A0A3Q0KPH5_SCHMA Loading...

Putative cadherin

AlphaFold DB , UniProt , Accession A0A3Q0KPH5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,498 aa.

						>A0A3Q0KPH5_SCHMA|A0A3Q0KPH5
MNVKHNPLHLMLQYTFKLTFMPLNHYYYNFFKFWILLHNCTYLLYFCDGCQSIANIKITEYSTEQYLNQSNFNVIHSSWPINPIHSQISINLSEILLQNLHLSIEDINEPLYFSDVEQSEPFIIRRRVSDDHSKFSWYELTSIIPVNRETICDIKRYPERISISQLCCSMTTTNTRTTATTTTNEANLHSNNMYTFNDPCCMFLGITISSKGTYFLRIDINDLNDNAPKFQELIFGKSLINKHDNYGRFIINIMENTPNGRWIPLPKATDLDEGLNAYVQYSIKLPNNEPVWNDYFKLIDNVQNSNIDTMSIPTKVYLNTDTNEFSALATDYNGPGLLILKTLDREEISSFLFILIATDMGQPFPRSSSLNIWLRILDENDNPPVFQKSEFHIEVNENKAGIPLLNIHVNDSDIDSNARLNYYLRTVNGMNQVSPEYLRNHIQLLPSVEGVSLRISQPLDYELQSHFIFEIVCVDQGHPPLSASAQIKITVLNMNDNAPIIKFYHHGQPLDSNYAQISIYENEFSNYSKENQILCHVHVTDLDNDLSSIQCSLEGDKSKQFELKEVSTNRLVQKRKIFDLTTIVLLDREVVPQHTLIVKCQDGTTESSLVGRNQLHIIVKDRNDNAPKFTQEHYIGHVKENTANTVVTLINSNAETVVNSYRNVIHATDLDIGSNAQVAYSLKSLYLPDYIKFVQNHTKENEQSLLLFLKNQTQSITISNDHDLMHNSTGEIVEHQTKRSISHDTQKDVENFYIDPISGQLRTRTELDCEQQNVYYFAVIAIDQAVPSEKRHSTTALVTVIVDDVNDNPPVLEQHHYIFDISEGLPRHSLIGQIKSTDADRDKENRYITYELRDVVNINASNFIYVEQNTGIIYSRKILDREEIQQIPFIIIARNEKPKSKLSSIHLNRTTFYDEASVTINIIDQNDNAPIMLHHGEILKYNGGTEGGLHSQTKQLQQLSVVDLKYNINVKDPFNSCIEFPYYFADADEKENAQIDVTLETNPYFEFRLDHTIICKISKEDPPVGQYTVHVVARDRPTDPTKSLKRRYAVRIHIVNEQVSTIESQTNLLKNIDFDSPPVSGDTHPTKWLQPVRLNGKDKKDLDFEKRYPKIIPSTNNAYQSYQSTSVLDESQQRYGLSTIAIVAALISVAGLLCLLLIGVVIAMKRIVPRTHNEVPVPLQKNNDKETDRSGISVWNMTSYPSPEYTLDMETGKIIEHHLGRPAGKYPNHSSDKSFGSDSANHLCHPSYLSTTHPLDISAQRFSPVSISSLYGSVKYMTQPLKIPTTFKTTTRQIPKDISVCDGSQIELTTKNNSTLSKSCDELRIVTGPMNNSCVQNQTTPSYEEQIALNTDHLYAMKCQTIKSKYQELNNKQNNNLISNEYNNQLNDKNEQRIWLLSNHKHDIKNNKPGILISPDDISDYQILEHMKYPSILRKSECYEIMPNSPKNNNNNANFNNLLHEQQDHSKITQKLTGYNNQSTTLLSTHSLKCLNVQKSFV
					

Structure Viewer

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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	31.1	Very low	32.5	Very low	234 Å²	234	147.6 Å²	147.6	100%	1.153	76%	0.759	S	S	*	*				0	128.5	0	-59.6	161.9	179.1	0	0	107.5
2	N	34.6	Very low	32.1	Very low	145 Å²	145	145.8 Å²	145.8	78%	0.775	75%	0.75	S	S	*	*			cis	-146.1	155.2	-9.4	-99.8	2.5	0	0	0	110
3	V	33.3	Very low	31.9	Very low	129 Å²	129	144.1 Å²	144.1	78%	0.782	74%	0.737	S	S	*	*			trans	21.6	107.4	146.9	-171.3	0	0	0	0	116.1
4	K	28.4	Very low	31.7	Very low	163 Å²	163	146.8 Å²	146.8	71%	0.709	74%	0.735	S	S	*	*			cis	73.9	120.5	43.8	-150.4	-162.4	-172.3	-144	0	114.4
5	H	34.6	Very low	31.5	Very low	140 Å²	140	144.6 Å²	144.6	65%	0.648	73%	0.733	S	S	*	*			trans	69.6	145.9	174.6	-58.9	-62	0	0	0	116.3
6	N	34.8	Very low	31.4	Very low	142 Å²	142	148.5 Å²	148.5	76%	0.759	74%	0.744	S	S	*	*			cis	-158	172.7	-6.7	-120.3	20.3	0	0	0	110.6
7	P	39.1	Very low	31.2	Very low	108 Å²	108	150.1 Å²	150.1	70%	0.701	75%	0.745	S	S	*	*			trans	-105.1	160.1	-169	39.7	-34.9	0	0	0	116.6
8	L	32.4	Very low	31.3	Very low	163 Å²	163	149.7 Å²	149.7	85%	0.853	75%	0.745	S	S	*	*			trans	-143.3	152.3	156.7	-101.2	98.2	0	0	0	106.2
9	H	32	Very low	31.6	Very low	142 Å²	142	147.7 Å²	147.7	66%	0.657	74%	0.742	S	S	*	*			cis	-153.8	135.4	-11.8	-148.5	-122.7	0	0	0	104.6
10	L	29.8	Very low	31.7	Very low	119 Å²	119	150.7 Å²	150.7	62%	0.623	75%	0.75	S	S	*	*				39.6	135.9	102	-80.6	83.8	0	0	0	115.5
11	M	27.1	Very low	31.8	Very low	139 Å²	139	151.2 Å²	151.2	69%	0.685	75%	0.753	S	S	*	*			cis	179	158.1	-2.4	-123.2	-175.5	169.5	0	0	110.8
12	L	28.6	Very low	32.4	Very low	125 Å²	125	146 Å²	146	65%	0.654	74%	0.736	S	S	*	*			trans	57.8	159.6	145.2	-56.2	176.4	0	0	0	118.8
13	Q	28.8	Very low	32.9	Very low	124 Å²	124	146.2 Å²	146.2	58%	0.579	74%	0.737	S	S	*	*			cis	-164.9	-179.5	-13.7	-120.8	171.2	-25.1	0	0	110.2
14	Y	29.2	Very low	33.4	Very low	182 Å²	182	146.9 Å²	146.9	71%	0.714	74%	0.736	S	S	*	*			trans	57.9	96.5	165.1	-60.6	-68	0	0	0	115.5
15	T	28.9	Very low	33.2	Very low	114 Å²	114	147.3 Å²	147.3	70%	0.699	74%	0.74	S	S	*	*				45	112	81.8	74.7	0	0	0	0	114.7
16	F	30.4	Very low	32.6	Very low	207 Å²	207	150.3 Å²	150.3	91%	0.908	75%	0.747	S	S	*	*				-155.3	173	121.1	-126.6	-91.3	0	0	0	110.8
17	K	27.4	Very low	32.1	Very low	175 Å²	175	151.1 Å²	151.1	76%	0.761	74%	0.741	S	S	*	*			trans	-72.9	155.3	-178.3	-126.9	176	-176.5	178.1	0	112
18	L	33.7	Very low	31.5	Very low	143 Å²	143	156.5 Å²	156.5	75%	0.749	75%	0.749	S	S	*	*			trans	82.9	109.4	154.5	-59.4	153.3	0	0	0	120.1
19	T	36.3	Very low	31.1	Very low	113 Å²	113	152.2 Å²	152.2	69%	0.693	73%	0.727	S	S	*	*			trans	59.1	123	133.8	56	0	0	0	0	123.6
20	F	34.4	Very low	30.9	Very low	206 Å²	206	152.2 Å²	152.2	90%	0.904	73%	0.725	S	S	*	*			trans	66.6	135.9	155.6	-68.7	-69.5	0	0	0	120.8
21	M	32.4	Very low	31.1	Very low	163 Å²	163	154.8 Å²	154.8	80%	0.803	73%	0.731	S	S	*	*			trans	-166.1	138.9	167.3	-133.1	-176.3	-172.3	0	0	114.1	L23	M21-L23 HydrophobicContact CE-CD1 4.05Å; M21-L23 HydrophobicContact SD-CD1 4.34Å
22	P	43.6	Very low	31	Very low	124 Å²	124	157.4 Å²	157.4	81%	0.805	74%	0.739	S	S	*	*			trans	-127.2	161.4	150.7	38.5	-28.2	0	0	0	112
23	L	47.1	Very low	31	Very low	149 Å²	149	160 Å²	160	78%	0.78	75%	0.745	S	S	*	*			trans	-155.3	115.3	-178.6	-104.2	169.3	0	0	0	114	M21	M21-L23 HydrophobicContact CE-CD1 4.05Å; M21-L23 HydrophobicContact SD-CD1 4.34Å
24	N	41.9	Very low	30.9	Very low	144 Å²	144	164 Å²	164	77%	0.77	76%	0.755	S	S	*	*			trans	-160.9	134.1	144.9	-147.7	-18.5	0	0	0	113
25	H	24.8	Very low	30.9	Very low	171 Å²	171	159.9 Å²	159.9	79%	0.792	74%	0.744	S	S	*	*			trans	64.3	167.7	163.9	-94.1	70.8	0	0	0	122.3
26	Y	22.7	Very low	30.7	Very low	203 Å²	203	161.3 Å²	161.3	80%	0.796	75%	0.747	S	S	*	*			trans	-45.7	149.1	176.3	-106.8	-121.2	0	0	0	114.4	Y28	Y26-Y28 PolarHBondContact O-N 2.89Å
27	Y	23.7	Very low	30.6	Very low	159 Å²	159	158.1 Å²	158.1	62%	0.624	74%	0.739	S	S	*	*				10.3	76.2	119.2	-98	-64.1	0	0	0	116.8	N29 F30	Y27-N29 WeakPolarHBondContact CD1-ND2 3.3Å; Y27-N29 VanDerWaalsContact CD1-OD1 3.29Å; Y27-N29 WeakPolarHBondContact CD1-OD1 2.85Å; Y27-N29 PolarHBondContact O-ND2 3.11Å; Y27-N29 VanDerWaalsContact O-ND2 3.11Å; Y27-F30 AromaticContact CE1-CE2 3.93Å; Y27-F30 HydrophobicContact CE1-CE2 3.93Å; Y27-F30 HydrophobicContact CE1-CZ 4.38Å
28	Y	26	Very low	30.6	Very low	222 Å²	222	157 Å²	157	87%	0.871	74%	0.736	S	S	*	*				-100.5	103	113.4	-105.3	-100.4	0	0	0	106.9	Y26	Y26-Y28 PolarHBondContact O-N 2.89Å
29	N	24.6	Very low	30.3	Very low	73 Å²	73	156.6 Å²	156.6	39%	0.39	73%	0.734	S	S	.	*				46	122.5	71.6	-65.7	-60.8	0	0	0	109.8	Y27	Y27-N29 WeakPolarHBondContact CD1-ND2 3.3Å; Y27-N29 VanDerWaalsContact CD1-OD1 3.29Å; Y27-N29 WeakPolarHBondContact CD1-OD1 2.85Å; Y27-N29 PolarHBondContact O-ND2 3.11Å; Y27-N29 VanDerWaalsContact O-ND2 3.11Å
30	F	28	Very low	29.9	Very low	142 Å²	142	155.9 Å²	155.9	62%	0.623	73%	0.733	S	S	*	*			cis	157.5	141.6	5.9	-119.1	-159.6	0	0	0	100.5	Y27	Y27-F30 AromaticContact CE1-CE2 3.93Å; Y27-F30 HydrophobicContact CE1-CE2 3.93Å; Y27-F30 HydrophobicContact CE1-CZ 4.38Å
31	F	32.7	Very low	29.9	Very low	172 Å²	172	151.7 Å²	151.7	75%	0.754	72%	0.724	S	S	*	*			trans	61	125.4	-179.9	-55.1	-75.9	0	0	0	114.5
32	K	26.5	Very low	29.6	Very low	194 Å²	194	154 Å²	154	84%	0.843	73%	0.725	S	S	*	*			cis	-130.5	144.2	20.9	-65	168.3	-175.3	171.1	0	108.4
33	F	27.6	Very low	28.8	Very low	180 Å²	180	154.9 Å²	154.9	79%	0.789	72%	0.723	S	S	*	*			cis	51	60.6	7	-120.6	-67.7	0	0	0	115.3
34	W	26.6	Very low	28	Very low	209 Å²	209	154.3 Å²	154.3	79%	0.792	72%	0.72	S	S	*	*				-128.1	124.6	125.4	-115.2	52.8	0	0	0	105.1
35	I	28.8	Very low	27.4	Very low	95 Å²	95	157.5 Å²	157.5	49%	0.487	72%	0.723	S	S	.	*				61.3	88.1	97.6	-67.7	-171.8	0	0	0	108.7
36	L	26.4	Very low	27.5	Very low	144 Å²	144	157.9 Å²	157.9	75%	0.754	72%	0.722	S	S	*	*				87.5	179.1	91.7	-82.8	164.3	0	0	0	110.6	H38	L36-H38 PolarHBondContact O-N 3.49Å
37	L	28.1	Very low	27.9	Very low	140 Å²	140	153 Å²	153	73%	0.733	72%	0.716	S	S	*	*			trans	-41.8	118.1	176.4	-62.2	70.9	0	0	0	111.5
38	H	27.2	Very low	28.5	Very low	152 Å²	152	153.9 Å²	153.9	70%	0.704	73%	0.732	S	S	*	*				-174.5	157.5	102.8	-97.6	-63.6	0	0	0	113.7	L36	L36-H38 PolarHBondContact O-N 3.49Å
39	N	27.5	Very low	29.2	Very low	133 Å²	133	144.6 Å²	144.6	71%	0.711	70%	0.703	S	S	*	*			trans	5.6	118.8	140.3	-35	-5.2	0	0	0	115.7
40	C	28.2	Very low	30.4	Very low	99 Å²	99	144.6 Å²	144.6	67%	0.669	71%	0.708	S	S	*	*				177.7	124.4	91.8	-96.9	0	0	0	0	113.1	Y42	C40-Y42 PolarHBondContact O-N 3.11Å; C40-Y42 VanDerWaalsContact O-N 3.11Å
41	T	33.7	Very low	31.4	Very low	117 Å²	117	145 Å²	145	72%	0.718	71%	0.712	S	S	*	*			trans	-21.7	99.9	133.9	48.8	0	0	0	0	115
42	Y	26.4	Very low	32.6	Very low	211 Å²	211	139.5 Å²	139.5	83%	0.827	70%	0.695	S	S	*	*			trans	-162.3	74.8	159.7	-100.6	-63.8	0	0	0	111.3	C40	C40-Y42 PolarHBondContact O-N 3.11Å; C40-Y42 VanDerWaalsContact O-N 3.11Å
43	L	26.7	Very low	34.1	Very low	143 Å²	143	130.7 Å²	130.7	75%	0.749	66%	0.657	S	S	*	*			trans	175.8	29.5	159.9	-102.1	161.7	0	0	0	111	F46	L43-F46 HydrophobicContact CD2-CD2 3.94Å
44	L	30	Very low	35.7	Very low	138 Å²	138	122.9 Å²	122.9	72%	0.723	63%	0.626	S	S	*	*				-35.6	141.5	109.1	-78.2	160.3	0	0	0	115
45	Y	28.6	Very low	37.4	Very low	211 Å²	211	117.5 Å²	117.5	83%	0.827	61%	0.613	S	S	*	*			trans	82.9	40.8	170.5	-60.4	-75.4	0	0	0	120.2
46	F	27.8	Very low	39.2	Very low	179 Å²	179	114 Å²	114	79%	0.785	60%	0.595	S	S	*	*			trans	-150.4	128.1	148.9	-75.8	-72.6	0	0	0	108.1	L43	L43-F46 HydrophobicContact CD2-CD2 3.94Å
47	C	31	Very low	41	Very low	99 Å²	99	114 Å²	114	67%	0.669	59%	0.588	S	S	*	*			cis	-140.6	152.1	-5.8	-70.6	0	0	0	0	110.3	G49	C47-G49 PolarHBondContact O-N 2.68Å
48	D	36.8	Very low	42.6	Very low	179 Å²	179	108 Å²	108	96%	0.957	56%	0.557	S	S	*	*	S	Bend	trans	-73.9	50	161.1	-67	-64.6	0	0	0	111.2
49	G	40.8	Very low	43.9	Very low	26 Å²	26	104 Å²	104	27%	0.268	54%	0.543	S	S	.	.			trans	-151.7	68.2	-150.4	0	0	0	0	0	117.8	C47 Q51	C47-G49 PolarHBondContact O-N 2.68Å; G49-Q51 PolarHBondContact O-N 3.01Å
50	C	48.8	Very low	45.3	Very low	73 Å²	73	98.8 Å²	98.8	49%	0.493	52%	0.515	S	S	.	.			trans	-81.4	53	142	-103.9	0	0	0	0	109.6	S52 C167	C50-S52 PolarHBondContact O-N 2.7Å; C50-C167 HydrophobicContact CB-CB 4.1Å; C50-C167 WeakPolarHBondContact CB-SG 3.08Å; C50-C167 WeakPolarHBondContact SG-CB 3.39Å; C50-C167 CovalentContact SG-SG 2.05Å; C50-C167 PolarHBondContact SG-SG 3.2Å
51	Q	48.9	Very low	46.3	Very low	151 Å²	151	101.9 Å²	101.9	71%	0.706	51%	0.513	S	S	*	.			trans	-82.8	106.4	170.5	-74.2	-172	-8.4	0	0	108.3	G49	G49-Q51 PolarHBondContact O-N 3.01Å
52	S	58	Low	47	Very low	57 Å²	57	98.2 Å²	98.2	40%	0.399	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	142.4	178.1	49	0	0	0	0	111.8	C50 F215	C50-S52 PolarHBondContact O-N 2.7Å; S52-F215 CarbonylContact C-O 3.42Å; S52-F215 WeakPolarHBondContact CA-O 3.45Å; S52-F215 WeakPolarHBondContact CB-O 3.21Å
53	I	57.3	Low	47.9	Very low	9 Å²	9	94.4 Å²	94.4	5%	0.046	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	-48.9	174.3	-50.8	161.2	0	0	0	109.7	I95 L96 N99 L100 I206 Y214 F215 L216	I53-I95 HydrophobicContact CB-CG2 4.48Å; I53-I95 HydrophobicContact CG2-CG2 3.49Å; I53-I95 VanDerWaalsContact CG2-CG2 3.49Å; I53-L96 HydrophobicContact CD1-CD2 4.12Å; I53-L96 HydrophobicContact CG2-CD2 4.43Å; I53-N99 HydrophobicContact CG2-CB 4.09Å; I53-N99 VanDerWaalsContact O-CB 3.26Å; I53-N99 WeakPolarHBondContact O-CB 3.42Å; I53-N99 PolarHBondContact O-ND2 2.94Å; I53-L100 HydrophobicContact CB-CD2 4.39Å; I53-L100 HydrophobicContact CG1-CD1 4.2Å; I53-L100 HydrophobicContact CG1-CD2 4.27Å; I53-L100 HydrophobicContact CG2-CD1 4.03Å; I53-L100 HydrophobicContact CG2-CD2 3.96Å; I53-L100 HydrophobicContact CG2-CG 3.84Å; I53-I206 HydrophobicContact CD1-CB 4.41Å; I53-I206 HydrophobicContact CD1-CD1 3.73Å; I53-Y214 HydrophobicContact CG1-CG 4.38Å; I53-F215 PolarHBondContact N-O 2.89Å; I53-L216 HydrophobicContact CD1-CB 4.31Å
54	A	62.1	Low	48.9	Very low	15 Å²	15	95.1 Å²	95.1	12%	0.124	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	161.5	-173.7	0	0	0	0	0	109.1	I95 L216 R217	A54-I95 HydrophobicContact CB-CG2 4.04Å; A54-L216 HydrophobicContact CB-CD1 3.79Å; A54-R217 PolarHBondContact O-N 3.33Å
55	N	62.9	Low	49.7	Very low	97 Å²	97	93.2 Å²	93.2	52%	0.519	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.3	164	-64.9	8.2	0	0	0	108.2	R217	N55-R217 CarbonylContact C-O 3.54Å; N55-R217 WeakPolarHBondContact CA-O 3.36Å
56	I	65.8	Low	50.1	Low	22 Å²	22	90 Å²	90	11%	0.113	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	131.7	167.1	-64.3	170.3	0	0	0	107.3	I58 I90 I95 L140 L216 R217 I218 D219	I56-I58 HydrophobicContact CG2-CG1 4.13Å; I56-I90 HydrophobicContact CD1-CD1 3.91Å; I56-I90 HydrophobicContact CD1-CG2 4.09Å; I56-I90 HydrophobicContact CG2-CD1 3.98Å; I56-I95 HydrophobicContact CD1-CD1 4.18Å; I56-L140 HydrophobicContact CD1-CD2 4.39Å; I56-L216 HydrophobicContact CD1-CD1 3.89Å; I56-L216 HydrophobicContact CD1-CD2 3.57Å; I56-L216 HydrophobicContact CD1-CG 3.9Å; I56-L216 HydrophobicContact CG1-CD1 4.21Å; I56-L216 HydrophobicContact CG1-CG 4.5Å; I56-R217 PolarHBondContact N-O 2.91Å; I56-I218 HydrophobicContact CB-CG1 4.43Å; I56-I218 CarbonylContact O-C 3.57Å; I56-I218 WeakPolarHBondContact O-CA 3.39Å; I56-D219 PolarHBondContact O-N 3.4Å
57	K	63.7	Low	50.9	Low	142 Å²	142	88.8 Å²	88.8	62%	0.617	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	128	165.8	-68.2	-151.2	164.4	-154.4	0	109.6	D219	K57-D219 HydrophobicContact CG-CB 4.3Å
58	I	62.7	Low	51.4	Low	16 Å²	16	90.6 Å²	90.6	8%	0.082	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.6	169.4	-59.3	172.3	0	0	0	107.2	I56 I88 F122 V146 I218 D219 N221	I56-I58 HydrophobicContact CG2-CG1 4.13Å; I58-I88 HydrophobicContact CD1-CD1 3.57Å; I58-I88 HydrophobicContact CG1-CD1 4.06Å; I58-I88 HydrophobicContact CG2-CD1 4Å; I58-F122 HydrophobicContact CD1-CE1 3.78Å; I58-F122 HydrophobicContact CD1-CZ 3.4Å; I58-F122 VanDerWaalsContact CD1-CZ 3.4Å; I58-V146 HydrophobicContact CD1-CG2 4.5Å; I58-V146 HydrophobicContact CG2-CG1 4.45Å; I58-V146 HydrophobicContact CG2-CG2 4.39Å; I58-I218 HydrophobicContact CD1-CG2 3.34Å; I58-I218 HydrophobicContact CG1-CG2 4Å; I58-D219 PolarHBondContact N-O 2.85Å; I58-N221 PolarHBondContact O-N 3.47Å; I58-N221 VanDerWaalsContact O-N 3.08Å; I58-N221 PolarHBondContact O-ND2 2.98Å
59	T	55.1	Low	51.3	Low	66 Å²	66	89.1 Å²	89.1	41%	0.405	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.8	164.8	-49.6	0	0	0	0	106.4	N221 L223	T59-N221 PolarHBondContact OG1-ND2 3.22Å; T59-L223 HydrophobicContact CG2-CD2 4.39Å
60	E	56.1	Low	51	Low	24 Å²	24	92.8 Å²	92.8	11%	0.112	48%	0.479	C	S	.	.			trans	-73	164.2	173.4	-74.6	171.3	-148.9	0	0	110.9	V146 N147 R148 L223	E60-V146 HydrophobicContact CG-CB 4.24Å; E60-V146 HydrophobicContact CG-CG1 4.33Å; E60-V146 WeakPolarHBondContact OE1-CG1 3.4Å; E60-N147 VanDerWaalsContact OE1-C 3.31Å; E60-N147 WeakPolarHBondContact OE1-CA 3.16Å; E60-N147 PolarHBondContact OE1-N 3.43Å; E60-N147 WeakPolarHBondContact OE2-CA 3.43Å; E60-R148 PolarHBondContact OE1-N 2.8Å; E60-L223 HydrophobicContact CB-CD1 3.7Å
61	Y	49.6	Very low	50.2	Low	164 Å²	164	96.2 Å²	96.2	64%	0.643	49%	0.492	S	S	*	.			trans	-128.8	114.7	178.9	-71.4	-79.5	0	0	0	109
62	S	48.9	Very low	49.3	Very low	40 Å²	40	98.3 Å²	98.3	28%	0.28	50%	0.499	S	S	.	.			trans	-72.6	151.4	174.7	77.1	0	0	0	0	111.2	E64 Q65	S62-E64 PolarHBondContact O-N 2.9Å; S62-E64 VanDerWaalsContact O-N 3.14Å; S62-Q65 PolarHBondContact O-N 3.18Å
63	T	44.7	Very low	47.7	Very low	131 Å²	131	103.5 Å²	103.5	80%	0.804	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.8	-179	-3.5	0	0	0	0	113.2	Y66	T63-Y66 WeakPolarHBondContact O-CB 3.47Å
64	E	46.8	Very low	46.4	Very low	158 Å²	158	109.1 Å²	109.1	74%	0.738	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-33.3	-179.5	-60.6	-167.8	142.2	0	0	113.1	S62 Y66 L67	S62-E64 PolarHBondContact O-N 2.9Å; S62-E64 VanDerWaalsContact O-N 3.14Å; E64-Y66 PolarHBondContact O-N 2.98Å; E64-L67 PolarHBondContact O-N 2.8Å
65	Q	47.9	Very low	44.7	Very low	98 Å²	98	115.4 Å²	115.4	46%	0.458	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-64.2	-23.6	176	-71.8	-177.4	6.7	0	0	112.5	S62 L67 N68	S62-Q65 PolarHBondContact O-N 3.18Å; Q65-L67 PolarHBondContact O-N 2.82Å; Q65-N68 PolarHBondContact O-N 2.89Å
66	Y	37.2	Very low	43	Very low	145 Å²	145	117.9 Å²	117.9	57%	0.569	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-64.9	-18.6	-179.5	-137.4	-83.3	0	0	0	113.8	T63 E64 P83	T63-Y66 WeakPolarHBondContact O-CB 3.47Å; E64-Y66 PolarHBondContact O-N 2.98Å; Y66-P83 PolarHBondContact OH-O 2.68Å
67	L	45	Very low	41.1	Very low	152 Å²	152	122.7 Å²	122.7	80%	0.796	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-88.4	-11	-177.4	-78.5	162.9	0	0	0	114.9	E64 Q65	E64-L67 PolarHBondContact O-N 2.8Å; Q65-L67 PolarHBondContact O-N 2.82Å
68	N	41.3	Very low	39.8	Very low	137 Å²	137	119.4 Å²	119.4	73%	0.733	63%	0.625	S	S	*	*			trans	-116.8	6.4	-169.3	-90.1	-39.1	0	0	0	115.6	Q65 S70	Q65-N68 PolarHBondContact O-N 2.89Å; N68-S70 PolarHBondContact O-N 2.88Å
69	Q	34.9	Very low	38.5	Very low	149 Å²	149	121.9 Å²	121.9	70%	0.696	63%	0.634	S	S	*	*			trans	-74.3	93.7	-176.7	-68	-164.7	4.3	0	0	113.2
70	S	33.7	Very low	37.5	Very low	103 Å²	103	124 Å²	124	72%	0.72	65%	0.649	S	S	*	*	S	Bend	trans	-138.1	-4.2	168.6	58.5	0	0	0	0	115.2	N68	N68-S70 PolarHBondContact O-N 2.88Å
71	N	30.9	Very low	36.7	Very low	144 Å²	144	126.7 Å²	126.7	77%	0.77	66%	0.663	S	S	*	*	S	Bend	trans	-143.5	13.8	-164.7	-95.5	-48.2	0	0	0	117.2
72	F	30.3	Very low	36.1	Very low	196 Å²	196	123.4 Å²	123.4	86%	0.86	66%	0.657	S	S	*	*			trans	-105.1	93.4	178.4	-84.5	-77.9	0	0	0	113.5	V74	F72-V74 PolarHBondContact O-N 3.08Å
73	N	25.7	Very low	35.7	Very low	166 Å²	166	125.7 Å²	125.7	89%	0.888	67%	0.67	S	S	*	*			trans	-76.7	102.4	161.8	-76.9	-36.5	0	0	0	109.5
74	V	28.7	Very low	35.7	Very low	126 Å²	126	125.7 Å²	125.7	76%	0.764	66%	0.664	S	S	*	*			trans	-121.3	124	164.4	-177.6	0	0	0	0	108.2	F72	F72-V74 PolarHBondContact O-N 3.08Å
75	I	27.3	Very low	35.6	Very low	147 Å²	147	123.8 Å²	123.8	75%	0.754	66%	0.655	S	S	*	*			trans	-88.2	145.3	-170.8	-71.1	174.3	0	0	0	110.7
76	H	26.4	Very low	35.8	Very low	149 Å²	149	122.6 Å²	122.6	69%	0.69	66%	0.658	S	S	*	*	S	Bend	trans	-29.9	149	172.9	-44	-81.3	0	0	0	115.4	S78	H76-S78 PolarHBondContact ND1-OG 3.04Å
77	S	27.6	Very low	36.7	Very low	123 Å²	123	118.9 Å²	118.9	86%	0.86	65%	0.645	S	S	*	*			cis	-90.5	99.8	38	55.9	0	0	0	0	115.5
78	S	36	Very low	37.6	Very low	73 Å²	73	112.3 Å²	112.3	51%	0.51	61%	0.611	S	S	.	*			trans	-86.3	128.3	176.4	56.8	0	0	0	0	111.4	H76	H76-S78 PolarHBondContact ND1-OG 3.04Å
79	W	34.9	Very low	38.9	Very low	69 Å²	69	107 Å²	107	26%	0.261	58%	0.584	S	S	.	*			trans	-99.7	130.5	153	-80.3	37.5	0	0	0	107.4	I81 I90 N91 E94 I95	W79-I81 VanDerWaalsContact C-N 3.32Å; W79-I81 PolarHBondContact O-N 2.68Å; W79-I90 HydrophobicContact CE3-CB 3.91Å; W79-I90 HydrophobicContact CE3-CG1 4.23Å; W79-I90 HydrophobicContact CE3-CG2 3.47Å; W79-I90 VanDerWaalsContact CE3-CG2 3.47Å; W79-I90 HydrophobicContact CZ3-CB 4.23Å; W79-I90 HydrophobicContact CZ3-CG2 3.42Å; W79-I90 VanDerWaalsContact CZ3-CG2 3.42Å; W79-N91 HydrophobicContact CE3-CB 4.28Å; W79-N91 VanDerWaalsContact CE3-N 3.31Å; W79-N91 HydrophobicContact CH2-CB 4.23Å; W79-N91 WeakPolarHBondContact CH2-O 3.36Å; W79-N91 HydrophobicContact CZ3-CB 3.88Å; W79-N91 WeakPolarHBondContact CZ3-O 3.21Å; W79-E94 HydrophobicContact CH2-CB 3.7Å; W79-E94 HydrophobicContact CH2-CG 4.16Å; W79-E94 HydrophobicContact CZ2-CB 3.78Å; W79-E94 HydrophobicContact CZ2-CG 3.7Å; W79-I95 HydrophobicContact CE3-CD1 4.29Å; W79-I95 HydrophobicContact CH2-CB 4.04Å; W79-I95 HydrophobicContact CH2-CD1 3.47Å; W79-I95 VanDerWaalsContact CH2-CD1 3.47Å; W79-I95 HydrophobicContact CH2-CG1 3.38Å; W79-I95 HydrophobicContact CZ2-CD1 4.17Å; W79-I95 HydrophobicContact CZ2-CG1 3.83Å; W79-I95 HydrophobicContact CZ3-CD1 3.52Å; W79-I95 HydrophobicContact CZ3-CG1 4Å
80	P	33.8	Very low	40.8	Very low	110 Å²	110	100.4 Å²	100.4	71%	0.714	55%	0.554	S	S	*	*			trans	-79.5	77.3	-164.2	32.1	-36.6	0	0	0	112.1	N82	P80-N82 PolarHBondContact O-N 2.73Å; P80-N82 VanDerWaalsContact O-N 3.07Å
81	I	40	Very low	42.8	Very low	80 Å²	80	97.8 Å²	97.8	41%	0.41	53%	0.532	S	S	.	.			trans	-58.7	112.9	163.1	-63.4	167.3	0	0	0	107.1	W79 P83 I88	W79-I81 VanDerWaalsContact C-N 3.32Å; W79-I81 PolarHBondContact O-N 2.68Å; I81-P83 WeakPolarHBondContact O-CD 3.34Å; I81-I88 HydrophobicContact CD1-CG2 4.41Å; I81-I88 HydrophobicContact CG1-CG2 4.39Å
82	N	36	Very low	45.2	Very low	96 Å²	96	90.9 Å²	90.9	51%	0.513	50%	0.495	S	S	.	.			trans	-74.1	108.4	-177.4	-172.7	-7.6	0	0	0	109.3	P80 I84	P80-N82 PolarHBondContact O-N 2.73Å; P80-N82 VanDerWaalsContact O-N 3.07Å; N82-I84 PolarHBondContact O-N 3.37Å
83	P	41.9	Very low	47.4	Very low	87 Å²	87	81.8 Å²	81.8	57%	0.565	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-5.8	-160.8	-22.6	34.9	0	0	0	116.2	Y66 I81 H85	Y66-P83 PolarHBondContact OH-O 2.68Å; I81-P83 WeakPolarHBondContact O-CD 3.34Å; P83-H85 PolarHBondContact O-N 3.04Å
84	I	43.3	Very low	49.7	Very low	131 Å²	131	77.1 Å²	77.1	67%	0.672	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.8	-173.5	-64.1	174.6	0	0	0	112.3	N82	N82-I84 PolarHBondContact O-N 3.37Å
85	H	45.3	Very low	51.8	Low	118 Å²	118	71.8 Å²	71.8	55%	0.546	40%	0.395	S	S	.	.	S	Bend	trans	-135.6	156.9	171.6	-63.3	-69.2	0	0	0	111.3	P83 Q87	P83-H85 PolarHBondContact O-N 3.04Å; H85-Q87 HydrophobicContact CB-CB 3.92Å; H85-Q87 HydrophobicContact CB-CG 3.82Å; H85-Q87 PolarHBondContact O-N 1.8Å
86	S	51.2	Low	54	Low	74 Å²	74	64.8 Å²	64.8	52%	0.517	36%	0.36	S	S	.	.	S	Bend	trans	-67.4	15.7	162	54.3	0	0	0	0	113.6	S142	S86-S142 PolarHBondContact O-OG 2.91Å
87	Q	56	Low	56.3	Low	66 Å²	66	61.6 Å²	61.6	31%	0.308	35%	0.347	S	S	.	.			trans	-88.5	106.5	173.3	-60.3	-174.5	11.7	0	0	107.5	H85 S142	H85-Q87 HydrophobicContact CB-CB 3.92Å; H85-Q87 HydrophobicContact CB-CG 3.82Å; H85-Q87 PolarHBondContact O-N 1.8Å; Q87-S142 WeakPolarHBondContact CA-OG 3.48Å; Q87-S142 VanDerWaalsContact CG-O 3.28Å; Q87-S142 WeakPolarHBondContact CG-O 3.33Å
88	I	64.9	Low	58.4	Low	14 Å²	14	60.9 Å²	60.9	7%	0.072	33%	0.33	C	S	.	.			trans	-54	147.8	163.4	-69.1	167.8	0	0	0	107.7	I58 I81 I90 F122 T141 S142 V146	I58-I88 HydrophobicContact CD1-CD1 3.57Å; I58-I88 HydrophobicContact CG1-CD1 4.06Å; I58-I88 HydrophobicContact CG2-CD1 4Å; I81-I88 HydrophobicContact CD1-CG2 4.41Å; I81-I88 HydrophobicContact CG1-CG2 4.39Å; I88-I90 HydrophobicContact CG2-CD1 3.56Å; I88-I90 HydrophobicContact CG2-CG1 3.76Å; I88-F122 HydrophobicContact CD1-CE1 3.77Å; I88-F122 HydrophobicContact CD1-CZ 4.25Å; I88-T141 WeakPolarHBondContact O-CA 3.47Å; I88-T141 VanDerWaalsContact O-CB 3.23Å; I88-T141 WeakPolarHBondContact O-CB 3.44Å; I88-T141 WeakPolarHBondContact O-CG2 3.37Å; I88-S142 PolarHBondContact N-OG 2.83Å; I88-S142 PolarHBondContact O-N 3.42Å; I88-V146 HydrophobicContact CD1-CG2 3.84Å
89	S	67.5	Low	60.1	Low	26 Å²	26	61.1 Å²	61.1	18%	0.182	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	117.6	174	175.5	0	0	0	0	109.4	E139 L140	S89-E139 PolarHBondContact OG-OE1 2.88Å; S89-L140 WeakPolarHBondContact CA-O 3.44Å
90	I	74.6	Confident	61.7	Low	11 Å²	11	59.4 Å²	59.4	6%	0.056	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	114.3	-166.5	-76.6	-176.5	0	0	0	107.9	I56 W79 I88 L92 I95 E139 L140	I56-I90 HydrophobicContact CD1-CD1 3.91Å; I56-I90 HydrophobicContact CD1-CG2 4.09Å; I56-I90 HydrophobicContact CG2-CD1 3.98Å; W79-I90 HydrophobicContact CE3-CB 3.91Å; W79-I90 HydrophobicContact CE3-CG1 4.23Å; W79-I90 HydrophobicContact CE3-CG2 3.47Å; W79-I90 VanDerWaalsContact CE3-CG2 3.47Å; W79-I90 HydrophobicContact CZ3-CB 4.23Å; W79-I90 HydrophobicContact CZ3-CG2 3.42Å; W79-I90 VanDerWaalsContact CZ3-CG2 3.42Å; I88-I90 HydrophobicContact CG2-CD1 3.56Å; I88-I90 HydrophobicContact CG2-CG1 3.76Å; I90-L92 PolarHBondContact O-N 3.38Å; I90-I95 HydrophobicContact CG2-CD1 3.99Å; I90-E139 CarbonylContact O-C 3.24Å; I90-E139 VanDerWaalsContact O-CA 3.3Å; I90-E139 WeakPolarHBondContact O-CA 3.3Å; I90-L140 HydrophobicContact CB-CB 4.17Å; I90-L140 HydrophobicContact CG2-CB 4.16Å; I90-L140 HydrophobicContact CG2-CD2 4.42Å; I90-L140 PolarHBondContact N-O 3.12Å; I90-L140 PolarHBondContact O-N 2.85Å
91	N	77	Confident	63.4	Low	47 Å²	47	62.4 Å²	62.4	25%	0.251	33%	0.326	S	S	.	.			trans	-64.9	67.1	179	177.3	20.3	0	0	0	113	W79 S93 E94 W137 Y138	W79-N91 HydrophobicContact CE3-CB 4.28Å; W79-N91 VanDerWaalsContact CE3-N 3.31Å; W79-N91 HydrophobicContact CH2-CB 4.23Å; W79-N91 WeakPolarHBondContact CH2-O 3.36Å; W79-N91 HydrophobicContact CZ3-CB 3.88Å; W79-N91 WeakPolarHBondContact CZ3-O 3.21Å; N91-S93 PolarHBondContact O-N 3.4Å; N91-E94 WeakPolarHBondContact ND2-CB 3.45Å; N91-E94 PolarHBondContact ND2-OE2 3.03Å; N91-E94 WeakPolarHBondContact O-CB 3.26Å; N91-E94 PolarHBondContact O-N 2.78Å; N91-W137 HydrophobicContact CB-CE3 4.25Å; N91-W137 HydrophobicContact CB-CZ3 4.03Å; N91-Y138 CarbonylContact C-O 3.41Å; N91-Y138 VanDerWaalsContact C-O 3.24Å
92	L	80.2	Confident	64.9	Low	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-45.5	-35	-174	-169.5	68.5	0	0	0	114.3	I90 E94 I95 L96 L111 I124 Y138 L140 I206 L216	I90-L92 PolarHBondContact O-N 3.38Å; L92-E94 PolarHBondContact O-N 2.77Å; L92-I95 PolarHBondContact O-N 3.14Å; L92-I95 VanDerWaalsContact O-N 3.16Å; L92-L96 HydrophobicContact CD2-CD1 4.28Å; L92-L96 HydrophobicContact CG-CD1 3.93Å; L92-L96 HydrophobicContact CG-CG 4.23Å; L92-L96 VanDerWaalsContact O-CG 3.25Å; L92-L96 WeakPolarHBondContact O-CG 3.43Å; L92-L96 PolarHBondContact O-N 3.23Å; L92-L111 HydrophobicContact CD2-CD1 3.85Å; L92-I124 HydrophobicContact CD2-CD1 3.47Å; L92-I124 VanDerWaalsContact CD2-CD1 3.47Å; L92-I124 HydrophobicContact CD2-CG1 3.74Å; L92-I124 HydrophobicContact CD2-CG2 4.43Å; L92-Y138 PolarHBondContact N-O 3.02Å; L92-L140 HydrophobicContact CB-CB 4.36Å; L92-I206 HydrophobicContact CD1-CD1 3.78Å; L92-I206 HydrophobicContact CD2-CD1 3.87Å; L92-I206 HydrophobicContact CD2-CG2 4.41Å; L92-I206 HydrophobicContact CG-CD1 4.35Å; L92-L216 HydrophobicContact CD1-CD2 3.98Å
93	S	76.7	Confident	66.6	Low	5 Å²	5	56.9 Å²	56.9	4%	0.035	30%	0.301	C	S	.	.	H	α-helix	trans	-55.4	-32.5	173.6	-81.2	0	0	0	0	114.3	N91 L97 I107 W137 Y138	N91-S93 PolarHBondContact O-N 3.4Å; S93-L97 WeakPolarHBondContact O-CB 3.37Å; S93-L97 VanDerWaalsContact O-CG 3.31Å; S93-L97 WeakPolarHBondContact O-CG 3.05Å; S93-L97 PolarHBondContact O-N 2.81Å; S93-I107 WeakPolarHBondContact OG-CG2 3.28Å; S93-W137 VanDerWaalsContact OG-CA 3.32Å; S93-W137 WeakPolarHBondContact OG-CA 3.33Å; S93-Y138 PolarHBondContact N-O 3.22Å; S93-Y138 PolarHBondContact OG-N 2.79Å
94	E	74.7	Confident	68.1	Low	67 Å²	67	57 Å²	57	31%	0.313	30%	0.296	S	S	.	.	H	α-helix	trans	-74.7	-36.5	178.4	179.9	179.3	170.4	0	0	112.2	W79 N91 L92 Q98	W79-E94 HydrophobicContact CH2-CB 3.7Å; W79-E94 HydrophobicContact CH2-CG 4.16Å; W79-E94 HydrophobicContact CZ2-CB 3.78Å; W79-E94 HydrophobicContact CZ2-CG 3.7Å; N91-E94 WeakPolarHBondContact ND2-CB 3.45Å; N91-E94 PolarHBondContact ND2-OE2 3.03Å; N91-E94 WeakPolarHBondContact O-CB 3.26Å; N91-E94 PolarHBondContact O-N 2.78Å; L92-E94 PolarHBondContact O-N 2.77Å; E94-Q98 WeakPolarHBondContact O-CB 3.36Å; E94-Q98 VanDerWaalsContact O-CG 3.22Å; E94-Q98 WeakPolarHBondContact O-CG 3.45Å; E94-Q98 PolarHBondContact O-N 2.82Å; E94-Q98 PolarHBondContact OE1-NE2 2.81Å
95	I	73.5	Confident	69.6	Low	14 Å²	14	58.5 Å²	58.5	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-63.5	-43.9	170.2	-84.3	155.6	0	0	0	110	I53 A54 I56 W79 I90 L92 Q98 N99 L216	I53-I95 HydrophobicContact CB-CG2 4.48Å; I53-I95 HydrophobicContact CG2-CG2 3.49Å; I53-I95 VanDerWaalsContact CG2-CG2 3.49Å; A54-I95 HydrophobicContact CB-CG2 4.04Å; I56-I95 HydrophobicContact CD1-CD1 4.18Å; W79-I95 HydrophobicContact CE3-CD1 4.29Å; W79-I95 HydrophobicContact CH2-CB 4.04Å; W79-I95 HydrophobicContact CH2-CD1 3.47Å; W79-I95 VanDerWaalsContact CH2-CD1 3.47Å; W79-I95 HydrophobicContact CH2-CG1 3.38Å; W79-I95 HydrophobicContact CZ2-CD1 4.17Å; W79-I95 HydrophobicContact CZ2-CG1 3.83Å; W79-I95 HydrophobicContact CZ3-CD1 3.52Å; W79-I95 HydrophobicContact CZ3-CG1 4Å; I90-I95 HydrophobicContact CG2-CD1 3.99Å; L92-I95 PolarHBondContact O-N 3.14Å; L92-I95 VanDerWaalsContact O-N 3.16Å; I95-Q98 PolarHBondContact O-N 3.04Å; I95-N99 WeakPolarHBondContact O-CB 3.34Å; I95-N99 PolarHBondContact O-N 3.44Å; I95-L216 HydrophobicContact CG2-CD1 4.33Å
96	L	73.5	Confident	70.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.5	-40.2	179.9	-65.8	170.8	0	0	0	111.8	I53 L92 L100 L102 I107 L111 I208	I53-L96 HydrophobicContact CD1-CD2 4.12Å; I53-L96 HydrophobicContact CG2-CD2 4.43Å; L92-L96 HydrophobicContact CD2-CD1 4.28Å; L92-L96 HydrophobicContact CG-CD1 3.93Å; L92-L96 HydrophobicContact CG-CG 4.23Å; L92-L96 VanDerWaalsContact O-CG 3.25Å; L92-L96 WeakPolarHBondContact O-CG 3.43Å; L92-L96 PolarHBondContact O-N 3.23Å; L96-L100 HydrophobicContact CD2-CD1 3.48Å; L96-L100 VanDerWaalsContact CD2-CD1 3.48Å; L96-L100 WeakPolarHBondContact O-CB 3.36Å; L96-L100 PolarHBondContact O-N 2.97Å; L96-L102 HydrophobicContact CB-CD1 3.95Å; L96-L102 HydrophobicContact CD2-CD1 4.49Å; L96-I107 HydrophobicContact CB-CD1 3.98Å; L96-L111 HydrophobicContact CD1-CD1 3.47Å; L96-L111 VanDerWaalsContact CD1-CD1 3.47Å; L96-L111 HydrophobicContact CD1-CD2 4.08Å; L96-L111 HydrophobicContact CD1-CG 4.41Å; L96-I208 HydrophobicContact CD2-CD1 4.34Å
97	L	74.1	Confident	72	Confident	82 Å²	82	51 Å²	51	43%	0.429	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-52.5	172	-82.9	170.6	0	0	0	111.8	S93 I107	S93-L97 WeakPolarHBondContact O-CB 3.37Å; S93-L97 VanDerWaalsContact O-CG 3.31Å; S93-L97 WeakPolarHBondContact O-CG 3.05Å; S93-L97 PolarHBondContact O-N 2.81Å; L97-I107 HydrophobicContact CB-CD1 4.27Å; L97-I107 HydrophobicContact CD2-CD1 3.68Å; L97-I107 HydrophobicContact CG-CD1 3.55Å
98	Q	72.2	Confident	72.8	Confident	108 Å²	108	50.4 Å²	50.4	51%	0.505	26%	0.257	S	S	.	.	H	α-helix	trans	-70.3	-42.9	-170.7	-71.3	173.4	13.9	0	0	112.1	E94 I95	E94-Q98 WeakPolarHBondContact O-CB 3.36Å; E94-Q98 VanDerWaalsContact O-CG 3.22Å; E94-Q98 WeakPolarHBondContact O-CG 3.45Å; E94-Q98 PolarHBondContact O-N 2.82Å; E94-Q98 PolarHBondContact OE1-NE2 2.81Å; I95-Q98 PolarHBondContact O-N 3.04Å
99	N	70.5	Confident	73.3	Confident	78 Å²	78	52.3 Å²	52.3	42%	0.417	27%	0.265	S	S	.	.	H	α-helix	trans	-102	-17.7	-165.4	-63.4	10.3	0	0	0	114.6	I53 I95	I53-N99 HydrophobicContact CG2-CB 4.09Å; I53-N99 VanDerWaalsContact O-CB 3.26Å; I53-N99 WeakPolarHBondContact O-CB 3.42Å; I53-N99 PolarHBondContact O-ND2 2.94Å; I95-N99 WeakPolarHBondContact O-CB 3.34Å; I95-N99 PolarHBondContact O-N 3.44Å
100	L	69	Low	73.7	Confident	34 Å²	34	53.4 Å²	53.4	18%	0.178	27%	0.272	C	S	.	.	H	α-helix	trans	-112.2	0	-177.7	-56.3	-179.9	0	0	0	113.9	I53 L96 L102 Y214	I53-L100 HydrophobicContact CB-CD2 4.39Å; I53-L100 HydrophobicContact CG1-CD1 4.2Å; I53-L100 HydrophobicContact CG1-CD2 4.27Å; I53-L100 HydrophobicContact CG2-CD1 4.03Å; I53-L100 HydrophobicContact CG2-CD2 3.96Å; I53-L100 HydrophobicContact CG2-CG 3.84Å; L96-L100 HydrophobicContact CD2-CD1 3.48Å; L96-L100 VanDerWaalsContact CD2-CD1 3.48Å; L96-L100 WeakPolarHBondContact O-CB 3.36Å; L96-L100 PolarHBondContact O-N 2.97Å; L100-L102 HydrophobicContact CB-CD1 3.73Å; L100-L102 HydrophobicContact CB-CG 3.71Å; L100-L102 HydrophobicContact CD1-CD1 3.78Å; L100-L102 HydrophobicContact CG-CD1 4.38Å; L100-L102 PolarHBondContact O-N 2.87Å; L100-L102 VanDerWaalsContact O-N 3.12Å; L100-Y214 HydrophobicContact CD1-CD1 3.82Å; L100-Y214 HydrophobicContact CD1-CD2 3.72Å; L100-Y214 HydrophobicContact CD1-CE1 3.93Å; L100-Y214 HydrophobicContact CD1-CE2 3.83Å; L100-Y214 HydrophobicContact CD1-CG 3.69Å; L100-Y214 HydrophobicContact CD2-CD1 3.54Å; L100-Y214 HydrophobicContact CD2-CE1 3.66Å; L100-Y214 HydrophobicContact CD2-CG 4.18Å; L100-Y214 HydrophobicContact CG-CD1 4.29Å; L100-Y214 HydrophobicContact CG-CE1 4.25Å
101	H	68.7	Low	73.8	Confident	172 Å²	172	53.7 Å²	53.7	80%	0.796	27%	0.273	S	S	*	.			trans	51.5	31.9	-176.6	-57.3	-39.4	0	0	0	114
102	L	71.1	Confident	73.8	Confident	13 Å²	13	57.8 Å²	57.8	7%	0.068	29%	0.286	C	S	.	.			trans	-69.6	141.3	179.4	-68.2	164.4	0	0	0	110.8	L96 L100 D106 I107 I208 K211	L96-L102 HydrophobicContact CB-CD1 3.95Å; L96-L102 HydrophobicContact CD2-CD1 4.49Å; L100-L102 HydrophobicContact CB-CD1 3.73Å; L100-L102 HydrophobicContact CB-CG 3.71Å; L100-L102 HydrophobicContact CD1-CD1 3.78Å; L100-L102 HydrophobicContact CG-CD1 4.38Å; L100-L102 PolarHBondContact O-N 2.87Å; L100-L102 VanDerWaalsContact O-N 3.12Å; L102-D106 HydrophobicContact CB-CB 4.21Å; L102-D106 HydrophobicContact CD2-CB 3.94Å; L102-I107 HydrophobicContact CB-CD1 3.83Å; L102-I107 HydrophobicContact CB-CG1 3.88Å; L102-I107 HydrophobicContact CD1-CD1 4.23Å; L102-I107 HydrophobicContact CD1-CG1 4.07Å; L102-I208 HydrophobicContact CD1-CD1 3.34Å; L102-I208 HydrophobicContact CD2-CD1 4.17Å; L102-I208 HydrophobicContact CG-CD1 4.42Å; L102-K211 HydrophobicContact CD2-CD 4.07Å; L102-K211 HydrophobicContact CD2-CG 3.68Å
103	S	72.9	Confident	73.7	Confident	47 Å²	47	59.5 Å²	59.5	33%	0.329	29%	0.294	S	S	.	.			trans	-72.8	162.6	171.1	73.6	0	0	0	0	111.2	E105 D106 I107	S103-E105 PolarHBondContact O-N 2.78Å; S103-E105 PolarHBondContact OG-N 2.81Å; S103-D106 WeakPolarHBondContact CB-OD2 3.46Å; S103-D106 PolarHBondContact N-OD2 2.82Å; S103-D106 PolarHBondContact O-N 3.25Å; S103-D106 PolarHBondContact OG-N 2.84Å; S103-D106 VanDerWaalsContact OG-N 3.17Å; S103-D106 PolarHBondContact OG-OD1 2.92Å; S103-D106 PolarHBondContact OG-OD2 2.87Å; S103-I107 PolarHBondContact O-N 3.19Å; S103-I107 VanDerWaalsContact O-N 3.13Å
104	I	73	Confident	73.6	Confident	91 Å²	91	62 Å²	62	47%	0.467	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-26.7	172.8	-69.6	157.4	0	0	0	111.4	N108 F135	I104-N108 PolarHBondContact O-N 2.93Å; I104-N108 PolarHBondContact O-ND2 3.18Å; I104-F135 HydrophobicContact CB-CE1 4.35Å; I104-F135 HydrophobicContact CD1-CE1 4.11Å; I104-F135 HydrophobicContact CD1-CZ 3.98Å; I104-F135 HydrophobicContact CG1-CE1 3.99Å; I104-F135 HydrophobicContact CG1-CZ 4.33Å; I104-F135 HydrophobicContact CG2-CD1 4.29Å; I104-F135 HydrophobicContact CG2-CE1 3.43Å; I104-F135 VanDerWaalsContact CG2-CE1 3.43Å; I104-F135 HydrophobicContact CG2-CZ 3.69Å
105	E	74.4	Confident	73.4	Confident	162 Å²	162	61.6 Å²	61.6	76%	0.757	31%	0.311	S	S	*	.	H	α-helix	trans	-74.2	-44.3	176.5	-61.2	-178	148.8	0	0	110.3	S103 I107 N108	S103-E105 PolarHBondContact O-N 2.78Å; S103-E105 PolarHBondContact OG-N 2.81Å; E105-I107 VanDerWaalsContact C-N 3.3Å; E105-I107 PolarHBondContact O-N 2.04Å; E105-N108 PolarHBondContact O-N 2.8Å; E105-N108 VanDerWaalsContact O-N 3.13Å
106	D	73.7	Confident	73	Confident	26 Å²	26	65.8 Å²	65.8	14%	0.139	34%	0.337	C	S	.	.	H	α-helix	trans	-60.7	-36.1	176.6	-52	-46.6	0	0	0	112.7	L102 S103 E109 K211	L102-D106 HydrophobicContact CB-CB 4.21Å; L102-D106 HydrophobicContact CD2-CB 3.94Å; S103-D106 WeakPolarHBondContact CB-OD2 3.46Å; S103-D106 PolarHBondContact N-OD2 2.82Å; S103-D106 PolarHBondContact O-N 3.25Å; S103-D106 PolarHBondContact OG-N 2.84Å; S103-D106 VanDerWaalsContact OG-N 3.17Å; S103-D106 PolarHBondContact OG-OD1 2.92Å; S103-D106 PolarHBondContact OG-OD2 2.87Å; D106-E109 WeakPolarHBondContact O-CB 3.2Å; D106-E109 PolarHBondContact O-N 3.34Å; D106-K211 WeakPolarHBondContact OD1-CE 3.25Å; D106-K211 IonicContact OD1-NZ 2.79Å; D106-K211 PolarHBondContact OD1-NZ 3.14Å; D106-K211 WeakPolarHBondContact OD2-CE 3.4Å; D106-K211 IonicContact OD2-NZ 2.59Å; D106-K211 PolarHBondContact OD2-NZ 3.17Å
107	I	73.6	Confident	72.8	Confident	9 Å²	9	74 Å²	74	5%	0.046	38%	0.376	C	S	.	.	H	α-helix	trans	-81.5	-12.3	179.6	-71.8	176.6	0	0	0	112.9	S93 L96 L97 L102 S103 E105 E109 Y138	S93-I107 WeakPolarHBondContact OG-CG2 3.28Å; L96-I107 HydrophobicContact CB-CD1 3.98Å; L97-I107 HydrophobicContact CB-CD1 4.27Å; L97-I107 HydrophobicContact CD2-CD1 3.68Å; L97-I107 HydrophobicContact CG-CD1 3.55Å; L102-I107 HydrophobicContact CB-CD1 3.83Å; L102-I107 HydrophobicContact CB-CG1 3.88Å; L102-I107 HydrophobicContact CD1-CD1 4.23Å; L102-I107 HydrophobicContact CD1-CG1 4.07Å; S103-I107 PolarHBondContact O-N 3.19Å; S103-I107 VanDerWaalsContact O-N 3.13Å; E105-I107 VanDerWaalsContact C-N 3.3Å; E105-I107 PolarHBondContact O-N 2.04Å; I107-E109 VanDerWaalsContact C-N 3.32Å; I107-Y138 WeakPolarHBondContact O-CE2 3.29Å
108	N	73.6	Confident	72.5	Confident	52 Å²	52	72.6 Å²	72.6	28%	0.278	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-7.2	171.1	-84.5	-68.3	0	0	0	113.4	I104 E105 R126 S136	I104-N108 PolarHBondContact O-N 2.93Å; I104-N108 PolarHBondContact O-ND2 3.18Å; E105-N108 PolarHBondContact O-N 2.8Å; E105-N108 VanDerWaalsContact O-N 3.13Å; N108-R126 PolarHBondContact O-NH2 3.3Å; N108-S136 PolarHBondContact OD1-OG 3.18Å
109	E	75.2	Confident	72.5	Confident	54 Å²	54	67.7 Å²	67.7	25%	0.252	35%	0.345	S	S	.	.	S	Bend	trans	-64.5	158.1	167.5	-66.2	-160.7	130.4	0	0	112.3	D106 I107 L111 Y138 I208 S209 S210	D106-E109 WeakPolarHBondContact O-CB 3.2Å; D106-E109 PolarHBondContact O-N 3.34Å; I107-E109 VanDerWaalsContact C-N 3.32Å; E109-L111 PolarHBondContact O-N 2.85Å; E109-Y138 WeakPolarHBondContact O-CE2 3.21Å; E109-Y138 PolarHBondContact O-OH 3.38Å; E109-I208 WeakPolarHBondContact OE2-CG2 3.44Å; E109-S209 PolarHBondContact OE2-N 3.04Å; E109-S210 VanDerWaalsContact CD-OG 3.26Å; E109-S210 WeakPolarHBondContact OE1-CB 3.35Å; E109-S210 WeakPolarHBondContact OE2-CB 3.37Å; E109-S210 PolarHBondContact OE2-N 3.4Å; E109-S210 PolarHBondContact OE2-OG 3.11Å
110	P	75.1	Confident	72.5	Confident	50 Å²	50	68.1 Å²	68.1	33%	0.325	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-66.2	126.4	169.4	28.1	-33.9	0	0	0	111.6	Y112 Y138	P110-Y112 HydrophobicContact CB-CE1 4.45Å; P110-Y112 HydrophobicContact CB-CE2 3.71Å; P110-Y112 WeakPolarHBondContact CB-OH 3.39Å; P110-Y112 HydrophobicContact CG-CE2 3.75Å; P110-Y112 WeakPolarHBondContact CG-OH 3.07Å; P110-Y138 VanDerWaalsContact CA-OH 3.31Å; P110-Y138 WeakPolarHBondContact CA-OH 3.42Å
111	L	77.4	Confident	72.7	Confident	16 Å²	16	66.7 Å²	66.7	8%	0.084	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	142.1	164.1	-63.6	-174.3	0	0	0	110.5	L92 L96 E109 I124 Y138 I206 I208	L92-L111 HydrophobicContact CD2-CD1 3.85Å; L96-L111 HydrophobicContact CD1-CD1 3.47Å; L96-L111 VanDerWaalsContact CD1-CD1 3.47Å; L96-L111 HydrophobicContact CD1-CD2 4.08Å; L96-L111 HydrophobicContact CD1-CG 4.41Å; E109-L111 PolarHBondContact O-N 2.85Å; L111-I124 HydrophobicContact CB-CG2 4.34Å; L111-I124 HydrophobicContact CD1-CG2 4.41Å; L111-Y138 HydrophobicContact CB-CD1 4.19Å; L111-Y138 HydrophobicContact CB-CE1 4.04Å; L111-Y138 HydrophobicContact CB-CE2 4.45Å; L111-Y138 HydrophobicContact CB-CG 4.46Å; L111-Y138 HydrophobicContact CD1-CD1 3.89Å; L111-Y138 HydrophobicContact CD1-CD2 3.46Å; L111-Y138 VanDerWaalsContact CD1-CD2 3.46Å; L111-Y138 HydrophobicContact CD1-CE1 4.41Å; L111-Y138 HydrophobicContact CD1-CE2 4.03Å; L111-Y138 HydrophobicContact CD1-CG 3.38Å; L111-Y138 HydrophobicContact CG-CD1 4.12Å; L111-Y138 HydrophobicContact CG-CD2 3.69Å; L111-Y138 HydrophobicContact CG-CE1 4.13Å; L111-Y138 HydrophobicContact CG-CE2 3.7Å; L111-Y138 HydrophobicContact CG-CG 3.9Å; L111-Y138 PolarHBondContact N-OH 2.98Å; L111-I206 HydrophobicContact CD1-CG2 4.31Å; L111-I206 HydrophobicContact CD2-CG2 4.16Å; L111-I208 HydrophobicContact CD2-CB 4.44Å; L111-I208 HydrophobicContact CD2-CD1 4.14Å; L111-I208 HydrophobicContact CD2-CG1 3.26Å
112	Y	77.4	Confident	73.2	Confident	134 Å²	134	58.7 Å²	58.7	53%	0.525	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	158.2	171.6	-55.6	-81.7	0	0	0	110	P110 I206 T207	P110-Y112 HydrophobicContact CB-CE1 4.45Å; P110-Y112 HydrophobicContact CB-CE2 3.71Å; P110-Y112 WeakPolarHBondContact CB-OH 3.39Å; P110-Y112 HydrophobicContact CG-CE2 3.75Å; P110-Y112 WeakPolarHBondContact CG-OH 3.07Å; Y112-I206 CarbonylContact O-C 3.42Å; Y112-I206 WeakPolarHBondContact O-CA 3.41Å; Y112-T207 PolarHBondContact N-O 2.81Å; Y112-T207 VanDerWaalsContact N-O 3.13Å; Y112-T207 PolarHBondContact O-N 2.56Å
113	F	78.3	Confident	73.6	Confident	36 Å²	36	60.3 Å²	60.3	16%	0.158	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	141.9	157	-63.4	-69.3	0	0	0	109.5	D115 V116 I124 L140 L204 G205	F113-D115 VanDerWaalsContact C-N 3.28Å; F113-V116 HydrophobicContact CB-CG2 4.24Å; F113-I124 HydrophobicContact CD1-CD1 4Å; F113-I124 HydrophobicContact CE1-CD1 3.47Å; F113-I124 VanDerWaalsContact CE1-CD1 3.47Å; F113-I124 HydrophobicContact CE1-CG1 3.76Å; F113-I124 HydrophobicContact CE2-CB 4.26Å; F113-I124 HydrophobicContact CE2-CD1 4.41Å; F113-I124 HydrophobicContact CE2-CG1 4.22Å; F113-I124 HydrophobicContact CZ-CB 4.04Å; F113-I124 HydrophobicContact CZ-CD1 3.75Å; F113-I124 HydrophobicContact CZ-CG1 3.52Å; F113-I124 VanDerWaalsContact CZ-N 3.33Å; F113-L140 HydrophobicContact CE1-CD1 4.35Å; F113-L140 HydrophobicContact CZ-CD1 4.29Å; F113-L204 HydrophobicContact CD1-CD1 4.28Å; F113-L204 HydrophobicContact CD1-CG 4.17Å; F113-L204 HydrophobicContact CE1-CD1 3.66Å; F113-L204 HydrophobicContact CE1-CD2 3.96Å; F113-L204 HydrophobicContact CE1-CG 3.77Å; F113-L204 HydrophobicContact CZ-CD1 4.42Å; F113-G205 CarbonylContact C-O 3.53Å; F113-G205 VanDerWaalsContact CA-O 3.26Å; F113-G205 WeakPolarHBondContact CA-O 3.25Å
114	S	74.3	Confident	73.9	Confident	56 Å²	56	59.7 Å²	59.7	39%	0.392	30%	0.3	S	S	.	.	S	Bend	trans	-72.8	-26	168.1	60	0	0	0	0	112.4	G205	S114-G205 PolarHBondContact N-O 2.97Å; S114-G205 WeakPolarHBondContact OG-CA 3.39Å
115	D	70.3	Confident	74.3	Confident	60 Å²	60	59.1 Å²	59.1	32%	0.321	29%	0.293	S	S	.	.			trans	-145.2	109.8	178.5	-165.4	-41.2	0	0	0	109.4	F113 E117 Q118 S119	F113-D115 VanDerWaalsContact C-N 3.28Å; D115-E117 PolarHBondContact OD1-N 3.21Å; D115-Q118 HydrophobicContact CB-CB 4.12Å; D115-Q118 HydrophobicContact CB-CG 4.3Å; D115-Q118 VanDerWaalsContact CG-CG 3.46Å; D115-Q118 WeakPolarHBondContact OD1-CG 3.32Å; D115-Q118 PolarHBondContact OD1-N 3.38Å; D115-Q118 VanDerWaalsContact OD1-N 3.09Å; D115-Q118 VanDerWaalsContact OD2-CD 3.24Å; D115-Q118 WeakPolarHBondContact OD2-CG 3.42Å; D115-Q118 PolarHBondContact OD2-NE2 2.78Å; D115-S119 WeakPolarHBondContact O-CB 3.43Å; D115-S119 PolarHBondContact O-N 3.13Å; D115-S119 PolarHBondContact O-OG 2.66Å
116	V	65.3	Low	74.6	Confident	101 Å²	101	57.1 Å²	57.1	61%	0.612	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-38.4	-172	179.8	0	0	0	0	111.3	F113 S119	F113-V116 HydrophobicContact CB-CG2 4.24Å; V116-S119 WeakPolarHBondContact CA-OG 3.35Å; V116-S119 PolarHBondContact O-N 2.7Å; V116-S119 PolarHBondContact O-OG 3.03Å
117	E	69.4	Low	74.8	Confident	173 Å²	173	61.1 Å²	61.1	81%	0.808	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-38.1	-178.1	-63.6	-175.1	177.3	0	0	110.9	D115 S119	D115-E117 PolarHBondContact OD1-N 3.21Å; E117-S119 PolarHBondContact O-N 3.23Å
118	Q	67.2	Low	74.5	Confident	53 Å²	53	65.5 Å²	65.5	25%	0.248	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-29	173.2	-66.4	-173	32.4	0	0	112.6	D115 E120 R160	D115-Q118 HydrophobicContact CB-CB 4.12Å; D115-Q118 HydrophobicContact CB-CG 4.3Å; D115-Q118 VanDerWaalsContact CG-CG 3.46Å; D115-Q118 WeakPolarHBondContact OD1-CG 3.32Å; D115-Q118 PolarHBondContact OD1-N 3.38Å; D115-Q118 VanDerWaalsContact OD1-N 3.09Å; D115-Q118 VanDerWaalsContact OD2-CD 3.24Å; D115-Q118 WeakPolarHBondContact OD2-CG 3.42Å; D115-Q118 PolarHBondContact OD2-NE2 2.78Å; Q118-E120 VanDerWaalsContact C-N 3.35Å; Q118-E120 PolarHBondContact O-N 3.03Å; Q118-R160 PolarHBondContact O-NH2 2.61Å
119	S	71.8	Confident	74.1	Confident	5 Å²	5	65 Å²	65	4%	0.035	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.4	-176	70.1	0	0	0	0	116	D115 V116 E117 F122	D115-S119 WeakPolarHBondContact O-CB 3.43Å; D115-S119 PolarHBondContact O-N 3.13Å; D115-S119 PolarHBondContact O-OG 2.66Å; V116-S119 WeakPolarHBondContact CA-OG 3.35Å; V116-S119 PolarHBondContact O-N 2.7Å; V116-S119 PolarHBondContact O-OG 3.03Å; E117-S119 PolarHBondContact O-N 3.23Å; S119-F122 WeakPolarHBondContact O-CA 3.1Å; S119-F122 WeakPolarHBondContact O-CB 3.43Å; S119-F122 PolarHBondContact O-N 2.83Å
120	E	70.2	Confident	73.7	Confident	86 Å²	86	70.2 Å²	70.2	40%	0.402	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	136.4	175.8	-74.6	-154.9	140.8	0	0	112.3	Q118 R160	Q118-E120 VanDerWaalsContact C-N 3.35Å; Q118-E120 PolarHBondContact O-N 3.03Å; E120-R160 PolarHBondContact O-NH2 2.87Å
121	P	73.4	Confident	73.1	Confident	5 Å²	5	73.8 Å²	73.8	3%	0.032	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	cis	-90.2	14.9	12.5	36	-39.6	0	0	0	115.9	S142 I143 I144 V146	P121-S142 CarbonylContact O-C 3.59Å; P121-S142 WeakPolarHBondContact O-CA 3.3Å; P121-S142 WeakPolarHBondContact O-CB 3.26Å; P121-I143 VanDerWaalsContact O-CG1 3.3Å; P121-I143 WeakPolarHBondContact O-CG1 3.44Å; P121-I143 PolarHBondContact O-N 3.05Å; P121-I144 HydrophobicContact CB-CB 4.23Å; P121-I144 HydrophobicContact CB-CD1 4.1Å; P121-I144 HydrophobicContact CB-CG1 3.69Å; P121-V146 HydrophobicContact CG-CG2 4.16Å
122	F	79.3	Confident	72	Confident	4 Å²	4	82.4 Å²	82.4	2%	0.018	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	152	-170.5	-56.8	-90.3	0	0	0	114.3	I58 I88 S119 L140 T141 V146 M202 L204 I218	I58-F122 HydrophobicContact CD1-CE1 3.78Å; I58-F122 HydrophobicContact CD1-CZ 3.4Å; I58-F122 VanDerWaalsContact CD1-CZ 3.4Å; I88-F122 HydrophobicContact CD1-CE1 3.77Å; I88-F122 HydrophobicContact CD1-CZ 4.25Å; S119-F122 WeakPolarHBondContact O-CA 3.1Å; S119-F122 WeakPolarHBondContact O-CB 3.43Å; S119-F122 PolarHBondContact O-N 2.83Å; F122-L140 HydrophobicContact CB-CD1 3.94Å; F122-L140 HydrophobicContact CD1-CD2 4.34Å; F122-L140 HydrophobicContact CD1-CG 4.29Å; F122-T141 CarbonylContact C-O 3.55Å; F122-T141 WeakPolarHBondContact CA-O 3.22Å; F122-V146 HydrophobicContact CZ-CG2 4.14Å; F122-M202 HydrophobicContact CD2-SD 3.94Å; F122-M202 HydrophobicContact CE2-CE 3.79Å; F122-M202 HydrophobicContact CE2-SD 3.55Å; F122-M202 VanDerWaalsContact CE2-SD 3.55Å; F122-L204 HydrophobicContact CB-CD1 3.63Å; F122-L204 HydrophobicContact CD2-CD1 4.21Å; F122-L204 HydrophobicContact CG-CD1 4.11Å; F122-I218 HydrophobicContact CD1-CD1 4.5Å; F122-I218 HydrophobicContact CD2-CD1 4.19Å; F122-I218 HydrophobicContact CE1-CD1 4.26Å; F122-I218 HydrophobicContact CE2-CD1 3.96Å; F122-I218 HydrophobicContact CG-CD1 4.49Å; F122-I218 HydrophobicContact CZ-CD1 4.01Å; F122-I218 HydrophobicContact CZ-CG2 4.36Å
123	I	79.5	Confident	70.8	Confident	47 Å²	47	79.5 Å²	79.5	24%	0.241	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.8	177	54.1	159.3	0	0	0	111.7	R125 T141 I143	I123-R125 HydrophobicContact CD1-CG 4.39Å; I123-T141 WeakPolarHBondContact CG1-O 3.37Å; I123-T141 WeakPolarHBondContact CG1-OG1 3.3Å; I123-T141 PolarHBondContact N-O 2.83Å; I123-T141 PolarHBondContact O-N 2.77Å; I123-I143 HydrophobicContact CD1-CG2 3.48Å; I123-I143 VanDerWaalsContact CD1-CG2 3.48Å; I123-I143 HydrophobicContact CG1-CG2 3.91Å; I123-I143 HydrophobicContact CG2-CG2 4.33Å
124	I	80.1	Confident	69.7	Low	33 Å²	33	87 Å²	87	17%	0.169	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.8	174.9	-71.5	164.6	0	0	0	110.1	L92 L111 F113 Y138 E139 L140 I206	L92-I124 HydrophobicContact CD2-CD1 3.47Å; L92-I124 VanDerWaalsContact CD2-CD1 3.47Å; L92-I124 HydrophobicContact CD2-CG1 3.74Å; L92-I124 HydrophobicContact CD2-CG2 4.43Å; L111-I124 HydrophobicContact CB-CG2 4.34Å; L111-I124 HydrophobicContact CD1-CG2 4.41Å; F113-I124 HydrophobicContact CD1-CD1 4Å; F113-I124 HydrophobicContact CE1-CD1 3.47Å; F113-I124 VanDerWaalsContact CE1-CD1 3.47Å; F113-I124 HydrophobicContact CE1-CG1 3.76Å; F113-I124 HydrophobicContact CE2-CB 4.26Å; F113-I124 HydrophobicContact CE2-CD1 4.41Å; F113-I124 HydrophobicContact CE2-CG1 4.22Å; F113-I124 HydrophobicContact CZ-CB 4.04Å; F113-I124 HydrophobicContact CZ-CD1 3.75Å; F113-I124 HydrophobicContact CZ-CG1 3.52Å; F113-I124 VanDerWaalsContact CZ-N 3.33Å; I124-Y138 HydrophobicContact CG2-CD1 3.73Å; I124-Y138 HydrophobicContact CG2-CG 4.39Å; I124-E139 CarbonylContact C-O 3.6Å; I124-E139 WeakPolarHBondContact CA-O 3.45Å; I124-L140 HydrophobicContact CG1-CD1 3.85Å; I124-I206 HydrophobicContact CD1-CD1 4.49Å; I124-I206 HydrophobicContact CD1-CG1 3.98Å; I124-I206 HydrophobicContact CD1-CG2 4.29Å
125	R	81.4	Confident	69.2	Low	80 Å²	80	89.8 Å²	89.8	30%	0.302	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.2	177.9	-63.4	175.1	174.1	159.5	1.5	109.7	I123 Y138 E139 T141	I123-R125 HydrophobicContact CD1-CG 4.39Å; R125-Y138 CarbonylContact O-C 3.58Å; R125-Y138 WeakPolarHBondContact O-CA 3.48Å; R125-E139 HydrophobicContact CB-CB 4.4Å; R125-E139 PolarHBondContact N-O 2.89Å; R125-E139 PolarHBondContact O-N 3.12Å; R125-T141 VanDerWaalsContact CZ-OG1 3.31Å; R125-T141 PolarHBondContact NE-OG1 3.07Å; R125-T141 PolarHBondContact NH1-OG1 2.88Å
126	R	80	Confident	69.2	Low	120 Å²	120	87.6 Å²	87.6	45%	0.453	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	138.1	170	-164.2	176.2	-175.6	158.2	4.8	110.1	N108 S136 Y138	N108-R126 PolarHBondContact O-NH2 3.3Å; R126-S136 PolarHBondContact NE-OG 3Å; R126-S136 PolarHBondContact NH2-OG 3.33Å; R126-Y138 HydrophobicContact CB-CD1 3.95Å; R126-Y138 HydrophobicContact CB-CE1 3.59Å; R126-Y138 HydrophobicContact CG-CD1 4.15Å; R126-Y138 HydrophobicContact CG-CE1 3.64Å; R126-Y138 PolarHBondContact NH1-OH 2.76Å
127	R	77.3	Confident	69.7	Low	110 Å²	110	87.2 Å²	87.2	42%	0.415	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	154.6	176.3	-62	-69.1	-167.4	146.8	8.3	109.3	S136 W137 E139	R127-S136 CarbonylContact O-C 3.58Å; R127-S136 VanDerWaalsContact O-CA 3.3Å; R127-S136 WeakPolarHBondContact O-CA 3.42Å; R127-S136 VanDerWaalsContact O-CB 3.3Å; R127-S136 WeakPolarHBondContact O-CB 3.18Å; R127-W137 HydrophobicContact CB-CD2 3.63Å; R127-W137 HydrophobicContact CB-CE3 4.21Å; R127-W137 HydrophobicContact CB-CG 3.98Å; R127-W137 HydrophobicContact CB-CH2 4.36Å; R127-W137 HydrophobicContact CB-CZ2 3.78Å; R127-W137 HydrophobicContact CG-CD2 4.07Å; R127-W137 HydrophobicContact CG-CE3 4.17Å; R127-W137 HydrophobicContact CG-CH2 3.85Å; R127-W137 HydrophobicContact CG-CZ2 3.72Å; R127-W137 HydrophobicContact CG-CZ3 4.07Å; R127-W137 PolarHBondContact N-O 3.28Å; R127-W137 PolarHBondContact O-N 2.82Å; R127-E139 HydrophobicContact CG-CB 4.26Å; R127-E139 IonicContact CZ-OE2 3.51Å; R127-E139 IonicContact NE-OE2 3.2Å; R127-E139 PolarHBondContact NE-OE2 2.86Å; R127-E139 VanDerWaalsContact NH2-CD 3.3Å; R127-E139 IonicContact NH2-OE1 3.68Å; R127-E139 PolarHBondContact NH2-OE1 2.79Å; R127-E139 VanDerWaalsContact NH2-OE1 3.15Å; R127-E139 IonicContact NH2-OE2 3.5Å; R127-E139 PolarHBondContact NH2-OE2 2.86Å
128	V	68.3	Low	70.3	Confident	101 Å²	101	79.3 Å²	79.3	61%	0.612	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132	146.8	179.6	-174.9	0	0	0	0	107.3
129	S	65.4	Low	71	Confident	42 Å²	42	77.2 Å²	77.2	29%	0.294	37%	0.371	S	S	.	.			trans	-69.4	141.5	174.1	54.9	0	0	0	0	111.6	D131 F135	S129-D131 VanDerWaalsContact C-N 3.27Å; S129-D131 PolarHBondContact O-N 3.28Å; S129-D131 PolarHBondContact OG-O 2.76Å; S129-F135 PolarHBondContact N-O 2.63Å; S129-F135 PolarHBondContact OG-O 2.95Å
130	D	66.3	Low	71.4	Confident	163 Å²	163	77 Å²	77	87%	0.872	37%	0.37	S	S	*	.	S	Bend	trans	-64.1	-34.7	175.4	-62	-55.5	0	0	0	111.6
131	D	63.5	Low	71.7	Confident	124 Å²	124	73 Å²	73	66%	0.663	35%	0.351	S	S	*	.	S	Bend	trans	-67.3	128.4	164.5	-70.1	-41.9	0	0	0	110.2	S129 S133	S129-D131 VanDerWaalsContact C-N 3.27Å; S129-D131 PolarHBondContact O-N 3.28Å; S129-D131 PolarHBondContact OG-O 2.76Å; D131-S133 PolarHBondContact O-N 3.46Å
132	H	53.7	Low	71.7	Confident	197 Å²	197	72.8 Å²	72.8	91%	0.912	35%	0.349	S	S	*	.			trans	-66	14.1	179.4	-66.6	-36.5	0	0	0	115.1	K134	H132-K134 PolarHBondContact O-N 3.06Å
133	S	52.5	Low	71.1	Confident	74 Å²	74	76.6 Å²	76.6	52%	0.517	37%	0.369	S	S	.	.	S	Bend	trans	-81.7	69.6	179.8	52.5	0	0	0	0	113.5	D131 F135	D131-S133 PolarHBondContact O-N 3.46Å; S133-F135 VanDerWaalsContact C-N 3.3Å; S133-F135 PolarHBondContact O-N 2.87Å
134	K	54.7	Low	70.6	Confident	194 Å²	194	78.3 Å²	78.3	84%	0.843	38%	0.378	S	S	*	.	S	Bend	trans	59.6	1	152.4	-75.4	-170.1	170.6	-171.3	0	120.9	H132	H132-K134 PolarHBondContact O-N 3.06Å
135	F	63.6	Low	69.8	Low	114 Å²	114	80.6 Å²	80.6	50%	0.5	40%	0.395	S	S	.	.			trans	-114.6	142.3	-176.4	-83.3	-98.3	0	0	0	114.5	I104 S129 S133	I104-F135 HydrophobicContact CB-CE1 4.35Å; I104-F135 HydrophobicContact CD1-CE1 4.11Å; I104-F135 HydrophobicContact CD1-CZ 3.98Å; I104-F135 HydrophobicContact CG1-CE1 3.99Å; I104-F135 HydrophobicContact CG1-CZ 4.33Å; I104-F135 HydrophobicContact CG2-CD1 4.29Å; I104-F135 HydrophobicContact CG2-CE1 3.43Å; I104-F135 VanDerWaalsContact CG2-CE1 3.43Å; I104-F135 HydrophobicContact CG2-CZ 3.69Å; S129-F135 PolarHBondContact N-O 2.63Å; S129-F135 PolarHBondContact OG-O 2.95Å; S133-F135 VanDerWaalsContact C-N 3.3Å; S133-F135 PolarHBondContact O-N 2.87Å
136	S	70.2	Confident	69.3	Low	13 Å²	13	77.6 Å²	77.6	9%	0.091	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.5	168.6	68.1	0	0	0	0	109.9	N108 R126 R127	N108-S136 PolarHBondContact OD1-OG 3.18Å; R126-S136 PolarHBondContact NE-OG 3Å; R126-S136 PolarHBondContact NH2-OG 3.33Å; R127-S136 CarbonylContact O-C 3.58Å; R127-S136 VanDerWaalsContact O-CA 3.3Å; R127-S136 WeakPolarHBondContact O-CA 3.42Å; R127-S136 VanDerWaalsContact O-CB 3.3Å; R127-S136 WeakPolarHBondContact O-CB 3.18Å
137	W	76.3	Confident	69	Low	93 Å²	93	73.9 Å²	73.9	35%	0.352	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	168.4	-176.6	62.8	-86.4	0	0	0	111.4	N91 S93 R127 E139	N91-W137 HydrophobicContact CB-CE3 4.25Å; N91-W137 HydrophobicContact CB-CZ3 4.03Å; S93-W137 VanDerWaalsContact OG-CA 3.32Å; S93-W137 WeakPolarHBondContact OG-CA 3.33Å; R127-W137 HydrophobicContact CB-CD2 3.63Å; R127-W137 HydrophobicContact CB-CE3 4.21Å; R127-W137 HydrophobicContact CB-CG 3.98Å; R127-W137 HydrophobicContact CB-CH2 4.36Å; R127-W137 HydrophobicContact CB-CZ2 3.78Å; R127-W137 HydrophobicContact CG-CD2 4.07Å; R127-W137 HydrophobicContact CG-CE3 4.17Å; R127-W137 HydrophobicContact CG-CH2 3.85Å; R127-W137 HydrophobicContact CG-CZ2 3.72Å; R127-W137 HydrophobicContact CG-CZ3 4.07Å; R127-W137 PolarHBondContact N-O 3.28Å; R127-W137 PolarHBondContact O-N 2.82Å; W137-E139 HydrophobicContact CE3-CB 4.3Å; W137-E139 HydrophobicContact CH2-CB 4.38Å; W137-E139 HydrophobicContact CH2-CG 4.45Å; W137-E139 HydrophobicContact CZ3-CB 3.68Å; W137-E139 HydrophobicContact CZ3-CG 4.04Å
138	Y	81.8	Confident	68.9	Low	8 Å²	8	69.8 Å²	69.8	3%	0.031	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.5	-177.8	-71.4	-81.9	0	0	0	112.3	N91 L92 S93 I107 E109 P110 L111 I124 R125 R126	N91-Y138 CarbonylContact C-O 3.41Å; N91-Y138 VanDerWaalsContact C-O 3.24Å; L92-Y138 PolarHBondContact N-O 3.02Å; S93-Y138 PolarHBondContact N-O 3.22Å; S93-Y138 PolarHBondContact OG-N 2.79Å; I107-Y138 WeakPolarHBondContact O-CE2 3.29Å; E109-Y138 WeakPolarHBondContact O-CE2 3.21Å; E109-Y138 PolarHBondContact O-OH 3.38Å; P110-Y138 VanDerWaalsContact CA-OH 3.31Å; P110-Y138 WeakPolarHBondContact CA-OH 3.42Å; L111-Y138 HydrophobicContact CB-CD1 4.19Å; L111-Y138 HydrophobicContact CB-CE1 4.04Å; L111-Y138 HydrophobicContact CB-CE2 4.45Å; L111-Y138 HydrophobicContact CB-CG 4.46Å; L111-Y138 HydrophobicContact CD1-CD1 3.89Å; L111-Y138 HydrophobicContact CD1-CD2 3.46Å; L111-Y138 VanDerWaalsContact CD1-CD2 3.46Å; L111-Y138 HydrophobicContact CD1-CE1 4.41Å; L111-Y138 HydrophobicContact CD1-CE2 4.03Å; L111-Y138 HydrophobicContact CD1-CG 3.38Å; L111-Y138 HydrophobicContact CG-CD1 4.12Å; L111-Y138 HydrophobicContact CG-CD2 3.69Å; L111-Y138 HydrophobicContact CG-CE1 4.13Å; L111-Y138 HydrophobicContact CG-CE2 3.7Å; L111-Y138 HydrophobicContact CG-CG 3.9Å; L111-Y138 PolarHBondContact N-OH 2.98Å; I124-Y138 HydrophobicContact CG2-CD1 3.73Å; I124-Y138 HydrophobicContact CG2-CG 4.39Å; R125-Y138 CarbonylContact O-C 3.58Å; R125-Y138 WeakPolarHBondContact O-CA 3.48Å; R126-Y138 HydrophobicContact CB-CD1 3.95Å; R126-Y138 HydrophobicContact CB-CE1 3.59Å; R126-Y138 HydrophobicContact CG-CD1 4.15Å; R126-Y138 HydrophobicContact CG-CE1 3.64Å; R126-Y138 PolarHBondContact NH1-OH 2.76Å
139	E	81.5	Confident	69.3	Low	9 Å²	9	66.8 Å²	66.8	4%	0.042	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	116	-175.3	-171.8	-161.9	-166.4	0	0	108.9	S89 I90 I124 R125 R127 W137 T141	S89-E139 PolarHBondContact OG-OE1 2.88Å; I90-E139 CarbonylContact O-C 3.24Å; I90-E139 VanDerWaalsContact O-CA 3.3Å; I90-E139 WeakPolarHBondContact O-CA 3.3Å; I124-E139 CarbonylContact C-O 3.6Å; I124-E139 WeakPolarHBondContact CA-O 3.45Å; R125-E139 HydrophobicContact CB-CB 4.4Å; R125-E139 PolarHBondContact N-O 2.89Å; R125-E139 PolarHBondContact O-N 3.12Å; R127-E139 HydrophobicContact CG-CB 4.26Å; R127-E139 IonicContact CZ-OE2 3.51Å; R127-E139 IonicContact NE-OE2 3.2Å; R127-E139 PolarHBondContact NE-OE2 2.86Å; R127-E139 VanDerWaalsContact NH2-CD 3.3Å; R127-E139 IonicContact NH2-OE1 3.68Å; R127-E139 PolarHBondContact NH2-OE1 2.79Å; R127-E139 VanDerWaalsContact NH2-OE1 3.15Å; R127-E139 IonicContact NH2-OE2 3.5Å; R127-E139 PolarHBondContact NH2-OE2 2.86Å; W137-E139 HydrophobicContact CE3-CB 4.3Å; W137-E139 HydrophobicContact CH2-CB 4.38Å; W137-E139 HydrophobicContact CH2-CG 4.45Å; W137-E139 HydrophobicContact CZ3-CB 3.68Å; W137-E139 HydrophobicContact CZ3-CG 4.04Å; E139-T141 HydrophobicContact CG-CG2 3.65Å; E139-T141 WeakPolarHBondContact OE1-CG2 3.3Å
140	L	79.8	Confident	69.7	Low	1 Å²	1	66.9 Å²	66.9	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	125.8	165.9	-176.8	70.5	0	0	0	108.3	I56 S89 I90 L92 F113 F122 I124 L204 L216	I56-L140 HydrophobicContact CD1-CD2 4.39Å; S89-L140 WeakPolarHBondContact CA-O 3.44Å; I90-L140 HydrophobicContact CB-CB 4.17Å; I90-L140 HydrophobicContact CG2-CB 4.16Å; I90-L140 HydrophobicContact CG2-CD2 4.42Å; I90-L140 PolarHBondContact N-O 3.12Å; I90-L140 PolarHBondContact O-N 2.85Å; L92-L140 HydrophobicContact CB-CB 4.36Å; F113-L140 HydrophobicContact CE1-CD1 4.35Å; F113-L140 HydrophobicContact CZ-CD1 4.29Å; F122-L140 HydrophobicContact CB-CD1 3.94Å; F122-L140 HydrophobicContact CD1-CD2 4.34Å; F122-L140 HydrophobicContact CD1-CG 4.29Å; I124-L140 HydrophobicContact CG1-CD1 3.85Å; L140-L204 HydrophobicContact CD1-CD1 4.44Å; L140-L204 HydrophobicContact CD1-CD2 3.64Å; L140-L204 HydrophobicContact CD2-CD2 3.93Å; L140-L204 HydrophobicContact CG-CD2 4.46Å; L140-L216 HydrophobicContact CD2-CD2 3.61Å
141	T	77.4	Confident	70	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	160.3	176.4	56.4	0	0	0	0	111.6	I88 F122 I123 R125 E139	I88-T141 WeakPolarHBondContact O-CA 3.47Å; I88-T141 VanDerWaalsContact O-CB 3.23Å; I88-T141 WeakPolarHBondContact O-CB 3.44Å; I88-T141 WeakPolarHBondContact O-CG2 3.37Å; F122-T141 CarbonylContact C-O 3.55Å; F122-T141 WeakPolarHBondContact CA-O 3.22Å; I123-T141 WeakPolarHBondContact CG1-O 3.37Å; I123-T141 WeakPolarHBondContact CG1-OG1 3.3Å; I123-T141 PolarHBondContact N-O 2.83Å; I123-T141 PolarHBondContact O-N 2.77Å; R125-T141 VanDerWaalsContact CZ-OG1 3.31Å; R125-T141 PolarHBondContact NE-OG1 3.07Å; R125-T141 PolarHBondContact NH1-OG1 2.88Å; E139-T141 HydrophobicContact CG-CG2 3.65Å; E139-T141 WeakPolarHBondContact OE1-CG2 3.3Å
142	S	72.5	Confident	70.3	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	154.6	168.5	53.8	0	0	0	0	112.1	S86 Q87 I88 P121	S86-S142 PolarHBondContact O-OG 2.91Å; Q87-S142 WeakPolarHBondContact CA-OG 3.48Å; Q87-S142 VanDerWaalsContact CG-O 3.28Å; Q87-S142 WeakPolarHBondContact CG-O 3.33Å; I88-S142 PolarHBondContact N-OG 2.83Å; I88-S142 PolarHBondContact O-N 3.42Å; P121-S142 CarbonylContact O-C 3.59Å; P121-S142 WeakPolarHBondContact O-CA 3.3Å; P121-S142 WeakPolarHBondContact O-CB 3.26Å
143	I	67.5	Low	71.2	Confident	85 Å²	85	49.3 Å²	49.3	44%	0.436	25%	0.253	S	S	.	.	S	Bend	trans	-105.1	-23.9	174.9	44.4	161.4	0	0	0	113.9	P121 I123	P121-I143 VanDerWaalsContact O-CG1 3.3Å; P121-I143 WeakPolarHBondContact O-CG1 3.44Å; P121-I143 PolarHBondContact O-N 3.05Å; I123-I143 HydrophobicContact CD1-CG2 3.48Å; I123-I143 VanDerWaalsContact CD1-CG2 3.48Å; I123-I143 HydrophobicContact CG1-CG2 3.91Å; I123-I143 HydrophobicContact CG2-CG2 4.33Å
144	I	69	Low	71.8	Confident	82 Å²	82	48.5 Å²	48.5	42%	0.421	24%	0.242	S	C	.	.	S	Bend	trans	-127.2	156.6	177.3	4	170.8	0	0	0	108	P121	P121-I144 HydrophobicContact CB-CB 4.23Å; P121-I144 HydrophobicContact CB-CD1 4.1Å; P121-I144 HydrophobicContact CB-CG1 3.69Å
145	P	64.2	Low	72.4	Confident	82 Å²	82	48.2 Å²	48.2	53%	0.532	24%	0.241	S	C	.	.			trans	-55.9	143.5	170.5	-20.7	32.7	0	0	0	110.9
146	V	70.3	Confident	72.6	Confident	16 Å²	16	49.3 Å²	49.3	10%	0.097	24%	0.242	C	C	.	.			trans	-70.8	134	163.3	-172.9	0	0	0	0	106.7	I58 E60 I88 P121 F122 I151 I220	I58-V146 HydrophobicContact CD1-CG2 4.5Å; I58-V146 HydrophobicContact CG2-CG1 4.45Å; I58-V146 HydrophobicContact CG2-CG2 4.39Å; E60-V146 HydrophobicContact CG-CB 4.24Å; E60-V146 HydrophobicContact CG-CG1 4.33Å; E60-V146 WeakPolarHBondContact OE1-CG1 3.4Å; I88-V146 HydrophobicContact CD1-CG2 3.84Å; P121-V146 HydrophobicContact CG-CG2 4.16Å; F122-V146 HydrophobicContact CZ-CG2 4.14Å; V146-I151 HydrophobicContact CB-CD1 4.31Å; V146-I151 HydrophobicContact CG1-CD1 3.49Å; V146-I151 VanDerWaalsContact CG1-CD1 3.49Å; V146-I220 HydrophobicContact CG1-CD1 3.7Å; V146-I220 HydrophobicContact CG1-CG1 4.13Å; V146-I220 HydrophobicContact CG1-CG2 4.35Å
147	N	72.3	Confident	72.5	Confident	43 Å²	43	52 Å²	52	23%	0.23	25%	0.25	C	S	.	.			trans	-138.7	116	165.3	168.4	-113.3	0	0	0	108.9	E60 E149 T150 I151	E60-N147 VanDerWaalsContact OE1-C 3.31Å; E60-N147 WeakPolarHBondContact OE1-CA 3.16Å; E60-N147 PolarHBondContact OE1-N 3.43Å; E60-N147 WeakPolarHBondContact OE2-CA 3.43Å; N147-E149 PolarHBondContact ND2-OE2 3.16Å; N147-E149 PolarHBondContact O-N 3.36Å; N147-T150 PolarHBondContact O-N 2.83Å; N147-T150 WeakPolarHBondContact OD1-CB 3.36Å; N147-T150 PolarHBondContact OD1-N 2.82Å; N147-T150 PolarHBondContact OD1-OG1 3.03Å; N147-I151 WeakPolarHBondContact O-CB 3.37Å; N147-I151 WeakPolarHBondContact O-CD1 3.48Å; N147-I151 VanDerWaalsContact O-CG1 3.26Å; N147-I151 WeakPolarHBondContact O-CG1 3.28Å; N147-I151 PolarHBondContact O-N 3Å
148	R	75.8	Confident	72.1	Confident	23 Å²	23	51 Å²	51	9%	0.087	26%	0.256	C	S	.	.	H	α-helix	trans	-54.1	-47.2	-174.7	-179.1	-172.9	161.7	-80.6	3	112.7	E60 T150 I151 C152 C200 I220 D222 E273	E60-R148 PolarHBondContact OE1-N 2.8Å; R148-T150 PolarHBondContact O-N 2.91Å; R148-I151 PolarHBondContact O-N 3.29Å; R148-I151 VanDerWaalsContact O-N 3.13Å; R148-C152 PolarHBondContact O-N 2.95Å; R148-C200 HydrophobicContact CG-CB 3.85Å; R148-I220 HydrophobicContact CB-CG2 3.75Å; R148-I220 HydrophobicContact CG-CG2 4.07Å; R148-D222 IonicContact CZ-OD1 2.73Å; R148-D222 IonicContact NE-OD1 3.94Å; R148-D222 PolarHBondContact NE-OD1 3.36Å; R148-D222 IonicContact NH1-OD1 2.75Å; R148-D222 PolarHBondContact NH1-OD1 2.88Å; R148-D222 IonicContact NH2-OD1 3.92Å; R148-E273 IonicContact CZ-OE2 3.81Å; R148-E273 IonicContact NE-OE2 3.73Å; R148-E273 IonicContact NH2-OE2 2.74Å; R148-E273 PolarHBondContact NH2-OE2 3.31Å
149	E	76.8	Confident	71.3	Confident	38 Å²	38	57.1 Å²	57.1	18%	0.178	29%	0.285	C	S	.	.	H	α-helix	trans	-67.2	-41.8	-174	-64.9	55.9	-110	0	0	109.6	N147 D153	N147-E149 PolarHBondContact ND2-OE2 3.16Å; N147-E149 PolarHBondContact O-N 3.36Å; E149-D153 WeakPolarHBondContact O-CB 3.31Å; E149-D153 PolarHBondContact O-N 3.2Å
150	T	74.2	Confident	70.6	Confident	44 Å²	44	58.2 Å²	58.2	27%	0.27	29%	0.288	S	S	.	.	H	α-helix	trans	-64.3	-42.2	172	-69.8	0	0	0	0	112.1	N147 R148 Y157	N147-T150 PolarHBondContact O-N 2.83Å; N147-T150 WeakPolarHBondContact OD1-CB 3.36Å; N147-T150 PolarHBondContact OD1-N 2.82Å; N147-T150 PolarHBondContact OD1-OG1 3.03Å; R148-T150 PolarHBondContact O-N 2.91Å; T150-Y157 HydrophobicContact CG2-CE2 4.18Å; T150-Y157 WeakPolarHBondContact O-CD2 3.34Å; T150-Y157 WeakPolarHBondContact O-CE2 3.48Å
151	I	71.8	Confident	69.7	Low	13 Å²	13	60 Å²	60	7%	0.067	30%	0.297	C	S	.	.	H	α-helix	trans	-74.2	-34.6	-173.4	-77.2	166.9	0	0	0	112.6	V146 N147 R148 M202 I220	V146-I151 HydrophobicContact CB-CD1 4.31Å; V146-I151 HydrophobicContact CG1-CD1 3.49Å; V146-I151 VanDerWaalsContact CG1-CD1 3.49Å; N147-I151 WeakPolarHBondContact O-CB 3.37Å; N147-I151 WeakPolarHBondContact O-CD1 3.48Å; N147-I151 VanDerWaalsContact O-CG1 3.26Å; N147-I151 WeakPolarHBondContact O-CG1 3.28Å; N147-I151 PolarHBondContact O-N 3Å; R148-I151 PolarHBondContact O-N 3.29Å; R148-I151 VanDerWaalsContact O-N 3.13Å; I151-M202 HydrophobicContact CD1-CE 4.08Å; I151-M202 HydrophobicContact CG2-CE 3.65Å; I151-I220 HydrophobicContact CB-CD1 4.25Å; I151-I220 HydrophobicContact CD1-CD1 3.8Å; I151-I220 HydrophobicContact CG2-CD1 3.72Å
152	C	71.5	Confident	68.9	Low	40 Å²	40	63.7 Å²	63.7	27%	0.27	32%	0.323	S	S	.	.	H	α-helix	trans	-103.3	6.7	-179.4	-78.2	0	0	0	0	114.4	R148 I154 C200	R148-C152 PolarHBondContact O-N 2.95Å; C152-I154 PolarHBondContact O-N 3Å; C152-C200 HydrophobicContact CB-CB 4.02Å; C152-C200 WeakPolarHBondContact CB-SG 3.4Å; C152-C200 WeakPolarHBondContact SG-CA 3.48Å; C152-C200 WeakPolarHBondContact SG-CB 3.43Å; C152-C200 CovalentContact SG-SG 2.04Å; C152-C200 PolarHBondContact SG-SG 2.86Å
153	D	70.7	Confident	68.2	Low	62 Å²	62	66.4 Å²	66.4	33%	0.332	34%	0.337	S	S	.	.			trans	-65.3	104.4	166.9	179.5	16.7	0	0	0	111.5	E149 K155 R156 Y157	E149-D153 WeakPolarHBondContact O-CB 3.31Å; E149-D153 PolarHBondContact O-N 3.2Å; D153-K155 PolarHBondContact O-N 3.13Å; D153-K155 VanDerWaalsContact O-N 3.08Å; D153-K155 VanDerWaalsContact OD1-CB 3.3Å; D153-K155 WeakPolarHBondContact OD1-CB 3.37Å; D153-K155 PolarHBondContact OD1-N 2.9Å; D153-R156 HydrophobicContact CB-CB 4.01Å; D153-R156 PolarHBondContact O-N 2.79Å; D153-R156 WeakPolarHBondContact OD2-CB 3.47Å; D153-Y157 PolarHBondContact O-N 3.12Å; D153-Y157 VanDerWaalsContact O-N 3.12Å
154	I	65.3	Low	67.9	Low	58 Å²	58	64 Å²	64	30%	0.297	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.6	-39	169.3	-83.9	-159.5	0	0	0	113.1	C152 R156 I161 F196	C152-I154 PolarHBondContact O-N 3Å; I154-R156 VanDerWaalsContact C-N 3.3Å; I154-R156 PolarHBondContact O-N 2.84Å; I154-I161 HydrophobicContact CB-CD1 4.03Å; I154-I161 HydrophobicContact CD1-CD1 3.92Å; I154-I161 HydrophobicContact CD1-CG1 4.31Å; I154-I161 HydrophobicContact CG1-CD1 3.71Å; I154-I161 HydrophobicContact CG1-CG1 3.94Å; I154-I161 HydrophobicContact CG2-CD1 3.82Å; I154-F196 HydrophobicContact CD1-CE2 3.51Å; I154-F196 HydrophobicContact CD1-CZ 3.6Å; I154-F196 HydrophobicContact CG1-CE2 3.82Å; I154-F196 HydrophobicContact CG1-CZ 3.66Å
155	K	67.7	Low	67.4	Low	187 Å²	187	64.2 Å²	64.2	81%	0.813	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-20.9	-174.5	-58.5	171.3	-175.9	166.4	0	112.3	D153	D153-K155 PolarHBondContact O-N 3.13Å; D153-K155 VanDerWaalsContact O-N 3.08Å; D153-K155 VanDerWaalsContact OD1-CB 3.3Å; D153-K155 WeakPolarHBondContact OD1-CB 3.37Å; D153-K155 PolarHBondContact OD1-N 2.9Å
156	R	68.9	Low	67.3	Low	138 Å²	138	67 Å²	67	52%	0.521	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-37.6	-175.9	-166.4	173.8	-179.5	157.3	-0.5	112.7	D153 I154	D153-R156 HydrophobicContact CB-CB 4.01Å; D153-R156 PolarHBondContact O-N 2.79Å; D153-R156 WeakPolarHBondContact OD2-CB 3.47Å; I154-R156 VanDerWaalsContact C-N 3.3Å; I154-R156 PolarHBondContact O-N 2.84Å
157	Y	67.7	Low	66.7	Low	69 Å²	69	67.5 Å²	67.5	27%	0.271	34%	0.34	S	S	.	.			trans	-131	63.2	-177.9	-58.2	-67.4	0	0	0	112.8	T150 D153 E159 R160	T150-Y157 HydrophobicContact CG2-CE2 4.18Å; T150-Y157 WeakPolarHBondContact O-CD2 3.34Å; T150-Y157 WeakPolarHBondContact O-CE2 3.48Å; D153-Y157 PolarHBondContact O-N 3.12Å; D153-Y157 VanDerWaalsContact O-N 3.12Å; Y157-E159 VanDerWaalsContact C-N 3.28Å; Y157-E159 PolarHBondContact O-N 2.64Å; Y157-R160 WeakPolarHBondContact O-CB 3.43Å; Y157-R160 PolarHBondContact O-N 2.85Å; Y157-R160 VanDerWaalsContact O-N 3.09Å
158	P	68	Low	66.2	Low	71 Å²	71	65.5 Å²	65.5	46%	0.461	33%	0.33	S	S	.	.	H	α-helix	trans	-61.2	-30.1	-172.8	24.2	-34.8	0	0	0	114.4	R160 I161	P158-R160 PolarHBondContact O-N 2.83Å; P158-I161 HydrophobicContact CB-CD1 4.22Å; P158-I161 VanDerWaalsContact O-CB 3.29Å; P158-I161 WeakPolarHBondContact O-CB 3.2Å; P158-I161 WeakPolarHBondContact O-CD1 3.48Å; P158-I161 VanDerWaalsContact O-CG1 3.24Å; P158-I161 WeakPolarHBondContact O-CG1 3.42Å; P158-I161 PolarHBondContact O-N 3.42Å
159	E	63.9	Low	65.3	Low	137 Å²	137	66.6 Å²	66.6	64%	0.64	34%	0.341	S	S	*	.	H	α-helix	trans	-53.6	-39.8	174.9	-59.3	-60	143.2	0	0	112.2	Y157 I161 S162	Y157-E159 VanDerWaalsContact C-N 3.28Å; Y157-E159 PolarHBondContact O-N 2.64Å; E159-I161 PolarHBondContact O-N 3.02Å; E159-S162 WeakPolarHBondContact O-CB 3.15Å; E159-S162 PolarHBondContact O-N 2.89Å; E159-S162 PolarHBondContact O-OG 2.91Å
160	R	68.1	Low	64.1	Low	33 Å²	33	71.1 Å²	71.1	13%	0.125	36%	0.364	C	S	.	.	H	α-helix	trans	-65	-26.9	-175.6	-64.5	-175.8	172	-179.2	-10.6	113	Q118 E120 Y157 P158 S162 I163 S164	Q118-R160 PolarHBondContact O-NH2 2.61Å; E120-R160 PolarHBondContact O-NH2 2.87Å; Y157-R160 WeakPolarHBondContact O-CB 3.43Å; Y157-R160 PolarHBondContact O-N 2.85Å; Y157-R160 VanDerWaalsContact O-N 3.09Å; P158-R160 PolarHBondContact O-N 2.83Å; R160-S162 PolarHBondContact O-N 2.8Å; R160-I163 PolarHBondContact O-N 3.1Å; R160-I163 VanDerWaalsContact O-N 3.11Å; R160-S164 PolarHBondContact O-N 2.9Å; R160-S164 PolarHBondContact O-OG 3.06Å
161	I	60.6	Low	62.2	Low	38 Å²	38	75.2 Å²	75.2	20%	0.195	39%	0.389	C	S	.	.	H	α-helix	trans	-55.3	-42.9	179.9	-57.5	171.8	0	0	0	110.5	I154 P158 E159 I163 S164 Q165	I154-I161 HydrophobicContact CB-CD1 4.03Å; I154-I161 HydrophobicContact CD1-CD1 3.92Å; I154-I161 HydrophobicContact CD1-CG1 4.31Å; I154-I161 HydrophobicContact CG1-CD1 3.71Å; I154-I161 HydrophobicContact CG1-CG1 3.94Å; I154-I161 HydrophobicContact CG2-CD1 3.82Å; P158-I161 HydrophobicContact CB-CD1 4.22Å; P158-I161 VanDerWaalsContact O-CB 3.29Å; P158-I161 WeakPolarHBondContact O-CB 3.2Å; P158-I161 WeakPolarHBondContact O-CD1 3.48Å; P158-I161 VanDerWaalsContact O-CG1 3.24Å; P158-I161 WeakPolarHBondContact O-CG1 3.42Å; P158-I161 PolarHBondContact O-N 3.42Å; E159-I161 PolarHBondContact O-N 3.02Å; I161-I163 PolarHBondContact O-N 3.44Å; I161-S164 PolarHBondContact O-OG 3.44Å; I161-Q165 VanDerWaalsContact CG2-CD 3.46Å; I161-Q165 HydrophobicContact CG2-CG 4.02Å; I161-Q165 VanDerWaalsContact O-CB 3.31Å; I161-Q165 WeakPolarHBondContact O-CB 3.25Å; I161-Q165 WeakPolarHBondContact O-CG 3.43Å; I161-Q165 PolarHBondContact O-N 2.94Å
162	S	59.8	Low	60.3	Low	78 Å²	78	80.7 Å²	80.7	55%	0.545	42%	0.423	S	S	.	.	H	α-helix	trans	-56.8	-34.2	-178.8	-35.5	0	0	0	0	113	E159 R160	E159-S162 WeakPolarHBondContact O-CB 3.15Å; E159-S162 PolarHBondContact O-N 2.89Å; E159-S162 PolarHBondContact O-OG 2.91Å; R160-S162 PolarHBondContact O-N 2.8Å
163	I	59.2	Low	58.4	Low	58 Å²	58	84.7 Å²	84.7	30%	0.297	45%	0.446	S	S	.	.	H	α-helix	trans	-99.1	-39.1	-173.6	-61.1	174.8	0	0	0	110.5	R160 I161 L166 C167 F203	R160-I163 PolarHBondContact O-N 3.1Å; R160-I163 VanDerWaalsContact O-N 3.11Å; I161-I163 PolarHBondContact O-N 3.44Å; I163-L166 PolarHBondContact O-N 3.48Å; I163-C167 PolarHBondContact O-N 2.92Å; I163-F203 HydrophobicContact CG2-CB 4.15Å; I163-F203 HydrophobicContact CG2-CD2 3.88Å; I163-F203 HydrophobicContact CG2-CG 4.28Å
164	S	59.6	Low	56.4	Low	33 Å²	33	88.8 Å²	88.8	23%	0.231	47%	0.468	C	S	.	.	H	α-helix	trans	-66.8	-43.7	178	64.2	0	0	0	0	111.8	R160 I161 L166 C167 C168	R160-S164 PolarHBondContact O-N 2.9Å; R160-S164 PolarHBondContact O-OG 3.06Å; I161-S164 PolarHBondContact O-OG 3.44Å; S164-L166 VanDerWaalsContact C-N 3.26Å; S164-L166 PolarHBondContact O-N 3.4Å; S164-C167 PolarHBondContact O-N 2.91Å; S164-C168 VanDerWaalsContact CA-SG 3.56Å; S164-C168 WeakPolarHBondContact O-CA 3.09Å; S164-C168 WeakPolarHBondContact O-CB 3.31Å; S164-C168 PolarHBondContact O-N 2.83Å
165	Q	59.5	Low	54.7	Low	88 Å²	88	92.3 Å²	92.3	41%	0.411	49%	0.493	S	S	.	.	H	α-helix	trans	-61.4	-36.1	175.3	-70.5	-177.7	-16.2	0	0	112.3	I161 S169	I161-Q165 VanDerWaalsContact CG2-CD 3.46Å; I161-Q165 HydrophobicContact CG2-CG 4.02Å; I161-Q165 VanDerWaalsContact O-CB 3.31Å; I161-Q165 WeakPolarHBondContact O-CB 3.25Å; I161-Q165 WeakPolarHBondContact O-CG 3.43Å; I161-Q165 PolarHBondContact O-N 2.94Å; Q165-S169 PolarHBondContact O-OG 3.04Å
166	L	61	Low	52.7	Low	140 Å²	140	94.3 Å²	94.3	73%	0.733	50%	0.495	S	S	*	.	H	α-helix	trans	-77.1	-35.7	-176.9	-136.6	79	0	0	0	113.7	I163 S164	I163-L166 PolarHBondContact O-N 3.48Å; S164-L166 VanDerWaalsContact C-N 3.26Å; S164-L166 PolarHBondContact O-N 3.4Å
167	C	58.6	Low	50.9	Low	26 Å²	26	94.1 Å²	94.1	18%	0.176	51%	0.509	C	S	.	.	H	α-helix	trans	-130.6	-5.9	-169.7	-56.4	0	0	0	0	116	C50 I163 S164 F203 R217	C50-C167 HydrophobicContact CB-CB 4.1Å; C50-C167 WeakPolarHBondContact CB-SG 3.08Å; C50-C167 WeakPolarHBondContact SG-CB 3.39Å; C50-C167 CovalentContact SG-SG 2.05Å; C50-C167 PolarHBondContact SG-SG 3.2Å; I163-C167 PolarHBondContact O-N 2.92Å; S164-C167 PolarHBondContact O-N 2.91Å; C167-F203 HydrophobicContact CB-CD2 4.34Å; C167-F203 HydrophobicContact CB-CE1 4.19Å; C167-F203 HydrophobicContact CB-CE2 3.51Å; C167-F203 HydrophobicContact CB-CZ 3.43Å; C167-F203 VanDerWaalsContact CB-CZ 3.43Å; C167-F203 WeakPolarHBondContact O-CZ 3.43Å; C167-R217 PolarHBondContact O-NH1 2.86Å
168	C	62.7	Low	49	Very low	2 Å²	2	97 Å²	97	1%	0.014	53%	0.534	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-31	167.5	-58.9	0	0	0	0	112.9	S164 M170 C201	S164-C168 VanDerWaalsContact CA-SG 3.56Å; S164-C168 WeakPolarHBondContact O-CA 3.09Å; S164-C168 WeakPolarHBondContact O-CB 3.31Å; S164-C168 PolarHBondContact O-N 2.83Å; C168-M170 PolarHBondContact O-N 2.93Å; C168-C201 VanDerWaalsContact CA-SG 3.55Å; C168-C201 HydrophobicContact CB-CB 3.88Å; C168-C201 WeakPolarHBondContact CB-SG 3.14Å; C168-C201 WeakPolarHBondContact SG-CB 3.44Å; C168-C201 PolarHBondContact SG-O 2.85Å; C168-C201 CovalentContact SG-SG 2.04Å; C168-C201 PolarHBondContact SG-SG 2.97Å
169	S	56.6	Low	47.2	Very low	45 Å²	45	98.6 Å²	98.6	32%	0.315	55%	0.554	S	S	.	*	S	Bend	trans	-59.9	123.8	-171.9	53.2	0	0	0	0	112.8	Q165 T171 D198	Q165-S169 PolarHBondContact O-OG 3.04Å; S169-T171 PolarHBondContact O-N 3.04Å; S169-D198 WeakPolarHBondContact CA-OD1 3.45Å; S169-D198 WeakPolarHBondContact CB-OD1 3.39Å
170	M	51	Low	45.5	Very low	133 Å²	133	98.1 Å²	98.1	66%	0.655	56%	0.56	S	S	*	*			trans	-76.6	112.4	178.4	-80.8	-72.9	-165.2	0	0	109.9	C168 T172	C168-M170 PolarHBondContact O-N 2.93Å; M170-T172 PolarHBondContact O-N 3.24Å
171	T	33.4	Very low	43.6	Very low	130 Å²	130	102.7 Å²	102.7	80%	0.798	59%	0.592	S	S	*	*			trans	-76.4	59	178.9	40.8	0	0	0	0	113	S169 T173	S169-T171 PolarHBondContact O-N 3.04Å; T171-T173 VanDerWaalsContact C-N 3.3Å; T171-T173 PolarHBondContact O-N 2.74Å
172	T	33.2	Very low	42	Very low	128 Å²	128	106.3 Å²	106.3	79%	0.785	62%	0.616	S	S	*	*			trans	-70.9	85.2	168.1	48	0	0	0	0	110.4	M170 N174	M170-T172 PolarHBondContact O-N 3.24Å; T172-N174 PolarHBondContact O-N 2.92Å
173	T	32	Very low	40.4	Very low	124 Å²	124	108.1 Å²	108.1	76%	0.761	62%	0.624	S	S	*	*			trans	-56.4	129.2	177.1	50.3	0	0	0	0	112	T171 T175	T171-T173 VanDerWaalsContact C-N 3.3Å; T171-T173 PolarHBondContact O-N 2.74Å; T173-T175 PolarHBondContact O-N 2.84Å
174	N	28	Very low	38.9	Very low	148 Å²	148	111.6 Å²	111.6	79%	0.791	64%	0.643	S	S	*	*			trans	-51.7	128.3	-177.3	-75.2	-80.4	0	0	0	114.9	T172	T172-N174 PolarHBondContact O-N 2.92Å
175	T	29.5	Very low	37.3	Very low	132 Å²	132	118.8 Å²	118.8	81%	0.81	67%	0.673	S	S	*	*			trans	-122.7	81.6	156.2	51.4	0	0	0	0	109.9	T173 T177	T173-T175 PolarHBondContact O-N 2.84Å; T175-T177 PolarHBondContact O-N 2.77Å
176	R	25.7	Very low	35.7	Very low	230 Å²	230	119.6 Å²	119.6	87%	0.868	70%	0.695	S	S	*	*			trans	-96	80.8	-171.4	-164.2	179	-168.3	-179.3	5	111.6	T178	R176-T178 PolarHBondContact O-N 2.64Å
177	T	31.6	Very low	34	Very low	133 Å²	133	120.8 Å²	120.8	82%	0.816	70%	0.702	S	S	*	*			trans	-81.6	98.2	-179.6	45.4	0	0	0	0	113	T175	T175-T177 PolarHBondContact O-N 2.77Å
178	T	28.1	Very low	32.4	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	73%	0.732	S	S	*	*			trans	-5.5	122.8	154.4	53.6	0	0	0	0	118.8	R176	R176-T178 PolarHBondContact O-N 2.64Å
179	A	30	Very low	30.7	Very low	105 Å²	105	135.2 Å²	135.2	87%	0.868	77%	0.771	S	S	*	*			trans	-135	142.6	142.9	0	0	0	0	0	108.3
180	T	27.8	Very low	29.2	Very low	126 Å²	126	139 Å²	139	77%	0.773	80%	0.797	S	S	*	*			trans	-108.8	136.6	-167.1	51.2	0	0	0	0	112.9
181	T	27.1	Very low	28.1	Very low	129 Å²	129	139.7 Å²	139.7	79%	0.791	80%	0.803	S	S	*	*				-165	128.9	124.9	17.8	0	0	0	0	113.6
182	T	27.3	Very low	27.7	Very low	115 Å²	115	139.4 Å²	139.4	71%	0.706	80%	0.797	S	S	*	*			trans	50.2	113.7	144.5	55.2	0	0	0	0	122.6
183	T	26.5	Very low	27.3	Very low	115 Å²	115	142.2 Å²	142.2	71%	0.706	80%	0.803	S	S	*	*				82.5	121.1	127.1	54.3	0	0	0	0	122.1
184	N	28	Very low	27.2	Very low	132 Å²	132	143.8 Å²	143.8	71%	0.706	80%	0.796	S	S	*	*			trans	73.9	98.1	146.7	-53.6	6.9	0	0	0	115.8
185	E	25.7	Very low	27.3	Very low	183 Å²	183	142.5 Å²	142.5	86%	0.855	79%	0.794	S	S	*	*				91.3	156	63.3	-78.6	-175	168.1	0	0	113.1
186	A	26.5	Very low	27.7	Very low	105 Å²	105	140.8 Å²	140.8	87%	0.868	78%	0.776	S	S	*	*			trans	62.4	61.9	-176.8	0	0	0	0	0	116.3
187	N	25.6	Very low	28.8	Very low	165 Å²	165	136 Å²	136	88%	0.882	77%	0.767	S	S	*	*			trans	-139.3	85.5	161.7	-144.9	-18.4	0	0	0	111.3
188	L	24.9	Very low	29.8	Very low	154 Å²	154	133 Å²	133	81%	0.806	75%	0.746	S	S	*	*			trans	-155.8	51.4	-174.9	-160.9	111.4	0	0	0	114.5
189	H	25.4	Very low	31.3	Very low	178 Å²	178	129 Å²	129	82%	0.824	72%	0.723	S	S	*	*			trans	-167.3	98.6	158.5	-96.7	-1.9	0	0	0	112.8
190	S	26.7	Very low	33.2	Very low	124 Å²	124	124.3 Å²	124.3	87%	0.867	68%	0.683	S	S	*	*			trans	-173.3	118.7	133.6	29.2	0	0	0	0	110.8
191	N	27.5	Very low	35.3	Very low	147 Å²	147	118.7 Å²	118.7	79%	0.786	65%	0.649	S	S	*	*			trans	-63.9	134.8	-170.1	-54	-38.6	0	0	0	114
192	N	24.9	Very low	37.5	Very low	125 Å²	125	113.2 Å²	113.2	67%	0.668	62%	0.615	S	S	*	*			trans	35	88.3	139.2	-55.7	5.2	0	0	0	117.9	Y194	N192-Y194 HydrophobicContact CB-CE2 4.49Å
193	M	24.5	Very low	39.6	Very low	187 Å²	187	108.9 Å²	108.9	92%	0.921	59%	0.586	S	S	*	*			trans	-101.6	124.8	132.3	-97.7	-179.8	60.2	0	0	107.8	T195	M193-T195 PolarHBondContact O-N 2.86Å
194	Y	29.2	Very low	41.9	Very low	156 Å²	156	103.4 Å²	103.4	61%	0.612	55%	0.553	S	S	*	*			trans	-68.3	115.3	-170.8	-69.7	-99.6	0	0	0	111.1	N192 F196	N192-Y194 HydrophobicContact CB-CE2 4.49Å; Y194-F196 PolarHBondContact O-N 2.9Å
195	T	31	Very low	44.1	Very low	122 Å²	122	97.4 Å²	97.4	75%	0.748	52%	0.522	S	S	*	.			trans	-71.9	105.3	164.8	48.8	0	0	0	0	108.6	M193 N197	M193-T195 PolarHBondContact O-N 2.86Å; T195-N197 VanDerWaalsContact C-N 3.34Å; T195-N197 PolarHBondContact O-N 2.88Å
196	F	37.9	Very low	46.5	Very low	95 Å²	95	88.7 Å²	88.7	42%	0.417	48%	0.481	S	S	.	.			trans	-70.5	90	173.7	-99.2	-88.7	0	0	0	110.5	I154 Y194	I154-F196 HydrophobicContact CD1-CE2 3.51Å; I154-F196 HydrophobicContact CD1-CZ 3.6Å; I154-F196 HydrophobicContact CG1-CE2 3.82Å; I154-F196 HydrophobicContact CG1-CZ 3.66Å; Y194-F196 PolarHBondContact O-N 2.9Å
197	N	48.5	Very low	49	Very low	129 Å²	129	85.3 Å²	85.3	69%	0.69	45%	0.45	S	S	*	.			trans	-111.3	6.9	162.6	-69.1	32.1	0	0	0	111	T195	T195-N197 VanDerWaalsContact C-N 3.34Å; T195-N197 PolarHBondContact O-N 2.88Å
198	D	53.1	Low	51.4	Low	71 Å²	71	77.4 Å²	77.4	38%	0.38	41%	0.407	S	S	.	.	S	Bend	trans	-81.3	121.2	170.5	-84.2	-50.2	0	0	0	108.3	S169 C200	S169-D198 WeakPolarHBondContact CA-OD1 3.45Å; S169-D198 WeakPolarHBondContact CB-OD1 3.39Å; D198-C200 PolarHBondContact O-N 3.02Å
199	P	59.9	Low	53.8	Low	46 Å²	46	73.3 Å²	73.3	30%	0.299	39%	0.392	S	S	.	.			trans	-64.9	130.9	-172.4	25.7	-34.5	0	0	0	111	C201	P199-C201 PolarHBondContact O-N 2.8Å
200	C	70.2	Confident	55.9	Low	7 Å²	7	67.9 Å²	67.9	5%	0.047	37%	0.373	C	S	.	.			trans	-58.3	108.9	-178.5	-176.3	0	0	0	0	111	R148 C152 D198 I220	R148-C200 HydrophobicContact CG-CB 3.85Å; C152-C200 HydrophobicContact CB-CB 4.02Å; C152-C200 WeakPolarHBondContact CB-SG 3.4Å; C152-C200 WeakPolarHBondContact SG-CA 3.48Å; C152-C200 WeakPolarHBondContact SG-CB 3.43Å; C152-C200 CovalentContact SG-SG 2.04Å; C152-C200 PolarHBondContact SG-SG 2.86Å; D198-C200 PolarHBondContact O-N 3.02Å; C200-I220 PolarHBondContact O-N 3.12Å
201	C	70.3	Confident	58	Low	7 Å²	7	66.2 Å²	66.2	5%	0.047	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.2	-177.5	115.2	0	0	0	0	110.9	C168 P199 F203 I218	C168-C201 VanDerWaalsContact CA-SG 3.55Å; C168-C201 HydrophobicContact CB-CB 3.88Å; C168-C201 WeakPolarHBondContact CB-SG 3.14Å; C168-C201 WeakPolarHBondContact SG-CB 3.44Å; C168-C201 PolarHBondContact SG-O 2.85Å; C168-C201 CovalentContact SG-SG 2.04Å; C168-C201 PolarHBondContact SG-SG 2.97Å; P199-C201 PolarHBondContact O-N 2.8Å; C201-F203 VanDerWaalsContact SG-CE2 3.57Å; C201-I218 CarbonylContact C-O 3.55Å; C201-I218 WeakPolarHBondContact CA-O 3.38Å
202	M	73.1	Confident	60.2	Low	15 Å²	15	60.8 Å²	60.8	7%	0.074	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	161.9	175.3	71.5	173.8	82.3	0	0	111.5	F122 I151 I218 I220	F122-M202 HydrophobicContact CD2-SD 3.94Å; F122-M202 HydrophobicContact CE2-CE 3.79Å; F122-M202 HydrophobicContact CE2-SD 3.55Å; F122-M202 VanDerWaalsContact CE2-SD 3.55Å; I151-M202 HydrophobicContact CD1-CE 4.08Å; I151-M202 HydrophobicContact CG2-CE 3.65Å; M202-I218 HydrophobicContact CG-CB 3.7Å; M202-I218 HydrophobicContact CG-CD1 4.3Å; M202-I218 HydrophobicContact CG-CG1 4.48Å; M202-I218 HydrophobicContact CG-CG2 4.1Å; M202-I218 PolarHBondContact N-O 2.6Å; M202-I218 PolarHBondContact O-N 2.86Å; M202-I218 HydrophobicContact SD-CD1 4.32Å; M202-I220 HydrophobicContact CE-CD1 3.88Å
203	F	71.5	Confident	62.5	Low	23 Å²	23	57.8 Å²	57.8	10%	0.101	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.7	176.3	-72.1	-93	0	0	0	110.2	I163 C167 C201 F215 L216 R217	I163-F203 HydrophobicContact CG2-CB 4.15Å; I163-F203 HydrophobicContact CG2-CD2 3.88Å; I163-F203 HydrophobicContact CG2-CG 4.28Å; C167-F203 HydrophobicContact CB-CD2 4.34Å; C167-F203 HydrophobicContact CB-CE1 4.19Å; C167-F203 HydrophobicContact CB-CE2 3.51Å; C167-F203 HydrophobicContact CB-CZ 3.43Å; C167-F203 VanDerWaalsContact CB-CZ 3.43Å; C167-F203 WeakPolarHBondContact O-CZ 3.43Å; C201-F203 VanDerWaalsContact SG-CE2 3.57Å; F203-F215 HydrophobicContact CD1-CB 4.18Å; F203-L216 WeakPolarHBondContact CA-O 3.33Å; F203-R217 HydrophobicContact CD1-CB 4.14Å; F203-R217 HydrophobicContact CE1-CB 3.7Å; F203-R217 HydrophobicContact CE1-CG 4Å; F203-R217 HydrophobicContact CZ-CB 4.18Å; F203-R217 HydrophobicContact CZ-CG 3.94Å
204	L	75	Confident	64.8	Low	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	98.7	-174.3	178.7	110.1	0	0	0	108.1	F113 F122 L140 I206 L216 I218	F113-L204 HydrophobicContact CD1-CD1 4.28Å; F113-L204 HydrophobicContact CD1-CG 4.17Å; F113-L204 HydrophobicContact CE1-CD1 3.66Å; F113-L204 HydrophobicContact CE1-CD2 3.96Å; F113-L204 HydrophobicContact CE1-CG 3.77Å; F113-L204 HydrophobicContact CZ-CD1 4.42Å; F122-L204 HydrophobicContact CB-CD1 3.63Å; F122-L204 HydrophobicContact CD2-CD1 4.21Å; F122-L204 HydrophobicContact CG-CD1 4.11Å; L140-L204 HydrophobicContact CD1-CD1 4.44Å; L140-L204 HydrophobicContact CD1-CD2 3.64Å; L140-L204 HydrophobicContact CD2-CD2 3.93Å; L140-L204 HydrophobicContact CG-CD2 4.46Å; L204-I206 HydrophobicContact CD2-CD1 4.07Å; L204-I206 HydrophobicContact CD2-CG1 4.26Å; L204-L216 HydrophobicContact CB-CB 4.21Å; L204-L216 HydrophobicContact CD2-CB 4.07Å; L204-L216 HydrophobicContact CD2-CD2 3.63Å; L204-L216 HydrophobicContact CD2-CG 4.44Å; L204-L216 PolarHBondContact N-O 2.92Å; L204-L216 PolarHBondContact O-N 2.89Å; L204-I218 HydrophobicContact CB-CD1 4.15Å
205	G	73.9	Confident	66.8	Low	6 Å²	6	47 Å²	47	6%	0.062	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.5	-175.1	0	0	0	0	0	112.7	F113 S114	F113-G205 CarbonylContact C-O 3.53Å; F113-G205 VanDerWaalsContact CA-O 3.26Å; F113-G205 WeakPolarHBondContact CA-O 3.25Å; S114-G205 PolarHBondContact N-O 2.97Å; S114-G205 WeakPolarHBondContact OG-CA 3.39Å
206	I	78	Confident	68.9	Low	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	116.1	-172.3	-60.3	160.8	0	0	0	108.7	I53 L92 L111 Y112 I124 L204 T213 Y214 L216	I53-I206 HydrophobicContact CD1-CB 4.41Å; I53-I206 HydrophobicContact CD1-CD1 3.73Å; L92-I206 HydrophobicContact CD1-CD1 3.78Å; L92-I206 HydrophobicContact CD2-CD1 3.87Å; L92-I206 HydrophobicContact CD2-CG2 4.41Å; L92-I206 HydrophobicContact CG-CD1 4.35Å; L111-I206 HydrophobicContact CD1-CG2 4.31Å; L111-I206 HydrophobicContact CD2-CG2 4.16Å; Y112-I206 CarbonylContact O-C 3.42Å; Y112-I206 WeakPolarHBondContact O-CA 3.41Å; I124-I206 HydrophobicContact CD1-CD1 4.49Å; I124-I206 HydrophobicContact CD1-CG1 3.98Å; I124-I206 HydrophobicContact CD1-CG2 4.29Å; L204-I206 HydrophobicContact CD2-CD1 4.07Å; L204-I206 HydrophobicContact CD2-CG1 4.26Å; I206-T213 WeakPolarHBondContact O-CA 3.4Å; I206-Y214 PolarHBondContact N-O 2.99Å; I206-Y214 PolarHBondContact O-N 2.94Å; I206-L216 HydrophobicContact CD1-CB 3.97Å; I206-L216 HydrophobicContact CD1-CD2 4.21Å
207	T	78.4	Confident	70.6	Confident	33 Å²	33	38 Å²	38	20%	0.202	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.5	-178	-47.9	0	0	0	0	111.1	Y112 G212 T213	Y112-T207 PolarHBondContact N-O 2.81Å; Y112-T207 VanDerWaalsContact N-O 3.13Å; Y112-T207 PolarHBondContact O-N 2.56Å; T207-G212 WeakPolarHBondContact CA-O 3.13Å; T207-T213 PolarHBondContact OG1-OG1 2.77Å; T207-T213 VanDerWaalsContact OG1-OG1 3.1Å
208	I	76.2	Confident	71.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130.6	166.6	-69.7	155.4	0	0	0	108	L96 L102 E109 L111 S210 K211 G212 Y214	L96-I208 HydrophobicContact CD2-CD1 4.34Å; L102-I208 HydrophobicContact CD1-CD1 3.34Å; L102-I208 HydrophobicContact CD2-CD1 4.17Å; L102-I208 HydrophobicContact CG-CD1 4.42Å; E109-I208 WeakPolarHBondContact OE2-CG2 3.44Å; L111-I208 HydrophobicContact CD2-CB 4.44Å; L111-I208 HydrophobicContact CD2-CD1 4.14Å; L111-I208 HydrophobicContact CD2-CG1 3.26Å; I208-S210 VanDerWaalsContact C-N 3.27Å; I208-S210 PolarHBondContact O-N 2.88Å; I208-K211 HydrophobicContact CB-CB 4.08Å; I208-K211 HydrophobicContact CB-CG 4.29Å; I208-K211 HydrophobicContact CG2-CB 3.94Å; I208-K211 HydrophobicContact CG2-CG 3.62Å; I208-K211 PolarHBondContact O-N 3.38Å; I208-K211 VanDerWaalsContact O-N 3.09Å; I208-G212 PolarHBondContact N-O 2.94Å; I208-G212 PolarHBondContact O-N 3.47Å; I208-Y214 HydrophobicContact CD1-CD2 4.14Å; I208-Y214 HydrophobicContact CD1-CE2 3.8Å
209	S	73.8	Confident	72.8	Confident	68 Å²	68	29.3 Å²	29.3	48%	0.476	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.5	-167.5	-63.1	0	0	0	0	113.8	E109	E109-S209 PolarHBondContact OE2-N 3.04Å
210	S	70.1	Confident	73.4	Confident	63 Å²	63	27.5 Å²	27.5	44%	0.441	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-5.9	179.2	60	0	0	0	0	115.4	E109 I208	E109-S210 VanDerWaalsContact CD-OG 3.26Å; E109-S210 WeakPolarHBondContact OE1-CB 3.35Å; E109-S210 WeakPolarHBondContact OE2-CB 3.37Å; E109-S210 PolarHBondContact OE2-N 3.4Å; E109-S210 PolarHBondContact OE2-OG 3.11Å; I208-S210 VanDerWaalsContact C-N 3.27Å; I208-S210 PolarHBondContact O-N 2.88Å
211	K	72.2	Confident	73.6	Confident	90 Å²	90	29.7 Å²	29.7	39%	0.391	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-16	-170.5	-49.3	-69.6	174.2	171.8	0	115	L102 D106 I208 Y214	L102-K211 HydrophobicContact CD2-CD 4.07Å; L102-K211 HydrophobicContact CD2-CG 3.68Å; D106-K211 WeakPolarHBondContact OD1-CE 3.25Å; D106-K211 IonicContact OD1-NZ 2.79Å; D106-K211 PolarHBondContact OD1-NZ 3.14Å; D106-K211 WeakPolarHBondContact OD2-CE 3.4Å; D106-K211 IonicContact OD2-NZ 2.59Å; D106-K211 PolarHBondContact OD2-NZ 3.17Å; I208-K211 HydrophobicContact CB-CB 4.08Å; I208-K211 HydrophobicContact CB-CG 4.29Å; I208-K211 HydrophobicContact CG2-CB 3.94Å; I208-K211 HydrophobicContact CG2-CG 3.62Å; I208-K211 PolarHBondContact O-N 3.38Å; I208-K211 VanDerWaalsContact O-N 3.09Å; K211-Y214 HydrophobicContact CB-CE2 3.8Å; K211-Y214 WeakPolarHBondContact CB-OH 3.43Å
212	G	73.1	Confident	73.8	Confident	33 Å²	33	31.1 Å²	31.1	34%	0.34	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	90.6	-162.9	-176.5	0	0	0	0	0	113.5	T207 I208	T207-G212 WeakPolarHBondContact CA-O 3.13Å; I208-G212 PolarHBondContact N-O 2.94Å; I208-G212 PolarHBondContact O-N 3.47Å
213	T	72.4	Confident	74	Confident	61 Å²	61	32 Å²	32	37%	0.374	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.3	-174.6	-51.6	0	0	0	0	111.7	I206 T207 F215	I206-T213 WeakPolarHBondContact O-CA 3.4Å; T207-T213 PolarHBondContact OG1-OG1 2.77Å; T207-T213 VanDerWaalsContact OG1-OG1 3.1Å; T213-F215 HydrophobicContact CG2-CE1 4.25Å; T213-F215 HydrophobicContact CG2-CE2 4.28Å; T213-F215 HydrophobicContact CG2-CZ 3.97Å
214	Y	73.5	Confident	74.6	Confident	52 Å²	52	32.3 Å²	32.3	20%	0.204	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	151.3	170.2	-51.8	-98.8	0	0	0	109.9	I53 L100 I206 I208 K211	I53-Y214 HydrophobicContact CG1-CG 4.38Å; L100-Y214 HydrophobicContact CD1-CD1 3.82Å; L100-Y214 HydrophobicContact CD1-CD2 3.72Å; L100-Y214 HydrophobicContact CD1-CE1 3.93Å; L100-Y214 HydrophobicContact CD1-CE2 3.83Å; L100-Y214 HydrophobicContact CD1-CG 3.69Å; L100-Y214 HydrophobicContact CD2-CD1 3.54Å; L100-Y214 HydrophobicContact CD2-CE1 3.66Å; L100-Y214 HydrophobicContact CD2-CG 4.18Å; L100-Y214 HydrophobicContact CG-CD1 4.29Å; L100-Y214 HydrophobicContact CG-CE1 4.25Å; I206-Y214 PolarHBondContact N-O 2.99Å; I206-Y214 PolarHBondContact O-N 2.94Å; I208-Y214 HydrophobicContact CD1-CD2 4.14Å; I208-Y214 HydrophobicContact CD1-CE2 3.8Å; K211-Y214 HydrophobicContact CB-CE2 3.8Å; K211-Y214 WeakPolarHBondContact CB-OH 3.43Å
215	F	71.1	Confident	74.8	Confident	65 Å²	65	35.1 Å²	35.1	29%	0.285	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.3	-173.8	-63.7	-85.7	0	0	0	113.3	S52 I53 F203 T213	S52-F215 CarbonylContact C-O 3.42Å; S52-F215 WeakPolarHBondContact CA-O 3.45Å; S52-F215 WeakPolarHBondContact CB-O 3.21Å; I53-F215 PolarHBondContact N-O 2.89Å; F203-F215 HydrophobicContact CD1-CB 4.18Å; T213-F215 HydrophobicContact CG2-CE1 4.25Å; T213-F215 HydrophobicContact CG2-CE2 4.28Å; T213-F215 HydrophobicContact CG2-CZ 3.97Å
216	L	74.2	Confident	75.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	118.6	172.2	-171.5	65.6	0	0	0	109.2	I53 A54 I56 L92 I95 L140 F203 L204 I206	I53-L216 HydrophobicContact CD1-CB 4.31Å; A54-L216 HydrophobicContact CB-CD1 3.79Å; I56-L216 HydrophobicContact CD1-CD1 3.89Å; I56-L216 HydrophobicContact CD1-CD2 3.57Å; I56-L216 HydrophobicContact CD1-CG 3.9Å; I56-L216 HydrophobicContact CG1-CD1 4.21Å; I56-L216 HydrophobicContact CG1-CG 4.5Å; L92-L216 HydrophobicContact CD1-CD2 3.98Å; I95-L216 HydrophobicContact CG2-CD1 4.33Å; L140-L216 HydrophobicContact CD2-CD2 3.61Å; F203-L216 WeakPolarHBondContact CA-O 3.33Å; L204-L216 HydrophobicContact CB-CB 4.21Å; L204-L216 HydrophobicContact CD2-CB 4.07Å; L204-L216 HydrophobicContact CD2-CD2 3.63Å; L204-L216 HydrophobicContact CD2-CG 4.44Å; L204-L216 PolarHBondContact N-O 2.92Å; L204-L216 PolarHBondContact O-N 2.89Å; I206-L216 HydrophobicContact CD1-CB 3.97Å; I206-L216 HydrophobicContact CD1-CD2 4.21Å
217	R	74.7	Confident	75.5	Confident	27 Å²	27	38.3 Å²	38.3	10%	0.102	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134.8	174.8	178.3	173.9	165.5	144.4	1.4	109.1	A54 N55 I56 C167 F203 D219	A54-R217 PolarHBondContact O-N 3.33Å; N55-R217 CarbonylContact C-O 3.54Å; N55-R217 WeakPolarHBondContact CA-O 3.36Å; I56-R217 PolarHBondContact N-O 2.91Å; C167-R217 PolarHBondContact O-NH1 2.86Å; F203-R217 HydrophobicContact CD1-CB 4.14Å; F203-R217 HydrophobicContact CE1-CB 3.7Å; F203-R217 HydrophobicContact CE1-CG 4Å; F203-R217 HydrophobicContact CZ-CB 4.18Å; F203-R217 HydrophobicContact CZ-CG 3.94Å; R217-D219 IonicContact CZ-OD1 2.77Å; R217-D219 IonicContact NE-OD1 2.74Å; R217-D219 PolarHBondContact NE-OD1 3.34Å; R217-D219 IonicContact NE-OD2 2.75Å; R217-D219 IonicContact NH2-OD1 2.96Å; R217-D219 PolarHBondContact NH2-OD1 3.21Å
218	I	74.9	Confident	76.1	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	112	178.4	-65.9	171.2	0	0	0	107.4	I56 I58 F122 C201 M202 L204	I56-I218 HydrophobicContact CB-CG1 4.43Å; I56-I218 CarbonylContact O-C 3.57Å; I56-I218 WeakPolarHBondContact O-CA 3.39Å; I58-I218 HydrophobicContact CD1-CG2 3.34Å; I58-I218 HydrophobicContact CG1-CG2 4Å; F122-I218 HydrophobicContact CD1-CD1 4.5Å; F122-I218 HydrophobicContact CD2-CD1 4.19Å; F122-I218 HydrophobicContact CE1-CD1 4.26Å; F122-I218 HydrophobicContact CE2-CD1 3.96Å; F122-I218 HydrophobicContact CG-CD1 4.49Å; F122-I218 HydrophobicContact CZ-CD1 4.01Å; F122-I218 HydrophobicContact CZ-CG2 4.36Å; C201-I218 CarbonylContact C-O 3.55Å; C201-I218 WeakPolarHBondContact CA-O 3.38Å; M202-I218 HydrophobicContact CG-CB 3.7Å; M202-I218 HydrophobicContact CG-CD1 4.3Å; M202-I218 HydrophobicContact CG-CG1 4.48Å; M202-I218 HydrophobicContact CG-CG2 4.1Å; M202-I218 PolarHBondContact N-O 2.6Å; M202-I218 PolarHBondContact O-N 2.86Å; M202-I218 HydrophobicContact SD-CD1 4.32Å; L204-I218 HydrophobicContact CB-CD1 4.15Å
219	D	72.6	Confident	76.5	Confident	18 Å²	18	42.8 Å²	42.8	10%	0.096	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	132.6	172.1	-60.1	-42.9	0	0	0	109.3	I56 K57 I58 R217	I56-D219 PolarHBondContact O-N 3.4Å; K57-D219 HydrophobicContact CG-CB 4.3Å; I58-D219 PolarHBondContact N-O 2.85Å; R217-D219 IonicContact CZ-OD1 2.77Å; R217-D219 IonicContact NE-OD1 2.74Å; R217-D219 PolarHBondContact NE-OD1 3.34Å; R217-D219 IonicContact NE-OD2 2.75Å; R217-D219 IonicContact NH2-OD1 2.96Å; R217-D219 PolarHBondContact NH2-OD1 3.21Å
220	I	73.2	Confident	76.9	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.041	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.8	173.4	-55.9	168.8	0	0	0	108.7	V146 R148 I151 C200 M202	V146-I220 HydrophobicContact CG1-CD1 3.7Å; V146-I220 HydrophobicContact CG1-CG1 4.13Å; V146-I220 HydrophobicContact CG1-CG2 4.35Å; R148-I220 HydrophobicContact CB-CG2 3.75Å; R148-I220 HydrophobicContact CG-CG2 4.07Å; I151-I220 HydrophobicContact CB-CD1 4.25Å; I151-I220 HydrophobicContact CD1-CD1 3.8Å; I151-I220 HydrophobicContact CG2-CD1 3.72Å; C200-I220 PolarHBondContact O-N 3.12Å; M202-I220 HydrophobicContact CE-CD1 3.88Å
221	N	73.7	Confident	76.8	Confident	53 Å²	53	41.4 Å²	41.4	28%	0.283	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	139.1	175.8	-56.2	-56	0	0	0	110.9	I58 T59	I58-N221 PolarHBondContact O-N 3.47Å; I58-N221 VanDerWaalsContact O-N 3.08Å; I58-N221 PolarHBondContact O-ND2 2.98Å; T59-N221 PolarHBondContact OG1-ND2 3.22Å
222	D	75.3	Confident	76	Confident	36 Å²	36	41.6 Å²	41.6	19%	0.193	22%	0.215	C	C	.	.			trans	-65.9	151.3	172.9	-166.6	72.1	0	0	0	112.5	R148 E273 N276	R148-D222 IonicContact CZ-OD1 2.73Å; R148-D222 IonicContact NE-OD1 3.94Å; R148-D222 PolarHBondContact NE-OD1 3.36Å; R148-D222 IonicContact NH1-OD1 2.75Å; R148-D222 PolarHBondContact NH1-OD1 2.88Å; R148-D222 IonicContact NH2-OD1 3.92Å; D222-E273 HydrophobicContact CB-CB 4.19Å; D222-E273 PolarHBondContact OD1-N 2.92Å; D222-E273 PolarHBondContact OD2-N 2.84Å; D222-N276 PolarHBondContact OD2-ND2 2.84Å
223	L	76.5	Confident	75.1	Confident	35 Å²	35	44.3 Å²	44.3	18%	0.183	22%	0.222	C	C	.	.			trans	-129.2	155.4	173.3	-67.3	-179	0	0	0	109	T59 E60 D225	T59-L223 HydrophobicContact CG2-CD2 4.39Å; E60-L223 HydrophobicContact CB-CD1 3.7Å; L223-D225 HydrophobicContact CB-CB 3.94Å; L223-D225 PolarHBondContact O-N 2.6Å
224	N	83.3	Confident	74.3	Confident	29 Å²	29	42.1 Å²	42.1	16%	0.155	21%	0.207	C	C	.	.	S	Bend	trans	-77.7	61.7	169.8	-150.3	47.6	0	0	0	109.5	D272 N276 D359 F364 R366	N224-D272 VanDerWaalsContact C-OD2 3.28Å; N224-D272 VanDerWaalsContact CA-OD2 3.26Å; N224-D272 WeakPolarHBondContact CA-OD2 3.07Å; N224-N276 HydrophobicContact CB-CB 4.45Å; N224-N276 PolarHBondContact N-ND2 2.83Å; N224-N276 WeakPolarHBondContact OD1-CA 3.29Å; N224-N276 WeakPolarHBondContact OD1-CB 3.48Å; N224-N276 VanDerWaalsContact OD1-CG 3.28Å; N224-N276 PolarHBondContact OD1-OD1 3.39Å; N224-D359 PolarHBondContact ND2-OD1 3.43Å; N224-D359 PolarHBondContact ND2-OD2 3.35Å; N224-D359 PolarHBondContact OD1-OD1 3.35Å; N224-F364 PolarHBondContact ND2-O 2.75Å; N224-R366 VanDerWaalsContact O-CD 3.29Å; N224-R366 WeakPolarHBondContact O-CD 3.3Å; N224-R366 PolarHBondContact O-NH1 2.92Å
225	D	79.3	Confident	73.3	Confident	59 Å²	59	43.2 Å²	43.2	32%	0.316	21%	0.213	S	C	.	.			trans	-94.6	-29.2	-166.8	154.7	-82.2	0	0	0	111.7	L223 D272 R366	L223-D225 HydrophobicContact CB-CB 3.94Å; L223-D225 PolarHBondContact O-N 2.6Å; D225-D272 PolarHBondContact N-OD2 2.8Å; D225-R366 VanDerWaalsContact CA-NH1 3.34Å; D225-R366 PolarHBondContact O-NH1 2.89Å; D225-R366 PolarHBondContact O-NH2 2.82Å
226	N	81.2	Confident	72.3	Confident	43 Å²	43	43.4 Å²	43.4	23%	0.23	23%	0.234	C	C	.	.	S	Bend	trans	-94.9	-166.5	168.6	-63.8	-85.8	0	0	0	110.7	D270 L271 D272 R366	N226-D270 VanDerWaalsContact CB-OD1 3.29Å; N226-D270 WeakPolarHBondContact CB-OD1 3.43Å; N226-L271 HydrophobicContact CB-CB 4.1Å; N226-D272 VanDerWaalsContact CB-OD1 3.25Å; N226-D272 WeakPolarHBondContact CB-OD1 3.36Å; N226-D272 PolarHBondContact N-OD1 3.33Å; N226-D272 VanDerWaalsContact N-OD1 3.14Å; N226-D272 PolarHBondContact N-OD2 3.07Å; N226-D272 PolarHBondContact ND2-OD1 3.02Å; N226-R366 VanDerWaalsContact O-CD 3.26Å; N226-R366 WeakPolarHBondContact O-CD 3.39Å; N226-R366 PolarHBondContact O-NE 2.86Å; N226-R366 PolarHBondContact O-NH1 3.1Å; N226-R366 PolarHBondContact O-NH2 3.41Å
227	A	85.9	Confident	71.1	Confident	31 Å²	31	48 Å²	48	26%	0.256	25%	0.254	S	S	.	.			trans	-160.7	154.2	178.8	0	0	0	0	0	109.1	K229 D270 R366	A227-K229 PolarHBondContact O-N 3.48Å; A227-D270 WeakPolarHBondContact CA-OD2 3.46Å; A227-D270 PolarHBondContact N-OD1 3Å; A227-R366 HydrophobicContact CB-CB 3.78Å
228	P	90.2	Very high	69.9	Low	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-63.9	116	-167.3	-26.6	34.5	0	0	0	111.2	A268 D270 V279 A357 D359 S368	P228-A268 HydrophobicContact CB-CB 4.35Å; P228-D270 WeakPolarHBondContact CA-OD2 3.37Å; P228-D270 WeakPolarHBondContact CD-OD2 3.32Å; P228-D270 VanDerWaalsContact CG-OD2 3.31Å; P228-D270 WeakPolarHBondContact CG-OD2 3.48Å; P228-V279 HydrophobicContact CB-CG1 4.08Å; P228-V279 HydrophobicContact CB-CG2 3.85Å; P228-V279 HydrophobicContact CG-CG1 4.48Å; P228-V279 HydrophobicContact CG-CG2 4.11Å; P228-A357 HydrophobicContact CB-CB 4Å; P228-D359 HydrophobicContact CG-CB 3.97Å; P228-S368 WeakPolarHBondContact O-CB 3.22Å; P228-S368 PolarHBondContact O-OG 3.39Å
229	K	85.2	Confident	68.8	Low	126 Å²	126	49.9 Å²	49.9	55%	0.548	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	120.8	-178.4	-169.6	-178.8	173.7	-167.9	0	110.7	A227 Q231 E232 A268 T269	A227-K229 PolarHBondContact O-N 3.48Å; K229-Q231 PolarHBondContact O-N 3.04Å; K229-E232 IonicContact NZ-OE1 2.72Å; K229-E232 PolarHBondContact NZ-OE1 2.83Å; K229-A268 CarbonylContact O-C 3.53Å; K229-A268 VanDerWaalsContact O-CA 3.28Å; K229-A268 WeakPolarHBondContact O-CA 3.21Å; K229-T269 PolarHBondContact N-O 3.44Å; K229-T269 PolarHBondContact O-N 2.7Å
230	F	83.1	Confident	67.5	Low	25 Å²	25	54.1 Å²	54.1	11%	0.11	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	128.4	167.8	-74	-76.8	0	0	0	110.4	P266 A268 Y281 L355 A357 S368 L370	F230-P266 HydrophobicContact CD1-CB 4.17Å; F230-A268 HydrophobicContact CD1-CB 3.89Å; F230-A268 HydrophobicContact CE1-CB 4.1Å; F230-A268 HydrophobicContact CG-CB 4.16Å; F230-Y281 HydrophobicContact CE1-CE1 4.15Å; F230-L355 HydrophobicContact CE1-CD2 3.63Å; F230-L355 HydrophobicContact CE1-CG 3.94Å; F230-L355 HydrophobicContact CZ-CB 4.3Å; F230-L355 HydrophobicContact CZ-CD2 4.07Å; F230-L355 HydrophobicContact CZ-CG 3.84Å; F230-L355 WeakPolarHBondContact CZ-O 3.42Å; F230-A357 HydrophobicContact CE1-CB 4.18Å; F230-A357 HydrophobicContact CE2-CB 3.89Å; F230-A357 HydrophobicContact CZ-CB 3.59Å; F230-S368 VanDerWaalsContact CD2-OG 3.24Å; F230-S368 WeakPolarHBondContact CD2-OG 3.24Å; F230-S368 WeakPolarHBondContact CE2-OG 3.5Å; F230-L370 HydrophobicContact CB-CD2 4.21Å; F230-L370 HydrophobicContact CD1-CB 4.36Å; F230-L370 HydrophobicContact CD1-CD2 3.95Å; F230-L370 HydrophobicContact CD2-CB 3.7Å; F230-L370 HydrophobicContact CD2-CD2 4.47Å; F230-L370 HydrophobicContact CE1-CB 4.4Å; F230-L370 HydrophobicContact CE1-CD2 4.48Å; F230-L370 HydrophobicContact CE2-CB 3.74Å; F230-L370 HydrophobicContact CG-CB 4.03Å; F230-L370 HydrophobicContact CG-CD2 3.95Å; F230-L370 HydrophobicContact CZ-CB 4.09Å
231	Q	67	Low	66.4	Low	78 Å²	78	61.2 Å²	61.2	36%	0.364	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-72.1	137.9	-175.7	-64.2	-165.4	-24.6	0	0	111	K229 L233 L239 K267 T269	K229-Q231 PolarHBondContact O-N 3.04Å; Q231-L233 PolarHBondContact O-N 2.88Å; Q231-L239 WeakPolarHBondContact O-CD1 3.45Å; Q231-K267 PolarHBondContact N-O 3.09Å; Q231-T269 HydrophobicContact CG-CG2 4.46Å; Q231-T269 PolarHBondContact NE2-OG1 2.82Å
232	E	56	Low	65.4	Low	94 Å²	94	59.9 Å²	59.9	44%	0.439	32%	0.321	S	S	.	.	S	Bend	trans	-71.4	20.1	172.7	-67.2	171.3	-141.9	0	0	112.9	K229 S238 L239	K229-E232 IonicContact NZ-OE1 2.72Å; K229-E232 PolarHBondContact NZ-OE1 2.83Å; E232-S238 CarbonylContact O-C 3.55Å; E232-S238 VanDerWaalsContact O-CA 3.3Å; E232-S238 WeakPolarHBondContact O-CA 3.34Å; E232-L239 PolarHBondContact O-N 2.89Å
233	L	54.6	Low	64.5	Low	90 Å²	90	62.1 Å²	62.1	47%	0.471	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	122.3	-176.1	-70	168.4	0	0	0	109.6	Q231 K237	Q231-L233 PolarHBondContact O-N 2.88Å; L233-K237 WeakPolarHBondContact CA-O 3.19Å
234	I	54.9	Low	63.5	Low	14 Å²	14	62 Å²	62	7%	0.072	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.1	161.8	-38.7	178.3	0	0	0	106.5	G236 K237 L239 F249 P266	I234-G236 PolarHBondContact O-N 2.95Å; I234-G236 VanDerWaalsContact O-N 3.15Å; I234-K237 PolarHBondContact N-O 3.39Å; I234-K237 PolarHBondContact O-N 2.84Å; I234-K237 VanDerWaalsContact O-N 3.12Å; I234-L239 HydrophobicContact CD1-CD1 4.34Å; I234-L239 HydrophobicContact CD1-CD2 4.25Å; I234-L239 HydrophobicContact CG1-CD1 4.14Å; I234-L239 HydrophobicContact CG1-CD2 4.22Å; I234-L239 HydrophobicContact CG1-CG 4.4Å; I234-F249 HydrophobicContact CD1-CE1 3.76Å; I234-F249 HydrophobicContact CD1-CE2 4.22Å; I234-F249 HydrophobicContact CD1-CZ 3.46Å; I234-F249 VanDerWaalsContact CD1-CZ 3.46Å; I234-P266 HydrophobicContact CD1-CB 3.77Å; I234-P266 HydrophobicContact CD1-CG 3.7Å; I234-P266 HydrophobicContact CG1-CB 4.45Å
235	F	53.1	Low	62.4	Low	75 Å²	75	68.7 Å²	68.7	33%	0.329	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	35.4	-176.2	-44.8	-58.1	0	0	0	113.7	K237 P264 L318 F325 A327 Y332	F235-K237 PolarHBondContact O-N 3.15Å; F235-P264 HydrophobicContact CE2-CG 4.41Å; F235-P264 HydrophobicContact CZ-CB 3.84Å; F235-P264 HydrophobicContact CZ-CG 3.77Å; F235-L318 HydrophobicContact CD2-CD1 4.39Å; F235-L318 HydrophobicContact CE2-CD1 4.49Å; F235-F325 HydrophobicContact CB-CD1 4.22Å; F235-F325 HydrophobicContact CB-CE1 4.49Å; F235-F325 HydrophobicContact CD2-CB 4.17Å; F235-F325 AromaticContact CD2-CD1 3.52Å; F235-F325 HydrophobicContact CD2-CD1 3.52Å; F235-F325 HydrophobicContact CD2-CE1 4.29Å; F235-F325 HydrophobicContact CD2-CG 4.19Å; F235-F325 HydrophobicContact CE2-CB 4.16Å; F235-F325 HydrophobicContact CE2-CD1 4.33Å; F235-F325 HydrophobicContact CG-CD1 4.19Å; F235-A327 HydrophobicContact CE1-CB 3.59Å; F235-A327 HydrophobicContact CZ-CB 3.88Å; F235-Y332 HydrophobicContact CE1-CD2 4.08Å
236	G	49.1	Very low	61.5	Low	70 Å²	70	74.5 Å²	74.5	72%	0.722	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	5.4	178.9	0	0	0	0	0	115.8	I234	I234-G236 PolarHBondContact O-N 2.95Å; I234-G236 VanDerWaalsContact O-N 3.15Å
237	K	50.1	Low	60.9	Low	97 Å²	97	74.1 Å²	74.1	42%	0.422	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138.6	175.6	-68.4	-175.1	-175.3	171.3	0	111	L233 I234 F235 F325	L233-K237 WeakPolarHBondContact CA-O 3.19Å; I234-K237 PolarHBondContact N-O 3.39Å; I234-K237 PolarHBondContact O-N 2.84Å; I234-K237 VanDerWaalsContact O-N 3.12Å; F235-K237 PolarHBondContact O-N 3.15Å; K237-F325 HydrophobicContact CD-CE1 4Å; K237-F325 HydrophobicContact CD-CZ 4.03Å
238	S	48.9	Very low	60.5	Low	50 Å²	50	74.8 Å²	74.8	35%	0.35	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	141.5	-173.9	-172.2	0	0	0	0	113.2	E232 I240	E232-S238 CarbonylContact O-C 3.55Å; E232-S238 VanDerWaalsContact O-CA 3.3Å; E232-S238 WeakPolarHBondContact O-CA 3.34Å; S238-I240 VanDerWaalsContact C-N 3.33Å; S238-I240 WeakPolarHBondContact OG-CB 3.25Å; S238-I240 VanDerWaalsContact OG-CG1 3.29Å; S238-I240 WeakPolarHBondContact OG-CG1 3.42Å; S238-I240 PolarHBondContact OG-N 2.83Å; S238-I240 VanDerWaalsContact OG-N 3.14Å
239	L	51.7	Low	60	Low	16 Å²	16	74.9 Å²	74.9	8%	0.084	39%	0.387	C	S	.	.			trans	-85.4	-1.6	169.6	-64.3	-177	0	0	0	113.3	Q231 E232 I234 N241 K242 F249	Q231-L239 WeakPolarHBondContact O-CD1 3.45Å; E232-L239 PolarHBondContact O-N 2.89Å; I234-L239 HydrophobicContact CD1-CD1 4.34Å; I234-L239 HydrophobicContact CD1-CD2 4.25Å; I234-L239 HydrophobicContact CG1-CD1 4.14Å; I234-L239 HydrophobicContact CG1-CD2 4.22Å; I234-L239 HydrophobicContact CG1-CG 4.4Å; L239-N241 PolarHBondContact O-N 2.91Å; L239-K242 HydrophobicContact CB-CB 4.49Å; L239-K242 HydrophobicContact CD2-CB 4.15Å; L239-K242 HydrophobicContact CD2-CD 4.35Å; L239-K242 WeakPolarHBondContact O-CB 3.5Å; L239-K242 PolarHBondContact O-N 2.88Å; L239-F249 HydrophobicContact CD2-CD2 4.01Å; L239-F249 HydrophobicContact CD2-CE2 3.44Å; L239-F249 VanDerWaalsContact CD2-CE2 3.44Å; L239-F249 HydrophobicContact CD2-CZ 4.19Å
240	I	45.7	Very low	59.9	Low	107 Å²	107	70 Å²	70	55%	0.549	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	122.9	172.7	-64.3	169	0	0	0	108.1	S238 K242	S238-I240 VanDerWaalsContact C-N 3.33Å; S238-I240 WeakPolarHBondContact OG-CB 3.25Å; S238-I240 VanDerWaalsContact OG-CG1 3.29Å; S238-I240 WeakPolarHBondContact OG-CG1 3.42Å; S238-I240 PolarHBondContact OG-N 2.83Å; S238-I240 VanDerWaalsContact OG-N 3.14Å; I240-K242 VanDerWaalsContact C-N 3.34Å
241	N	49.3	Very low	60	Low	157 Å²	157	68.9 Å²	68.9	84%	0.84	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	15.8	-170.5	-46.3	-36.1	0	0	0	116.1	L239	L239-N241 PolarHBondContact O-N 2.91Å
242	K	53.7	Low	61	Low	26 Å²	26	65.4 Å²	65.4	11%	0.113	35%	0.345	C	S	.	.			trans	-103.5	22.3	177.2	-68.2	-152.9	168.5	-152.7	0	115.7	L239 I240 N319 D321	L239-K242 HydrophobicContact CB-CB 4.49Å; L239-K242 HydrophobicContact CD2-CB 4.15Å; L239-K242 HydrophobicContact CD2-CD 4.35Å; L239-K242 WeakPolarHBondContact O-CB 3.5Å; L239-K242 PolarHBondContact O-N 2.88Å; I240-K242 VanDerWaalsContact C-N 3.34Å; K242-N319 WeakPolarHBondContact CA-ND2 3.24Å; K242-N319 WeakPolarHBondContact CB-ND2 3.29Å; K242-N319 PolarHBondContact O-ND2 3.49Å; K242-D321 IonicContact NZ-OD1 3.15Å; K242-D321 PolarHBondContact NZ-OD1 3.41Å; K242-D321 IonicContact NZ-OD2 2.62Å; K242-D321 PolarHBondContact NZ-OD2 3.06Å
243	H	56.3	Low	62.6	Low	82 Å²	82	60.9 Å²	60.9	38%	0.38	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-101.6	149.3	162.5	-64.8	-101.6	0	0	0	109.6	G247 R248	H243-G247 PolarHBondContact ND1-O 3.22Å; H243-R248 WeakPolarHBondContact CA-O 3.18Å
244	D	56.1	Low	64.2	Low	34 Å²	34	59.6 Å²	59.6	18%	0.182	32%	0.316	C	S	.	.			trans	-71.3	178	166.5	78.7	-7.5	0	0	0	111.8	Y246 G247 R248 I250	D244-Y246 PolarHBondContact O-N 2.83Å; D244-Y246 WeakPolarHBondContact OD1-CA 3.39Å; D244-Y246 WeakPolarHBondContact OD1-CB 3.31Å; D244-Y246 PolarHBondContact OD1-N 2.99Å; D244-G247 PolarHBondContact O-N 3.31Å; D244-G247 PolarHBondContact OD1-N 3.23Å; D244-G247 VanDerWaalsContact OD1-N 3.16Å; D244-R248 PolarHBondContact N-O 3.2Å; D244-R248 WeakPolarHBondContact OD1-CB 3.36Å; D244-R248 PolarHBondContact OD1-N 3.27Å; D244-R248 IonicContact OD1-NE 3.23Å; D244-R248 IonicContact OD2-CZ 2.95Å; D244-R248 IonicContact OD2-NE 2.99Å; D244-R248 PolarHBondContact OD2-NE 2.89Å; D244-R248 IonicContact OD2-NH2 3.51Å; D244-R248 PolarHBondContact OD2-NH2 3.03Å; D244-I250 HydrophobicContact CB-CD1 4.25Å
245	N	59.1	Low	65.9	Low	168 Å²	168	59 Å²	59	90%	0.898	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-6.2	178.6	-66	-14.7	0	0	0	114.3
246	Y	61.1	Low	67.6	Low	182 Å²	182	58.8 Å²	58.8	71%	0.714	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	7.9	177.4	-55	-77.1	0	0	0	112.7	D244 R248	D244-Y246 PolarHBondContact O-N 2.83Å; D244-Y246 WeakPolarHBondContact OD1-CA 3.39Å; D244-Y246 WeakPolarHBondContact OD1-CB 3.31Å; D244-Y246 PolarHBondContact OD1-N 2.99Å; Y246-R248 VanDerWaalsContact C-N 3.34Å
247	G	67.9	Low	69.4	Low	34 Å²	34	55.9 Å²	55.9	35%	0.351	28%	0.284	S	S	.	.	S	Bend	trans	78.3	13	-179.1	0	0	0	0	0	114.4	H243 D244	H243-G247 PolarHBondContact ND1-O 3.22Å; D244-G247 PolarHBondContact O-N 3.31Å; D244-G247 PolarHBondContact OD1-N 3.23Å; D244-G247 VanDerWaalsContact OD1-N 3.16Å
248	R	78.1	Confident	71	Confident	46 Å²	46	54 Å²	54	17%	0.174	28%	0.282	C	S	.	.			trans	-90.1	138.8	-177.2	-54.2	-179.8	-64.5	165.1	5.4	111.4	H243 D244 Y246 N371 W373	H243-R248 WeakPolarHBondContact CA-O 3.18Å; D244-R248 PolarHBondContact N-O 3.2Å; D244-R248 WeakPolarHBondContact OD1-CB 3.36Å; D244-R248 PolarHBondContact OD1-N 3.27Å; D244-R248 IonicContact OD1-NE 3.23Å; D244-R248 IonicContact OD2-CZ 2.95Å; D244-R248 IonicContact OD2-NE 2.99Å; D244-R248 PolarHBondContact OD2-NE 2.89Å; D244-R248 IonicContact OD2-NH2 3.51Å; D244-R248 PolarHBondContact OD2-NH2 3.03Å; Y246-R248 VanDerWaalsContact C-N 3.34Å; R248-N371 WeakPolarHBondContact CA-O 3.36Å; R248-N371 HydrophobicContact CG-CB 4.22Å; R248-W373 HydrophobicContact CB-CB 4.46Å; R248-W373 VanDerWaalsContact CZ-CE3 3.49Å
249	F	79.6	Confident	72.7	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.009	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.6	171	179.5	-113	0	0	0	109.8	I234 L239 I251 P266 L318 L370 N371 I372 W373	I234-F249 HydrophobicContact CD1-CE1 3.76Å; I234-F249 HydrophobicContact CD1-CE2 4.22Å; I234-F249 HydrophobicContact CD1-CZ 3.46Å; I234-F249 VanDerWaalsContact CD1-CZ 3.46Å; L239-F249 HydrophobicContact CD2-CD2 4.01Å; L239-F249 HydrophobicContact CD2-CE2 3.44Å; L239-F249 VanDerWaalsContact CD2-CE2 3.44Å; L239-F249 HydrophobicContact CD2-CZ 4.19Å; F249-I251 HydrophobicContact CD1-CD1 4.43Å; F249-I251 HydrophobicContact CD1-CG1 4.04Å; F249-I251 HydrophobicContact CE1-CD1 4.04Å; F249-I251 HydrophobicContact CE1-CG1 3.64Å; F249-P266 HydrophobicContact CD1-CG 3.83Å; F249-P266 HydrophobicContact CE1-CG 3.82Å; F249-L318 HydrophobicContact CE1-CD2 4.28Å; F249-L318 HydrophobicContact CZ-CD1 4.24Å; F249-L318 HydrophobicContact CZ-CD2 3.8Å; F249-L318 HydrophobicContact CZ-CG 4.46Å; F249-L370 HydrophobicContact CB-CD1 4.31Å; F249-N371 PolarHBondContact N-O 2.98Å; F249-I372 HydrophobicContact CD1-CG1 4.42Å; F249-I372 HydrophobicContact CD1-CG2 4.49Å; F249-I372 WeakPolarHBondContact O-CA 3.32Å; F249-W373 PolarHBondContact O-N 2.59Å
250	I	81.7	Confident	74.2	Confident	22 Å²	22	57.3 Å²	57.3	11%	0.113	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.5	-172.9	-51.4	-178.9	0	0	0	111	D244 N319 W373 R375	D244-I250 HydrophobicContact CB-CD1 4.25Å; I250-N319 WeakPolarHBondContact CB-OD1 3.41Å; I250-N319 PolarHBondContact N-OD1 3.1Å; I250-N319 PolarHBondContact O-N 3.3Å; I250-N319 PolarHBondContact O-OD1 3.2Å; I250-W373 WeakPolarHBondContact CA-O 3.46Å; I250-W373 HydrophobicContact CD1-CE3 3.76Å; I250-W373 HydrophobicContact CD1-CZ3 3.99Å; I250-W373 HydrophobicContact CG1-CE3 3.98Å; I250-R375 HydrophobicContact CG2-CG 4.11Å
251	I	86.4	Confident	76.2	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.5	167.5	-54.6	178.3	0	0	0	106.3	F249 I263 L265 V316 L318 I372 W373 L374 R375	F249-I251 HydrophobicContact CD1-CD1 4.43Å; F249-I251 HydrophobicContact CD1-CG1 4.04Å; F249-I251 HydrophobicContact CE1-CD1 4.04Å; F249-I251 HydrophobicContact CE1-CG1 3.64Å; I251-I263 HydrophobicContact CD1-CG2 4.34Å; I251-I263 HydrophobicContact CG2-CG2 4.2Å; I251-L265 HydrophobicContact CD1-CD2 3.93Å; I251-V316 HydrophobicContact CG2-CB 3.8Å; I251-V316 HydrophobicContact CG2-CG1 3.88Å; I251-V316 HydrophobicContact CG2-CG2 4.26Å; I251-L318 HydrophobicContact CG1-CD2 4.13Å; I251-L318 HydrophobicContact CG2-CD2 4.48Å; I251-I372 HydrophobicContact CD1-CG2 3.82Å; I251-I372 HydrophobicContact CG1-CG2 4.1Å; I251-W373 PolarHBondContact N-O 3.15Å; I251-W373 VanDerWaalsContact N-O 3.08Å; I251-L374 HydrophobicContact CB-CD1 4.02Å; I251-L374 HydrophobicContact CG2-CD1 3.86Å; I251-L374 CarbonylContact O-C 3.4Å; I251-L374 WeakPolarHBondContact O-CA 3.29Å; I251-R375 PolarHBondContact O-N 3.43Å
252	N	87.2	Confident	77.9	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.027	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	141.9	172.1	-38.1	-98.6	0	0	0	109.9	V316 Y317 N319 R375 L377	N252-V316 CarbonylContact O-C 3.51Å; N252-V316 WeakPolarHBondContact O-CA 3.19Å; N252-Y317 PolarHBondContact N-O 3.37Å; N252-Y317 PolarHBondContact ND2-O 3.2Å; N252-Y317 PolarHBondContact O-N 2.75Å; N252-N319 PolarHBondContact ND2-O 3.46Å; N252-R375 CarbonylContact C-O 3.37Å; N252-R375 VanDerWaalsContact CA-O 3.28Å; N252-R375 WeakPolarHBondContact CA-O 3.39Å; N252-R375 PolarHBondContact OD1-NH1 2.84Å; N252-L377 HydrophobicContact CB-CD1 3.71Å; N252-L377 HydrophobicContact CB-CD2 3.97Å; N252-L377 HydrophobicContact CB-CG 3.82Å
253	I	90	Very high	79.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.3	-179.3	-170.3	169.3	0	0	0	109.2	T257 I263 T314 I339 L343 L374 R375 I376 L377	I253-T257 HydrophobicContact CD1-CG2 4.11Å; I253-I263 HydrophobicContact CD1-CD1 3.83Å; I253-I263 HydrophobicContact CD1-CG1 3.87Å; I253-T314 HydrophobicContact CD1-CG2 3.45Å; I253-T314 VanDerWaalsContact CD1-CG2 3.45Å; I253-T314 HydrophobicContact CG1-CG2 4.22Å; I253-I339 HydrophobicContact CD1-CD1 3.8Å; I253-L343 HydrophobicContact CD1-CD1 3.85Å; I253-L343 HydrophobicContact CG1-CD1 4.32Å; I253-L343 HydrophobicContact CG2-CD1 3.68Å; I253-L374 HydrophobicContact CB-CD1 4.43Å; I253-L374 HydrophobicContact CG2-CD1 3.87Å; I253-L374 HydrophobicContact CG2-CG 4.49Å; I253-R375 PolarHBondContact N-O 2.84Å; I253-I376 HydrophobicContact CG2-CG1 3.96Å; I253-I376 CarbonylContact O-C 3.52Å; I253-I376 WeakPolarHBondContact O-CA 3.46Å; I253-L377 WeakPolarHBondContact O-CB 3.42Å; I253-L377 PolarHBondContact O-N 2.81Å
254	M	88.4	Confident	80.8	Confident	63 Å²	63	43.9 Å²	43.9	31%	0.31	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	147.4	172.1	-51.5	-44.8	-133.2	0	0	110.4	T257 Y317 L377	M254-T257 PolarHBondContact O-OG1 2.9Å; M254-Y317 HydrophobicContact CE-CE2 4.43Å; M254-Y317 HydrophobicContact SD-CE2 3.95Å; M254-L377 HydrophobicContact SD-CB 3.71Å; M254-L377 HydrophobicContact SD-CD1 3.66Å; M254-L377 HydrophobicContact SD-CG 4.32Å
255	E	90.7	Very high	82.3	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.009	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-177.6	159	74.5	-165.8	117.6	0	0	112.1	T257 R345 I376 L377 D378 E379	E255-T257 PolarHBondContact O-N 3.33Å; E255-R345 HydrophobicContact CB-CB 4.45Å; E255-R345 WeakPolarHBondContact OE1-CB 3.2Å; E255-R345 WeakPolarHBondContact OE2-CB 2.97Å; E255-R345 PolarHBondContact OE2-N 2.95Å; E255-I376 HydrophobicContact CB-CG2 3.59Å; E255-L377 PolarHBondContact N-O 2.7Å; E255-D378 WeakPolarHBondContact OE1-CA 3.37Å; E255-E379 HydrophobicContact CG-CB 4.11Å; E255-E379 HydrophobicContact CG-CG 4.24Å; E255-E379 PolarHBondContact OE1-N 2.84Å
256	N	88.3	Confident	83.4	Confident	70 Å²	70	34.4 Å²	34.4	37%	0.374	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	6.1	-169.1	-77.1	-61.6	0	0	0	114.9	P258 L343 D381	N256-P258 VanDerWaalsContact O-CD 3.23Å; N256-P258 WeakPolarHBondContact O-CD 3.3Å; N256-P258 VanDerWaalsContact O-N 3.15Å; N256-L343 PolarHBondContact N-O 3.2Å; N256-D381 PolarHBondContact ND2-OD2 3.37Å
257	T	87.7	Confident	84.6	Confident	8 Å²	8	28.6 Å²	28.6	5%	0.049	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-59	118.6	176.4	-73.4	0	0	0	0	108.9	I253 M254 E255 T314 I339	I253-T257 HydrophobicContact CD1-CG2 4.11Å; M254-T257 PolarHBondContact O-OG1 2.9Å; E255-T257 PolarHBondContact O-N 3.33Å; T257-T314 WeakPolarHBondContact CG2-OG1 3.4Å; T257-I339 HydrophobicContact CG2-CD1 3.53Å
258	P	83.3	Confident	85.5	Confident	59 Å²	59	27.1 Å²	27.1	38%	0.383	14%	0.144	S	C	.	.	P	Polyproline II helix	trans	-61.7	144.4	-178	-25.7	35.3	0	0	0	112.7	N256	N256-P258 VanDerWaalsContact O-CD 3.23Å; N256-P258 WeakPolarHBondContact O-CD 3.3Å; N256-P258 VanDerWaalsContact O-N 3.15Å
259	N	85.3	Confident	85.8	Confident	94 Å²	94	27.6 Å²	27.6	50%	0.503	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	160.2	168.9	62.3	-12.6	0	0	0	112.2	R261 I339 L340	N259-R261 PolarHBondContact O-N 3.36Å; N259-I339 WeakPolarHBondContact CA-O 3Å; N259-L340 WeakPolarHBondContact CB-O 3.33Å; N259-L340 PolarHBondContact ND2-O 3.2Å
260	G	82.9	Confident	86.1	Confident	40 Å²	40	28.5 Å²	28.5	41%	0.412	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-11.9	-171.1	0	0	0	0	0	114.8	I339	G260-I339 PolarHBondContact N-O 3.33Å
261	R	86.7	Confident	86.2	Confident	85 Å²	85	33.1 Å²	33.1	32%	0.321	18%	0.181	S	C	.	.			trans	-77	163.1	165	-66.7	-170.3	-178.3	167.6	5.3	111.3	N259 I312 I339	N259-R261 PolarHBondContact O-N 3.36Å; R261-I312 WeakPolarHBondContact CA-O 3.02Å; R261-I339 HydrophobicContact CB-CD1 4.42Å; R261-I339 WeakPolarHBondContact O-CB 3.32Å; R261-I339 PolarHBondContact O-N 3.21Å
262	W	86	Confident	86.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.4	177.2	62.7	-82.8	0	0	0	113.7	P264 I299 V302 S311 P313 T314 A327 A329 Y332 L337	W262-P264 HydrophobicContact CE3-CB 4.47Å; W262-P264 HydrophobicContact CZ3-CB 3.78Å; W262-I299 HydrophobicContact CB-CD1 4.38Å; W262-V302 HydrophobicContact CD2-CG1 4.11Å; W262-V302 HydrophobicContact CD2-CG2 4.47Å; W262-V302 HydrophobicContact CE3-CG1 4.19Å; W262-V302 HydrophobicContact CE3-CG2 3.87Å; W262-V302 HydrophobicContact CH2-CB 4.4Å; W262-V302 HydrophobicContact CH2-CG1 3.79Å; W262-V302 HydrophobicContact CH2-CG2 4.35Å; W262-V302 HydrophobicContact CZ2-CG1 3.7Å; W262-V302 HydrophobicContact CZ3-CB 4.33Å; W262-V302 HydrophobicContact CZ3-CG1 4.02Å; W262-V302 HydrophobicContact CZ3-CG2 3.79Å; W262-S311 PolarHBondContact NE1-O 3.15Å; W262-P313 HydrophobicContact CH2-CB 4.28Å; W262-P313 HydrophobicContact CZ2-CB 3.66Å; W262-P313 HydrophobicContact CZ2-CG 4.42Å; W262-T314 WeakPolarHBondContact O-CG2 3.43Å; W262-T314 PolarHBondContact O-N 3.3Å; W262-A327 HydrophobicContact CH2-CB 3.77Å; W262-A327 WeakPolarHBondContact CZ2-O 3.41Å; W262-A327 HydrophobicContact CZ3-CB 4.29Å; W262-A329 HydrophobicContact CZ2-CB 3.91Å; W262-Y332 HydrophobicContact CH2-CD1 4.04Å; W262-Y332 AromaticContact CZ3-CD1 3.95Å; W262-Y332 HydrophobicContact CZ3-CD1 3.95Å; W262-Y332 HydrophobicContact CZ3-CE1 4.33Å; W262-L337 CarbonylContact C-O 3.59Å; W262-L337 WeakPolarHBondContact CA-O 3.27Å; W262-L337 WeakPolarHBondContact CB-O 3.35Å
263	I	88	Confident	85.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.2	178.9	-63.7	164.3	0	0	0	108.5	I251 I253 L265 F296 T314 V316 G336 L337 I339 L374	I251-I263 HydrophobicContact CD1-CG2 4.34Å; I251-I263 HydrophobicContact CG2-CG2 4.2Å; I253-I263 HydrophobicContact CD1-CD1 3.83Å; I253-I263 HydrophobicContact CD1-CG1 3.87Å; I263-L265 HydrophobicContact CG2-CD2 4.44Å; I263-F296 HydrophobicContact CD1-CD1 4.49Å; I263-F296 HydrophobicContact CD1-CE1 3.89Å; I263-T314 HydrophobicContact CG1-CG2 3.75Å; I263-V316 HydrophobicContact CG2-CG1 4.25Å; I263-G336 CarbonylContact O-C 3.47Å; I263-G336 WeakPolarHBondContact O-CA 3.31Å; I263-L337 HydrophobicContact CB-CB 4.22Å; I263-L337 HydrophobicContact CD1-CD1 4.46Å; I263-L337 PolarHBondContact N-O 3.24Å; I263-L337 PolarHBondContact O-N 2.98Å; I263-I339 HydrophobicContact CD1-CD1 4.21Å; I263-I339 HydrophobicContact CD1-CG1 4.28Å; I263-I339 HydrophobicContact CG1-CD1 4.2Å; I263-I339 HydrophobicContact CG1-CG1 4.43Å; I263-L374 HydrophobicContact CD1-CD1 4.08Å; I263-L374 HydrophobicContact CD1-CD2 3.81Å
264	P	83.3	Confident	85	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.039	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	140	172.6	29.1	-33.7	0	0	0	111.6	F235 W262 V316 A327 Y332	F235-P264 HydrophobicContact CE2-CG 4.41Å; F235-P264 HydrophobicContact CZ-CB 3.84Å; F235-P264 HydrophobicContact CZ-CG 3.77Å; W262-P264 HydrophobicContact CE3-CB 4.47Å; W262-P264 HydrophobicContact CZ3-CB 3.78Å; P264-V316 HydrophobicContact CG-CG2 4.39Å; P264-A327 HydrophobicContact CB-CB 3.85Å; P264-A327 HydrophobicContact CG-CB 4Å; P264-Y332 HydrophobicContact CB-CE1 4.39Å
265	L	86.6	Confident	84.7	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	23%	0.233	C	C	.	.			trans	-109.7	171.2	179	-66.4	-177.6	0	0	0	112.7	I251 I263 L298 Y332 P335 L337 F353 L355 I372	I251-L265 HydrophobicContact CD1-CD2 3.93Å; I263-L265 HydrophobicContact CG2-CD2 4.44Å; L265-L298 HydrophobicContact CD1-CD1 4.09Å; L265-Y332 PolarHBondContact O-OH 2.73Å; L265-P335 HydrophobicContact CB-CB 4.36Å; L265-P335 HydrophobicContact CB-CG 4.03Å; L265-P335 WeakPolarHBondContact CB-O 3.37Å; L265-P335 HydrophobicContact CD1-CB 4.45Å; L265-P335 PolarHBondContact N-O 3.07Å; L265-L337 HydrophobicContact CD1-CD2 3.94Å; L265-L337 HydrophobicContact CD1-CG 3.96Å; L265-L337 HydrophobicContact CD2-CD1 4.34Å; L265-L337 HydrophobicContact CD2-CG 4.17Å; L265-L337 HydrophobicContact CG-CG 4.27Å; L265-F353 HydrophobicContact CD1-CE2 4.42Å; L265-F353 HydrophobicContact CD2-CE2 4.34Å; L265-F353 HydrophobicContact CD2-CZ 3.88Å; L265-L355 HydrophobicContact CB-CD2 4.05Å; L265-L355 HydrophobicContact CD1-CD1 4.09Å; L265-L355 HydrophobicContact CD1-CD2 4.14Å; L265-I372 HydrophobicContact CD2-CD1 4.14Å
266	P	82.9	Confident	84.3	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	24%	0.239	C	C	.	.			trans	-68.9	133.3	172.1	-17.7	32.8	0	0	0	111.4	F230 I234 F249 L370 I372	F230-P266 HydrophobicContact CD1-CB 4.17Å; I234-P266 HydrophobicContact CD1-CB 3.77Å; I234-P266 HydrophobicContact CD1-CG 3.7Å; I234-P266 HydrophobicContact CG1-CB 4.45Å; F249-P266 HydrophobicContact CD1-CG 3.83Å; F249-P266 HydrophobicContact CE1-CG 3.82Å; P266-L370 HydrophobicContact CB-CD2 3.59Å; P266-L370 HydrophobicContact CG-CD2 3.57Å; P266-I372 HydrophobicContact CG-CD1 3.9Å
267	K	85.5	Confident	84.1	Confident	61 Å²	61	40.1 Å²	40.1	27%	0.265	24%	0.237	S	C	.	.			trans	-90.7	144.5	177	-171.4	176.1	178.5	167.3	0	111.1	Q231 Y281 N333	Q231-K267 PolarHBondContact N-O 3.09Å; K267-Y281 WeakPolarHBondContact CG-OH 3.45Å; K267-N333 PolarHBondContact NZ-O 3.3Å; K267-N333 PolarHBondContact NZ-OD1 2.98Å
268	A	86.3	Confident	84	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.017	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	156.3	168.8	0	0	0	0	0	112.3	P228 K229 F230 V279 Y281 A357	P228-A268 HydrophobicContact CB-CB 4.35Å; K229-A268 CarbonylContact O-C 3.53Å; K229-A268 VanDerWaalsContact O-CA 3.28Å; K229-A268 WeakPolarHBondContact O-CA 3.21Å; F230-A268 HydrophobicContact CD1-CB 3.89Å; F230-A268 HydrophobicContact CE1-CB 4.1Å; F230-A268 HydrophobicContact CG-CB 4.16Å; A268-V279 HydrophobicContact CB-CG1 4.32Å; A268-Y281 HydrophobicContact CB-CE1 4.14Å; A268-Y281 PolarHBondContact N-OH 3.25Å; A268-Y281 PolarHBondContact O-OH 2.7Å; A268-A357 HydrophobicContact CB-CB 3.53Å
269	T	85	Confident	84.2	Confident	57 Å²	57	44.6 Å²	44.6	35%	0.35	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	134.7	173	42.2	0	0	0	0	109.7	K229 Q231	K229-T269 PolarHBondContact N-O 3.44Å; K229-T269 PolarHBondContact O-N 2.7Å; Q231-T269 HydrophobicContact CG-CG2 4.46Å; Q231-T269 PolarHBondContact NE2-OG1 2.82Å
270	D	86.3	Confident	84.4	Confident	20 Å²	20	44.5 Å²	44.5	11%	0.107	25%	0.245	C	C	.	.			trans	-87.5	173.3	165.8	-137.4	-49.4	0	0	0	111.6	N226 A227 P228	N226-D270 VanDerWaalsContact CB-OD1 3.29Å; N226-D270 WeakPolarHBondContact CB-OD1 3.43Å; A227-D270 WeakPolarHBondContact CA-OD2 3.46Å; A227-D270 PolarHBondContact N-OD1 3Å; P228-D270 WeakPolarHBondContact CA-OD2 3.37Å; P228-D270 WeakPolarHBondContact CD-OD2 3.32Å; P228-D270 VanDerWaalsContact CG-OD2 3.31Å; P228-D270 WeakPolarHBondContact CG-OD2 3.48Å
271	L	84.2	Confident	84.9	Confident	119 Å²	119	43.6 Å²	43.6	62%	0.623	23%	0.23	S	C	*	.	S	Bend	trans	-112.5	-17.8	175.9	-60.6	178.8	0	0	0	113.5	N226	N226-L271 HydrophobicContact CB-CB 4.1Å
272	D	83.4	Confident	85.2	Confident	9 Å²	9	42 Å²	42	5%	0.048	23%	0.232	C	C	.	.	S	Bend	trans	-73	-179	178.3	-59.6	-14.5	0	0	0	111.7	N224 D225 N226 N276 A277	N224-D272 VanDerWaalsContact C-OD2 3.28Å; N224-D272 VanDerWaalsContact CA-OD2 3.26Å; N224-D272 WeakPolarHBondContact CA-OD2 3.07Å; D225-D272 PolarHBondContact N-OD2 2.8Å; N226-D272 VanDerWaalsContact CB-OD1 3.25Å; N226-D272 WeakPolarHBondContact CB-OD1 3.36Å; N226-D272 PolarHBondContact N-OD1 3.33Å; N226-D272 VanDerWaalsContact N-OD1 3.14Å; N226-D272 PolarHBondContact N-OD2 3.07Å; N226-D272 PolarHBondContact ND2-OD1 3.02Å; D272-N276 HydrophobicContact CB-CB 3.38Å; D272-A277 VanDerWaalsContact O-CB 3.25Å; D272-A277 WeakPolarHBondContact O-CB 3.29Å
273	E	75.5	Confident	85.4	Confident	49 Å²	49	43.9 Å²	43.9	23%	0.229	24%	0.241	C	C	.	.			trans	-108.4	157.2	-175.1	-142.2	-174.5	134.1	0	0	114.9	R148 D222 L275 N276 A277	R148-E273 IonicContact CZ-OE2 3.81Å; R148-E273 IonicContact NE-OE2 3.73Å; R148-E273 IonicContact NH2-OE2 2.74Å; R148-E273 PolarHBondContact NH2-OE2 3.31Å; D222-E273 HydrophobicContact CB-CB 4.19Å; D222-E273 PolarHBondContact OD1-N 2.92Å; D222-E273 PolarHBondContact OD2-N 2.84Å; E273-L275 PolarHBondContact O-N 3.08Å; E273-L275 VanDerWaalsContact O-N 3.09Å; E273-N276 VanDerWaalsContact O-CB 3.32Å; E273-N276 WeakPolarHBondContact O-CB 3.49Å; E273-N276 PolarHBondContact O-N 2.9Å; E273-A277 PolarHBondContact O-N 3.03Å
274	G	78.8	Confident	85.5	Confident	56 Å²	56	49.8 Å²	49.8	58%	0.577	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	-110.8	167.8	0	0	0	0	0	114.8
275	L	82.4	Confident	85.8	Confident	111 Å²	111	50.8 Å²	50.8	58%	0.581	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-29.7	177.4	-70.7	176.7	0	0	0	112.5	E273 A277 Y278 M360 G361	E273-L275 PolarHBondContact O-N 3.08Å; E273-L275 VanDerWaalsContact O-N 3.09Å; L275-A277 PolarHBondContact O-N 2.71Å; L275-Y278 PolarHBondContact O-N 2.85Å; L275-Y278 VanDerWaalsContact O-N 3.15Å; L275-M360 HydrophobicContact CB-CB 4.31Å; L275-M360 HydrophobicContact CD2-CB 4.25Å; L275-M360 CarbonylContact O-C 3.59Å; L275-M360 WeakPolarHBondContact O-CA 3.47Å; L275-M360 WeakPolarHBondContact O-CB 3.46Å; L275-M360 PolarHBondContact O-N 2.74Å; L275-M360 VanDerWaalsContact O-N 3.08Å; L275-G361 PolarHBondContact O-N 3.27Å
276	N	82.8	Confident	85.4	Confident	25 Å²	25	53.7 Å²	53.7	13%	0.134	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-35.5	171.1	-55.4	-16.2	0	0	0	109.4	D222 N224 D272 E273 Y278 D359 G361	D222-N276 PolarHBondContact OD2-ND2 2.84Å; N224-N276 HydrophobicContact CB-CB 4.45Å; N224-N276 PolarHBondContact N-ND2 2.83Å; N224-N276 WeakPolarHBondContact OD1-CA 3.29Å; N224-N276 WeakPolarHBondContact OD1-CB 3.48Å; N224-N276 VanDerWaalsContact OD1-CG 3.28Å; N224-N276 PolarHBondContact OD1-OD1 3.39Å; D272-N276 HydrophobicContact CB-CB 3.38Å; E273-N276 VanDerWaalsContact O-CB 3.32Å; E273-N276 WeakPolarHBondContact O-CB 3.49Å; E273-N276 PolarHBondContact O-N 2.9Å; N276-Y278 VanDerWaalsContact C-N 3.31Å; N276-Y278 PolarHBondContact O-N 3.1Å; N276-D359 WeakPolarHBondContact O-CB 3.34Å; N276-G361 WeakPolarHBondContact OD1-CA 3.41Å
277	A	82.8	Confident	85	Confident	40 Å²	40	59.8 Å²	59.8	33%	0.331	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-20	172.6	0	0	0	0	0	115.4	D272 E273 L275 V279	D272-A277 VanDerWaalsContact O-CB 3.25Å; D272-A277 WeakPolarHBondContact O-CB 3.29Å; E273-A277 PolarHBondContact O-N 3.03Å; L275-A277 PolarHBondContact O-N 2.71Å; A277-V279 PolarHBondContact O-N 3.29Å
278	Y	86.6	Confident	84	Confident	136 Å²	136	63.6 Å²	63.6	53%	0.533	35%	0.346	S	S	.	.			trans	-89.2	101.4	-163.2	-170.2	-83.9	0	0	0	112	L275 N276 Q280 D359 M360	L275-Y278 PolarHBondContact O-N 2.85Å; L275-Y278 VanDerWaalsContact O-N 3.15Å; N276-Y278 VanDerWaalsContact C-N 3.31Å; N276-Y278 PolarHBondContact O-N 3.1Å; Y278-Q280 HydrophobicContact CD1-CG 4.23Å; Y278-Q280 HydrophobicContact CE1-CG 3.92Å; Y278-D359 CarbonylContact O-C 3.57Å; Y278-D359 WeakPolarHBondContact O-CA 3.47Å; Y278-M360 HydrophobicContact CD1-CG 3.65Å; Y278-M360 HydrophobicContact CE1-CG 4.47Å; Y278-M360 HydrophobicContact CG-CG 4.45Å; Y278-M360 PolarHBondContact O-N 2.81Å
279	V	87.3	Confident	83.1	Confident	25 Å²	25	66.6 Å²	66.6	15%	0.152	36%	0.36	C	S	.	.			trans	-83.8	120.1	-178.1	-173.2	0	0	0	0	112.2	P228 A268 A277 Y281 A357 T358	P228-V279 HydrophobicContact CB-CG1 4.08Å; P228-V279 HydrophobicContact CB-CG2 3.85Å; P228-V279 HydrophobicContact CG-CG1 4.48Å; P228-V279 HydrophobicContact CG-CG2 4.11Å; A268-V279 HydrophobicContact CB-CG1 4.32Å; A277-V279 PolarHBondContact O-N 3.29Å; V279-Y281 HydrophobicContact CG1-CE1 4.07Å; V279-Y281 HydrophobicContact CG1-CE2 4.15Å; V279-A357 HydrophobicContact CG1-CB 3.67Å; V279-T358 CarbonylContact C-O 3.56Å; V279-T358 WeakPolarHBondContact CA-O 3.26Å
280	Q	89.6	Confident	82.3	Confident	91 Å²	91	69 Å²	69	43%	0.425	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	153.9	160.7	-67.3	-166.6	-17.7	0	0	111	Y278 A357 T358 M360	Y278-Q280 HydrophobicContact CD1-CG 4.23Å; Y278-Q280 HydrophobicContact CE1-CG 3.92Å; Q280-A357 WeakPolarHBondContact O-CA 3.25Å; Q280-T358 PolarHBondContact N-O 2.95Å; Q280-T358 PolarHBondContact O-N 3.26Å; Q280-M360 HydrophobicContact CG-CG 4.21Å; Q280-M360 HydrophobicContact CG-SD 3.92Å
281	Y	93	Very high	82.1	Confident	22 Å²	22	70.3 Å²	70.3	9%	0.086	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	150.5	176.2	-62.1	-83.4	0	0	0	111.6	F230 K267 A268 V279 D300 P335 L355 I356 A357	F230-Y281 HydrophobicContact CE1-CE1 4.15Å; K267-Y281 WeakPolarHBondContact CG-OH 3.45Å; A268-Y281 HydrophobicContact CB-CE1 4.14Å; A268-Y281 PolarHBondContact N-OH 3.25Å; A268-Y281 PolarHBondContact O-OH 2.7Å; V279-Y281 HydrophobicContact CG1-CE1 4.07Å; V279-Y281 HydrophobicContact CG1-CE2 4.15Å; Y281-D300 HydrophobicContact CD2-CB 4.39Å; Y281-P335 HydrophobicContact CD1-CB 4.3Å; Y281-P335 HydrophobicContact CD1-CG 3.84Å; Y281-P335 HydrophobicContact CD2-CB 3.91Å; Y281-P335 HydrophobicContact CD2-CG 3.99Å; Y281-P335 HydrophobicContact CE1-CG 3.79Å; Y281-P335 HydrophobicContact CE2-CB 4.32Å; Y281-P335 HydrophobicContact CE2-CG 3.98Å; Y281-P335 HydrophobicContact CG-CB 3.92Å; Y281-P335 HydrophobicContact CG-CG 3.94Å; Y281-L355 HydrophobicContact CD1-CD1 4.25Å; Y281-L355 HydrophobicContact CD1-CG 4.43Å; Y281-I356 CarbonylContact C-O 3.17Å; Y281-I356 WeakPolarHBondContact CA-O 3.4Å; Y281-A357 HydrophobicContact CD1-CB 3.98Å; Y281-A357 HydrophobicContact CE1-CB 3.76Å
282	S	92.5	Very high	82.3	Confident	51 Å²	51	65.3 Å²	65.3	36%	0.357	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	160.4	169.3	59.9	0	0	0	0	109.9	I356	S282-I356 PolarHBondContact N-O 3.37Å; S282-I356 PolarHBondContact O-N 3.38Å
283	I	91.7	Very high	82.5	Confident	39 Å²	39	70.3 Å²	70.3	20%	0.2	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.7	177.2	-74.7	175.3	0	0	0	109.9	L285 W292 L298 L337 F353 I354 L355	I283-L285 HydrophobicContact CG2-CD2 3.93Å; I283-W292 HydrophobicContact CD1-CH2 4.24Å; I283-W292 HydrophobicContact CD1-CZ2 3.72Å; I283-W292 HydrophobicContact CG2-CZ2 4.04Å; I283-L298 HydrophobicContact CD1-CB 4.35Å; I283-L298 HydrophobicContact CD1-CD1 4.02Å; I283-L298 HydrophobicContact CD1-CD2 4.49Å; I283-L298 HydrophobicContact CG1-CD2 4.28Å; I283-L337 HydrophobicContact CD1-CD2 3.54Å; I283-F353 HydrophobicContact CD1-CD2 3.74Å; I283-F353 HydrophobicContact CD1-CE2 3.75Å; I283-F353 HydrophobicContact CG1-CD2 3.96Å; I283-F353 HydrophobicContact CG1-CE2 4.28Å; I283-F353 HydrophobicContact CG2-CB 3.89Å; I283-F353 HydrophobicContact CG2-CD2 3.92Å; I283-F353 HydrophobicContact CG2-CG 4.27Å; I283-I354 WeakPolarHBondContact CA-O 3.37Å; I283-L355 HydrophobicContact CD1-CD1 4.4Å; I283-L355 HydrophobicContact CG1-CD1 3.92Å
284	K	89.9	Confident	83.1	Confident	125 Å²	125	72.5 Å²	72.5	54%	0.543	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.6	172.7	177.8	178	179.5	179.7	0	109.3	I354 I356	K284-I354 HydrophobicContact CB-CB 4.29Å; K284-I354 PolarHBondContact N-O 3.47Å; K284-I354 WeakPolarHBondContact O-CB 3.47Å; K284-I354 PolarHBondContact O-N 3.01Å; K284-I356 HydrophobicContact CB-CD1 3.74Å; K284-I356 HydrophobicContact CD-CD1 4.17Å
285	L	88.6	Confident	83.7	Confident	26 Å²	26	69.9 Å²	69.9	14%	0.136	37%	0.371	C	S	.	.			trans	-83.4	128.6	175	-54.4	176.3	0	0	0	108.8	I283 N287 W292 F353	I283-L285 HydrophobicContact CG2-CD2 3.93Å; L285-N287 PolarHBondContact O-N 2.81Å; L285-W292 HydrophobicContact CD1-CB 3.51Å; L285-W292 HydrophobicContact CD1-CD2 4.4Å; L285-W292 HydrophobicContact CD1-CG 3.68Å; L285-W292 HydrophobicContact CD2-CB 4.25Å; L285-W292 HydrophobicContact CD2-CD2 3.59Å; L285-W292 HydrophobicContact CD2-CE3 3.75Å; L285-W292 HydrophobicContact CD2-CG 3.79Å; L285-W292 HydrophobicContact CD2-CZ3 4.38Å; L285-W292 HydrophobicContact CG-CG 4.33Å; L285-F353 HydrophobicContact CD2-CB 3.93Å
286	P	79.4	Confident	84.1	Confident	63 Å²	63	64.7 Å²	64.7	41%	0.409	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-34.6	-178.9	-26.6	35.5	0	0	0	113.9	L352 I354	P286-L352 WeakPolarHBondContact CD-O 3.49Å; P286-L352 HydrophobicContact CG-CD2 4.25Å; P286-L352 HydrophobicContact CG-CG 4.2Å; P286-I354 HydrophobicContact CG-CG1 4.44Å
287	N	73.2	Confident	84.5	Confident	129 Å²	129	69.6 Å²	69.6	69%	0.69	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	6.6	-171.5	-62.7	-19.7	0	0	0	114.1	L285 E289	L285-N287 PolarHBondContact O-N 2.81Å; N287-E289 HydrophobicContact CB-CG 4.24Å
288	N	66.1	Low	84.9	Confident	140 Å²	140	69.7 Å²	69.7	75%	0.749	36%	0.359	S	S	*	.			trans	49.3	54.4	-166	-81.8	1.3	0	0	0	112.7	P290	N288-P290 WeakPolarHBondContact O-CD 3.49Å; N288-P290 VanDerWaalsContact O-N 3.17Å
289	E	67.4	Low	84.9	Confident	65 Å²	65	64 Å²	64	30%	0.304	34%	0.337	S	S	.	.			trans	-61.5	118.9	-179.9	-63.1	-160.9	153.9	0	0	111	N287 V291 W292	N287-E289 HydrophobicContact CB-CG 4.24Å; E289-V291 VanDerWaalsContact C-N 3.29Å; E289-V291 PolarHBondContact O-N 3.42Å; E289-W292 PolarHBondContact O-N 2.87Å
290	P	66.7	Low	84.7	Confident	108 Å²	108	66.8 Å²	66.8	70%	0.701	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-33.9	-171.3	25.4	-33.4	0	0	0	111.9	N288 W292	N288-P290 WeakPolarHBondContact O-CD 3.49Å; N288-P290 VanDerWaalsContact O-N 3.17Å; P290-W292 VanDerWaalsContact C-N 3.28Å; P290-W292 PolarHBondContact O-N 3.13Å
291	V	83	Confident	84.4	Confident	48 Å²	48	64.4 Å²	64.4	29%	0.291	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-13.9	-174.1	-142.2	0	0	0	0	113.3	E289 N293 D294 Y295 I348	E289-V291 VanDerWaalsContact C-N 3.29Å; E289-V291 PolarHBondContact O-N 3.42Å; V291-N293 PolarHBondContact O-N 3.09Å; V291-D294 HydrophobicContact CG1-CB 4.27Å; V291-D294 WeakPolarHBondContact O-CB 3.44Å; V291-D294 PolarHBondContact O-N 3.15Å; V291-Y295 HydrophobicContact CB-CD2 4.48Å; V291-Y295 HydrophobicContact CB-CE2 4.42Å; V291-Y295 HydrophobicContact CG1-CD2 3.97Å; V291-Y295 HydrophobicContact CG1-CE2 3.64Å; V291-Y295 WeakPolarHBondContact O-CD2 3.34Å; V291-Y295 PolarHBondContact O-N 2.68Å; V291-I348 HydrophobicContact CB-CD1 4.24Å; V291-I348 HydrophobicContact CG1-CD1 4.33Å; V291-I348 HydrophobicContact CG2-CD1 4.45Å
292	W	87.8	Confident	83.6	Confident	13 Å²	13	63.9 Å²	63.9	5%	0.049	34%	0.341	C	S	.	.	H	α-helix	trans	-53.8	-41.6	-178.4	169.6	-87.7	0	0	0	112.6	I283 L285 E289 P290 D294 Y295 F296 L337 F351 F353	I283-W292 HydrophobicContact CD1-CH2 4.24Å; I283-W292 HydrophobicContact CD1-CZ2 3.72Å; I283-W292 HydrophobicContact CG2-CZ2 4.04Å; L285-W292 HydrophobicContact CD1-CB 3.51Å; L285-W292 HydrophobicContact CD1-CD2 4.4Å; L285-W292 HydrophobicContact CD1-CG 3.68Å; L285-W292 HydrophobicContact CD2-CB 4.25Å; L285-W292 HydrophobicContact CD2-CD2 3.59Å; L285-W292 HydrophobicContact CD2-CE3 3.75Å; L285-W292 HydrophobicContact CD2-CG 3.79Å; L285-W292 HydrophobicContact CD2-CZ3 4.38Å; L285-W292 HydrophobicContact CG-CG 4.33Å; E289-W292 PolarHBondContact O-N 2.87Å; P290-W292 VanDerWaalsContact C-N 3.28Å; P290-W292 PolarHBondContact O-N 3.13Å; W292-D294 PolarHBondContact O-N 3.47Å; W292-Y295 PolarHBondContact O-N 2.84Å; W292-F296 HydrophobicContact CD2-CB 4.39Å; W292-F296 HydrophobicContact CD2-CD2 4.2Å; W292-F296 AromaticContact CE3-CD2 3.79Å; W292-F296 HydrophobicContact CE3-CD2 3.79Å; W292-F296 HydrophobicContact CE3-CE2 4.5Å; W292-F296 HydrophobicContact CH2-CB 4.21Å; W292-F296 HydrophobicContact CH2-CD2 4.05Å; W292-F296 HydrophobicContact CH2-CG 4.3Å; W292-F296 HydrophobicContact CZ2-CB 3.83Å; W292-F296 HydrophobicContact CZ2-CD2 4.41Å; W292-F296 HydrophobicContact CZ2-CG 4.42Å; W292-F296 AromaticContact CZ3-CD2 3.72Å; W292-F296 HydrophobicContact CZ3-CD2 3.72Å; W292-F296 HydrophobicContact CZ3-CE2 4.3Å; W292-F296 HydrophobicContact CZ3-CG 4.42Å; W292-F296 PolarHBondContact O-N 2.97Å; W292-L337 HydrophobicContact CH2-CD1 3.78Å; W292-L337 HydrophobicContact CH2-CD2 4.07Å; W292-L337 HydrophobicContact CZ2-CD1 4.34Å; W292-L337 HydrophobicContact CZ2-CD2 3.83Å; W292-F351 HydrophobicContact CE3-CB 4.34Å; W292-F351 AromaticContact CE3-CD1 3.98Å; W292-F351 HydrophobicContact CE3-CD1 3.98Å; W292-F351 HydrophobicContact CE3-CG 4.42Å; W292-F351 HydrophobicContact CZ3-CB 4.05Å; W292-F351 HydrophobicContact CZ3-CD1 4.47Å; W292-F351 HydrophobicContact CZ3-CG 4.46Å; W292-F353 HydrophobicContact CH2-CB 4.15Å; W292-F353 AromaticContact CH2-CD1 3.58Å; W292-F353 HydrophobicContact CH2-CD1 3.58Å; W292-F353 HydrophobicContact CH2-CD2 4.1Å; W292-F353 AromaticContact CH2-CE1 3.9Å; W292-F353 HydrophobicContact CH2-CE1 3.9Å; W292-F353 HydrophobicContact CH2-CE2 4.37Å; W292-F353 AromaticContact CH2-CG 3.69Å; W292-F353 HydrophobicContact CH2-CG 3.69Å; W292-F353 HydrophobicContact CH2-CZ 4.28Å; W292-F353 HydrophobicContact CZ3-CB 4.08Å; W292-F353 AromaticContact CZ3-CD1 3.6Å; W292-F353 HydrophobicContact CZ3-CD1 3.6Å; W292-F353 HydrophobicContact CZ3-CE1 4.19Å; W292-F353 AromaticContact CZ3-CG 3.93Å; W292-F353 HydrophobicContact CZ3-CG 3.93Å
293	N	88.3	Confident	82.7	Confident	114 Å²	114	65.6 Å²	65.6	61%	0.61	34%	0.343	S	S	*	.	H	α-helix	trans	-72.5	-15.1	-178.3	-59.9	-58.7	0	0	0	113.4	V291 L340	V291-N293 PolarHBondContact O-N 3.09Å; N293-L340 VanDerWaalsContact O-CD1 3.32Å; N293-L340 WeakPolarHBondContact O-CD1 3.37Å
294	D	87.8	Confident	81.6	Confident	95 Å²	95	69.7 Å²	69.7	51%	0.508	37%	0.365	S	S	.	.	H	α-helix	trans	-83.7	-24.7	175.2	-55.5	-41.7	0	0	0	111.3	V291 W292 L340 K341	V291-D294 HydrophobicContact CG1-CB 4.27Å; V291-D294 WeakPolarHBondContact O-CB 3.44Å; V291-D294 PolarHBondContact O-N 3.15Å; W292-D294 PolarHBondContact O-N 3.47Å; D294-L340 WeakPolarHBondContact O-CB 3.31Å; D294-K341 VanDerWaalsContact O-CB 3.29Å; D294-K341 WeakPolarHBondContact O-CB 3.44Å; D294-K341 PolarHBondContact O-N 2.63Å
295	Y	90.6	Very high	80.4	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	35%	0.352	C	S	.	.	H	α-helix	trans	-101.2	-39	179.4	-73.6	-84.3	0	0	0	114.4	V291 W292 I339 L340 K341 T342 L343 E347 I348 F351	V291-Y295 HydrophobicContact CB-CD2 4.48Å; V291-Y295 HydrophobicContact CB-CE2 4.42Å; V291-Y295 HydrophobicContact CG1-CD2 3.97Å; V291-Y295 HydrophobicContact CG1-CE2 3.64Å; V291-Y295 WeakPolarHBondContact O-CD2 3.34Å; V291-Y295 PolarHBondContact O-N 2.68Å; W292-Y295 PolarHBondContact O-N 2.84Å; Y295-I339 CarbonylContact O-C 3.32Å; Y295-I339 WeakPolarHBondContact O-CA 3.43Å; Y295-L340 PolarHBondContact O-N 2.67Å; Y295-K341 HydrophobicContact CD1-CB 3.97Å; Y295-K341 HydrophobicContact CD1-CD 4.2Å; Y295-K341 HydrophobicContact CD1-CG 4.3Å; Y295-K341 HydrophobicContact CE1-CB 4.24Å; Y295-K341 HydrophobicContact CE1-CD 3.7Å; Y295-K341 HydrophobicContact CE1-CG 4.05Å; Y295-K341 HydrophobicContact CE2-CD 4.26Å; Y295-K341 PolarHBondContact OH-NZ 3.4Å; Y295-T342 WeakPolarHBondContact CE1-O 3.39Å; Y295-L343 HydrophobicContact CD1-CD2 3.72Å; Y295-L343 HydrophobicContact CE1-CD2 4.25Å; Y295-E347 PolarHBondContact OH-OE1 2.97Å; Y295-E347 PolarHBondContact OH-OE2 3.03Å; Y295-I348 HydrophobicContact CD2-CD1 4.28Å; Y295-I348 HydrophobicContact CE2-CD1 3.58Å; Y295-I348 HydrophobicContact CE2-CG1 4.49Å; Y295-F351 HydrophobicContact CD1-CZ 4.45Å; Y295-F351 HydrophobicContact CD2-CE1 4.19Å; Y295-F351 AromaticContact CD2-CZ 3.68Å; Y295-F351 HydrophobicContact CD2-CZ 3.68Å; Y295-F351 HydrophobicContact CE2-CZ 4.09Å; Y295-F351 AromaticContact CG-CZ 3.86Å; Y295-F351 HydrophobicContact CG-CZ 3.86Å
296	F	92	Very high	79.1	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.009	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	143	-169.1	-55.3	-70.2	0	0	0	114.9	I263 W292 L337 L338 I339 L343 F351 L374	I263-F296 HydrophobicContact CD1-CD1 4.49Å; I263-F296 HydrophobicContact CD1-CE1 3.89Å; W292-F296 HydrophobicContact CD2-CB 4.39Å; W292-F296 HydrophobicContact CD2-CD2 4.2Å; W292-F296 AromaticContact CE3-CD2 3.79Å; W292-F296 HydrophobicContact CE3-CD2 3.79Å; W292-F296 HydrophobicContact CE3-CE2 4.5Å; W292-F296 HydrophobicContact CH2-CB 4.21Å; W292-F296 HydrophobicContact CH2-CD2 4.05Å; W292-F296 HydrophobicContact CH2-CG 4.3Å; W292-F296 HydrophobicContact CZ2-CB 3.83Å; W292-F296 HydrophobicContact CZ2-CD2 4.41Å; W292-F296 HydrophobicContact CZ2-CG 4.42Å; W292-F296 AromaticContact CZ3-CD2 3.72Å; W292-F296 HydrophobicContact CZ3-CD2 3.72Å; W292-F296 HydrophobicContact CZ3-CE2 4.3Å; W292-F296 HydrophobicContact CZ3-CG 4.42Å; W292-F296 PolarHBondContact O-N 2.97Å; F296-L337 HydrophobicContact CB-CB 4.45Å; F296-L337 HydrophobicContact CD1-CB 4.09Å; F296-L337 HydrophobicContact CD1-CD1 4.19Å; F296-L337 HydrophobicContact CG-CD1 4.3Å; F296-L338 WeakPolarHBondContact CA-O 3.45Å; F296-I339 HydrophobicContact CD1-CG1 4.38Å; F296-I339 HydrophobicContact CE1-CG1 4.14Å; F296-L343 HydrophobicContact CE1-CD2 4.18Å; F296-L343 HydrophobicContact CZ-CD2 3.83Å; F296-F351 HydrophobicContact CE2-CD1 4.16Å; F296-F351 AromaticContact CE2-CD2 3.57Å; F296-F351 HydrophobicContact CE2-CD2 3.57Å; F296-F351 HydrophobicContact CE2-CE1 4.14Å; F296-F351 AromaticContact CE2-CE2 3.57Å; F296-F351 HydrophobicContact CE2-CE2 3.57Å; F296-F351 AromaticContact CE2-CG 3.87Å; F296-F351 HydrophobicContact CE2-CG 3.87Å; F296-F351 AromaticContact CE2-CZ 3.84Å; F296-F351 HydrophobicContact CE2-CZ 3.84Å; F296-F351 HydrophobicContact CZ-CD2 4.12Å; F296-F351 HydrophobicContact CZ-CE2 4.07Å; F296-L374 HydrophobicContact CE1-CD2 3.88Å; F296-L374 HydrophobicContact CE2-CD2 3.99Å; F296-L374 HydrophobicContact CZ-CD2 3.46Å; F296-L374 VanDerWaalsContact CZ-CD2 3.46Å
297	K	90.3	Very high	78.2	Confident	128 Å²	128	71.5 Å²	71.5	56%	0.557	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.3	167.7	175	178.8	177	-174.8	0	110.9	L337 L338 L340	K297-L337 CarbonylContact O-C 3.48Å; K297-L337 WeakPolarHBondContact O-CA 3.37Å; K297-L338 HydrophobicContact CB-CB 4.37Å; K297-L338 PolarHBondContact N-O 2.64Å; K297-L338 PolarHBondContact O-N 2.87Å; K297-L340 HydrophobicContact CB-CD1 4.13Å; K297-L340 HydrophobicContact CB-CD2 4.24Å; K297-L340 HydrophobicContact CB-CG 4.44Å
298	L	91.3	Very high	77.4	Confident	43 Å²	43	71.7 Å²	71.7	23%	0.225	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	141.1	173	-179.1	64.2	0	0	0	111.4	L265 I283 P335 G336 L337 L355	L265-L298 HydrophobicContact CD1-CD1 4.09Å; I283-L298 HydrophobicContact CD1-CB 4.35Å; I283-L298 HydrophobicContact CD1-CD1 4.02Å; I283-L298 HydrophobicContact CD1-CD2 4.49Å; I283-L298 HydrophobicContact CG1-CD2 4.28Å; L298-P335 HydrophobicContact CD1-CB 4.22Å; L298-G336 CarbonylContact C-O 3.49Å; L298-L337 HydrophobicContact CD1-CD2 4.5Å; L298-L355 HydrophobicContact CD1-CD1 4.41Å
299	I	87.5	Confident	76.6	Confident	16 Å²	16	72.6 Å²	72.6	8%	0.082	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.6	168.9	-59.3	148.6	0	0	0	106.1	W262 V302 S305 I307 P335 G336 L338	W262-I299 HydrophobicContact CB-CD1 4.38Å; I299-V302 HydrophobicContact CB-CG2 4.49Å; I299-V302 HydrophobicContact CG2-CG2 4.01Å; I299-S305 WeakPolarHBondContact CG2-OG 3.46Å; I299-I307 HydrophobicContact CD1-CD1 3.49Å; I299-I307 VanDerWaalsContact CD1-CD1 3.49Å; I299-I307 HydrophobicContact CG1-CD1 4.17Å; I299-I307 HydrophobicContact CG2-CD1 4.47Å; I299-P335 CarbonylContact O-C 3.57Å; I299-P335 WeakPolarHBondContact O-CA 2.98Å; I299-P335 WeakPolarHBondContact O-CB 3.41Å; I299-G336 PolarHBondContact N-O 2.84Å; I299-G336 PolarHBondContact O-N 2.64Å; I299-L338 HydrophobicContact CD1-CB 3.93Å
300	D	82.7	Confident	75.7	Confident	83 Å²	83	77.2 Å²	77.2	44%	0.444	42%	0.416	S	S	.	.	S	Bend	trans	-76.7	-34	-176.9	-60.8	-45.5	0	0	0	113.6	Y281 G334 P335	Y281-D300 HydrophobicContact CD2-CB 4.39Å; D300-G334 CarbonylContact O-C 3.57Å; D300-P335 WeakPolarHBondContact O-CA 3.47Å
301	N	82.2	Confident	75.3	Confident	42 Å²	42	73.1 Å²	73.1	23%	0.225	39%	0.389	C	S	.	.			trans	-147.8	108.6	176.7	177.4	1.2	0	0	0	110.1	Q303 N304 S305 N333 G334	N301-Q303 VanDerWaalsContact C-N 3.3Å; N301-Q303 PolarHBondContact O-N 3.25Å; N301-Q303 PolarHBondContact OD1-N 2.96Å; N301-Q303 VanDerWaalsContact OD1-N 3.14Å; N301-N304 HydrophobicContact CB-CB 4.29Å; N301-N304 PolarHBondContact ND2-ND2 3.29Å; N301-N304 PolarHBondContact ND2-OD1 3.26Å; N301-N304 PolarHBondContact O-N 2.9Å; N301-N304 VanDerWaalsContact O-N 3.11Å; N301-S305 PolarHBondContact O-N 2.93Å; N301-S305 VanDerWaalsContact O-N 3.16Å; N301-S305 PolarHBondContact O-OG 3.18Å; N301-N333 WeakPolarHBondContact OD1-CA 3.08Å; N301-G334 WeakPolarHBondContact CA-O 3.04Å
302	V	77.7	Confident	74.6	Confident	10 Å²	10	76 Å²	76	6%	0.061	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-31.4	-174.9	179.5	0	0	0	0	113.4	W262 I299 S305 Y332 G334	W262-V302 HydrophobicContact CD2-CG1 4.11Å; W262-V302 HydrophobicContact CD2-CG2 4.47Å; W262-V302 HydrophobicContact CE3-CG1 4.19Å; W262-V302 HydrophobicContact CE3-CG2 3.87Å; W262-V302 HydrophobicContact CH2-CB 4.4Å; W262-V302 HydrophobicContact CH2-CG1 3.79Å; W262-V302 HydrophobicContact CH2-CG2 4.35Å; W262-V302 HydrophobicContact CZ2-CG1 3.7Å; W262-V302 HydrophobicContact CZ3-CB 4.33Å; W262-V302 HydrophobicContact CZ3-CG1 4.02Å; W262-V302 HydrophobicContact CZ3-CG2 3.79Å; I299-V302 HydrophobicContact CB-CG2 4.49Å; I299-V302 HydrophobicContact CG2-CG2 4.01Å; V302-S305 WeakPolarHBondContact CA-OG 3.35Å; V302-S305 PolarHBondContact O-OG 3.21Å; V302-Y332 HydrophobicContact CB-CD1 4.36Å; V302-Y332 HydrophobicContact CG2-CD1 4.3Å; V302-Y332 HydrophobicContact CG2-CE1 4.26Å; V302-G334 PolarHBondContact N-O 3.39Å; V302-G334 VanDerWaalsContact N-O 3.16Å
303	Q	73	Confident	74	Confident	88 Å²	88	76.5 Å²	76.5	41%	0.411	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-31.3	175.2	-81.7	-178.3	-10.7	0	0	113.4	N301 A329 T330 N333	N301-Q303 VanDerWaalsContact C-N 3.3Å; N301-Q303 PolarHBondContact O-N 3.25Å; N301-Q303 PolarHBondContact OD1-N 2.96Å; N301-Q303 VanDerWaalsContact OD1-N 3.14Å; Q303-A329 WeakPolarHBondContact CG-O 3.08Å; Q303-T330 PolarHBondContact NE2-O 3.41Å; Q303-N333 HydrophobicContact CG-CB 4.21Å; Q303-N333 VanDerWaalsContact OE1-CB 3.24Å
304	N	69	Low	73.5	Confident	124 Å²	124	71.2 Å²	71.2	66%	0.663	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-12.3	-173.7	-74.4	12.2	0	0	0	113.1	N301	N301-N304 HydrophobicContact CB-CB 4.29Å; N301-N304 PolarHBondContact ND2-ND2 3.29Å; N301-N304 PolarHBondContact ND2-OD1 3.26Å; N301-N304 PolarHBondContact O-N 2.9Å; N301-N304 VanDerWaalsContact O-N 3.11Å
305	S	64.3	Low	73	Confident	38 Å²	38	71.6 Å²	71.6	27%	0.266	38%	0.376	S	S	.	.	S	Bend	trans	-79.2	130.3	175.7	46.6	0	0	0	0	111.5	I299 N301 V302 I307	I299-S305 WeakPolarHBondContact CG2-OG 3.46Å; N301-S305 PolarHBondContact O-N 2.93Å; N301-S305 VanDerWaalsContact O-N 3.16Å; N301-S305 PolarHBondContact O-OG 3.18Å; V302-S305 WeakPolarHBondContact CA-OG 3.35Å; V302-S305 PolarHBondContact O-OG 3.21Å; S305-I307 PolarHBondContact O-N 3.09Å; S305-I307 WeakPolarHBondContact OG-CD1 3.28Å; S305-I307 WeakPolarHBondContact OG-CG1 3.44Å
306	N	61.7	Low	72.5	Confident	170 Å²	170	71.6 Å²	71.6	91%	0.909	38%	0.376	S	S	*	.			trans	-70.5	54.2	169.7	-66.9	-8.5	0	0	0	111.9
307	I	60.5	Low	71.8	Confident	44 Å²	44	73.8 Å²	73.8	23%	0.226	39%	0.385	C	S	.	.			trans	-77.3	133.4	163.8	-31.9	175.4	0	0	0	106	I299 S305 L338	I299-I307 HydrophobicContact CD1-CD1 3.49Å; I299-I307 VanDerWaalsContact CD1-CD1 3.49Å; I299-I307 HydrophobicContact CG1-CD1 4.17Å; I299-I307 HydrophobicContact CG2-CD1 4.47Å; S305-I307 PolarHBondContact O-N 3.09Å; S305-I307 WeakPolarHBondContact OG-CD1 3.28Å; S305-I307 WeakPolarHBondContact OG-CG1 3.44Å; I307-L338 HydrophobicContact CG2-CD1 4.39Å
308	D	54.8	Low	71.1	Confident	134 Å²	134	68 Å²	68	72%	0.717	36%	0.36	S	S	*	.			trans	-54.4	147.5	-177.3	-70.3	-59.3	0	0	0	111.5	M310 S311	D308-M310 PolarHBondContact O-N 2.95Å; D308-S311 WeakPolarHBondContact O-CB 3.42Å; D308-S311 PolarHBondContact O-N 3.38Å; D308-S311 PolarHBondContact O-OG 3.48Å
309	T	50.2	Low	69.9	Low	159 Å²	159	67.3 Å²	67.3	98%	0.975	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	6.9	-176.5	50.2	0	0	0	0	115.1
310	M	49.5	Very low	68.5	Low	162 Å²	162	73 Å²	73	80%	0.798	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-2.1	169.6	-68	175.2	54.3	0	0	113.9	D308 I312	D308-M310 PolarHBondContact O-N 2.95Å; M310-I312 VanDerWaalsContact C-N 3.33Å; M310-I312 PolarHBondContact O-N 3.3Å
311	S	57.9	Low	67.4	Low	21 Å²	21	71 Å²	71	15%	0.147	38%	0.381	C	S	.	.			trans	-75.1	81	-177.4	66.9	0	0	0	0	112.3	W262 D308	W262-S311 PolarHBondContact NE1-O 3.15Å; D308-S311 WeakPolarHBondContact O-CB 3.42Å; D308-S311 PolarHBondContact O-N 3.38Å; D308-S311 PolarHBondContact O-OG 3.48Å
312	I	66.9	Low	66.2	Low	108 Å²	108	75.4 Å²	75.4	55%	0.554	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-64.6	130.5	-178.7	-63.7	166.7	0	0	0	109.9	R261 M310 T314	R261-I312 WeakPolarHBondContact CA-O 3.02Å; M310-I312 VanDerWaalsContact C-N 3.33Å; M310-I312 PolarHBondContact O-N 3.3Å; I312-T314 PolarHBondContact O-N 3.3Å
313	P	75.4	Confident	65.3	Low	25 Å²	25	78.9 Å²	78.9	16%	0.162	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-59.6	129.7	169.3	26.6	-36.1	0	0	0	109.9	W262 A327	W262-P313 HydrophobicContact CH2-CB 4.28Å; W262-P313 HydrophobicContact CZ2-CB 3.66Å; W262-P313 HydrophobicContact CZ2-CG 4.42Å; P313-A327 WeakPolarHBondContact CB-O 3.43Å; P313-A327 WeakPolarHBondContact CG-O 3.49Å
314	T	78.1	Confident	64.8	Low	3 Å²	3	79.3 Å²	79.3	2%	0.018	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-72.3	154.7	174.1	-153.3	0	0	0	0	110.8	I253 T257 W262 I263 I312 V316	I253-T314 HydrophobicContact CD1-CG2 3.45Å; I253-T314 VanDerWaalsContact CD1-CG2 3.45Å; I253-T314 HydrophobicContact CG1-CG2 4.22Å; T257-T314 WeakPolarHBondContact CG2-OG1 3.4Å; W262-T314 WeakPolarHBondContact O-CG2 3.43Å; W262-T314 PolarHBondContact O-N 3.3Å; I263-T314 HydrophobicContact CG1-CG2 3.75Å; I312-T314 PolarHBondContact O-N 3.3Å; T314-V316 HydrophobicContact CG2-CG1 3.79Å
315	K	76.9	Confident	64.5	Low	102 Å²	102	74 Å²	74	44%	0.443	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-74.9	133.5	170.4	-68.2	179.7	170.7	-164.9	0	108.8	E324	K315-E324 HydrophobicContact CD-CG 4.39Å; K315-E324 WeakPolarHBondContact CD-OE1 3.39Å; K315-E324 WeakPolarHBondContact CD-OE2 3.43Å; K315-E324 WeakPolarHBondContact CE-OE2 3.09Å; K315-E324 IonicContact NZ-OE1 3.71Å; K315-E324 PolarHBondContact NZ-OE1 3.38Å; K315-E324 IonicContact NZ-OE2 3.15Å; K315-E324 PolarHBondContact NZ-OE2 3.46Å
316	V	80.1	Confident	64.2	Low	2 Å²	2	75.5 Å²	75.5	1%	0.012	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.1	173.5	-60.2	0	0	0	0	111.1	I251 N252 I263 P264 T314 L318 F325	I251-V316 HydrophobicContact CG2-CB 3.8Å; I251-V316 HydrophobicContact CG2-CG1 3.88Å; I251-V316 HydrophobicContact CG2-CG2 4.26Å; N252-V316 CarbonylContact O-C 3.51Å; N252-V316 WeakPolarHBondContact O-CA 3.19Å; I263-V316 HydrophobicContact CG2-CG1 4.25Å; P264-V316 HydrophobicContact CG-CG2 4.39Å; T314-V316 HydrophobicContact CG2-CG1 3.79Å; V316-L318 HydrophobicContact CG2-CD2 4.34Å; V316-F325 HydrophobicContact CG2-CB 4.18Å; V316-F325 PolarHBondContact N-O 2.88Å; V316-F325 WeakPolarHBondContact O-CB 3.21Å; V316-F325 PolarHBondContact O-N 2.88Å
317	Y	77.9	Confident	64	Low	47 Å²	47	67.6 Å²	67.6	18%	0.184	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128	177	-52.7	-89.1	0	0	0	108.6	N252 M254 E324 L377	N252-Y317 PolarHBondContact N-O 3.37Å; N252-Y317 PolarHBondContact ND2-O 3.2Å; N252-Y317 PolarHBondContact O-N 2.75Å; M254-Y317 HydrophobicContact CE-CE2 4.43Å; M254-Y317 HydrophobicContact SD-CE2 3.95Å; Y317-E324 HydrophobicContact CD1-CG 4.46Å; Y317-E324 HydrophobicContact CE1-CB 4.4Å; Y317-E324 HydrophobicContact CE1-CG 3.59Å; Y317-L377 HydrophobicContact CD2-CD1 3.83Å; Y317-L377 HydrophobicContact CE2-CD1 4.23Å
318	L	75.3	Confident	63.8	Low	8 Å²	8	70.7 Å²	70.7	4%	0.042	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117	-174.1	-60.9	-177.3	0	0	0	111.1	F235 F249 I251 V316 T320 D321 F325	F235-L318 HydrophobicContact CD2-CD1 4.39Å; F235-L318 HydrophobicContact CE2-CD1 4.49Å; F249-L318 HydrophobicContact CE1-CD2 4.28Å; F249-L318 HydrophobicContact CZ-CD1 4.24Å; F249-L318 HydrophobicContact CZ-CD2 3.8Å; F249-L318 HydrophobicContact CZ-CG 4.46Å; I251-L318 HydrophobicContact CG1-CD2 4.13Å; I251-L318 HydrophobicContact CG2-CD2 4.48Å; V316-L318 HydrophobicContact CG2-CD2 4.34Å; L318-T320 PolarHBondContact O-N 3.14Å; L318-D321 WeakPolarHBondContact O-CB 3.33Å; L318-D321 PolarHBondContact O-N 3.44Å; L318-D321 VanDerWaalsContact O-N 3.12Å; L318-F325 HydrophobicContact CB-CD2 4.05Å; L318-F325 HydrophobicContact CB-CE2 3.87Å; L318-F325 HydrophobicContact CD1-CD1 4.07Å; L318-F325 HydrophobicContact CD1-CD2 3.89Å; L318-F325 HydrophobicContact CD1-CE1 4.16Å; L318-F325 HydrophobicContact CD1-CE2 4.01Å; L318-F325 HydrophobicContact CD1-CG 3.92Å; L318-F325 HydrophobicContact CD1-CZ 4.13Å; L318-F325 HydrophobicContact CG-CD2 3.65Å; L318-F325 HydrophobicContact CG-CE2 3.93Å; L318-F325 HydrophobicContact CG-CG 4.06Å
319	N	66.7	Low	63.9	Low	28 Å²	28	66.1 Å²	66.1	15%	0.15	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	-117.5	-171	-60.3	5.4	0	0	0	112.6	K242 I250 N252	K242-N319 WeakPolarHBondContact CA-ND2 3.24Å; K242-N319 WeakPolarHBondContact CB-ND2 3.29Å; K242-N319 PolarHBondContact O-ND2 3.49Å; I250-N319 WeakPolarHBondContact CB-OD1 3.41Å; I250-N319 PolarHBondContact N-OD1 3.1Å; I250-N319 PolarHBondContact O-N 3.3Å; I250-N319 PolarHBondContact O-OD1 3.2Å; N252-N319 PolarHBondContact ND2-O 3.46Å
320	T	58.2	Low	64.3	Low	135 Å²	135	63.4 Å²	63.4	83%	0.828	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	10.8	178.9	57	0	0	0	0	112.4	L318 T322	L318-T320 PolarHBondContact O-N 3.14Å; T320-T322 PolarHBondContact O-N 3.18Å
321	D	58.7	Low	65.1	Low	41 Å²	41	61.4 Å²	61.4	22%	0.219	34%	0.343	C	S	.	.			trans	-69.8	118.5	173.3	-71.9	29.6	0	0	0	108.9	K242 L318 N323 F325	K242-D321 IonicContact NZ-OD1 3.15Å; K242-D321 PolarHBondContact NZ-OD1 3.41Å; K242-D321 IonicContact NZ-OD2 2.62Å; K242-D321 PolarHBondContact NZ-OD2 3.06Å; L318-D321 WeakPolarHBondContact O-CB 3.33Å; L318-D321 PolarHBondContact O-N 3.44Å; L318-D321 VanDerWaalsContact O-N 3.12Å; D321-N323 HydrophobicContact CB-CB 4.48Å; D321-N323 PolarHBondContact O-N 2.75Å; D321-N323 VanDerWaalsContact O-N 3.12Å; D321-F325 HydrophobicContact CB-CE2 4.1Å
322	T	58	Low	65.9	Low	134 Å²	134	61.5 Å²	61.5	82%	0.822	34%	0.34	S	S	*	.			trans	-69.1	-0.1	169.2	52.4	0	0	0	0	113.5	T320	T320-T322 PolarHBondContact O-N 3.18Å
323	N	58.7	Low	66.4	Low	83 Å²	83	60 Å²	60	44%	0.444	33%	0.333	S	S	.	.	S	Bend	trans	-76.9	122.7	174.8	-64.5	-74.8	0	0	0	109.5	D321 F325	D321-N323 HydrophobicContact CB-CB 4.48Å; D321-N323 PolarHBondContact O-N 2.75Å; D321-N323 VanDerWaalsContact O-N 3.12Å; N323-F325 HydrophobicContact CB-CE2 4.13Å; N323-F325 WeakPolarHBondContact O-CD2 3.41Å; N323-F325 WeakPolarHBondContact O-CE2 3.22Å; N323-F325 PolarHBondContact O-N 2.96Å
324	E	61.4	Low	66.6	Low	97 Å²	97	58.8 Å²	58.8	45%	0.453	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	130.7	164.3	-62.7	-177.8	163.2	0	0	109.9	K315 Y317	K315-E324 HydrophobicContact CD-CG 4.39Å; K315-E324 WeakPolarHBondContact CD-OE1 3.39Å; K315-E324 WeakPolarHBondContact CD-OE2 3.43Å; K315-E324 WeakPolarHBondContact CE-OE2 3.09Å; K315-E324 IonicContact NZ-OE1 3.71Å; K315-E324 PolarHBondContact NZ-OE1 3.38Å; K315-E324 IonicContact NZ-OE2 3.15Å; K315-E324 PolarHBondContact NZ-OE2 3.46Å; Y317-E324 HydrophobicContact CD1-CG 4.46Å; Y317-E324 HydrophobicContact CE1-CB 4.4Å; Y317-E324 HydrophobicContact CE1-CG 3.59Å
325	F	63.6	Low	67.1	Low	14 Å²	14	58.7 Å²	58.7	6%	0.061	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.1	165.7	-64.8	-95.3	0	0	0	108.6	F235 K237 V316 L318 D321 N323	F235-F325 HydrophobicContact CB-CD1 4.22Å; F235-F325 HydrophobicContact CB-CE1 4.49Å; F235-F325 HydrophobicContact CD2-CB 4.17Å; F235-F325 AromaticContact CD2-CD1 3.52Å; F235-F325 HydrophobicContact CD2-CD1 3.52Å; F235-F325 HydrophobicContact CD2-CE1 4.29Å; F235-F325 HydrophobicContact CD2-CG 4.19Å; F235-F325 HydrophobicContact CE2-CB 4.16Å; F235-F325 HydrophobicContact CE2-CD1 4.33Å; F235-F325 HydrophobicContact CG-CD1 4.19Å; K237-F325 HydrophobicContact CD-CE1 4Å; K237-F325 HydrophobicContact CD-CZ 4.03Å; V316-F325 HydrophobicContact CG2-CB 4.18Å; V316-F325 PolarHBondContact N-O 2.88Å; V316-F325 WeakPolarHBondContact O-CB 3.21Å; V316-F325 PolarHBondContact O-N 2.88Å; L318-F325 HydrophobicContact CB-CD2 4.05Å; L318-F325 HydrophobicContact CB-CE2 3.87Å; L318-F325 HydrophobicContact CD1-CD1 4.07Å; L318-F325 HydrophobicContact CD1-CD2 3.89Å; L318-F325 HydrophobicContact CD1-CE1 4.16Å; L318-F325 HydrophobicContact CD1-CE2 4.01Å; L318-F325 HydrophobicContact CD1-CG 3.92Å; L318-F325 HydrophobicContact CD1-CZ 4.13Å; L318-F325 HydrophobicContact CG-CD2 3.65Å; L318-F325 HydrophobicContact CG-CE2 3.93Å; L318-F325 HydrophobicContact CG-CG 4.06Å; D321-F325 HydrophobicContact CB-CE2 4.1Å; N323-F325 HydrophobicContact CB-CE2 4.13Å; N323-F325 WeakPolarHBondContact O-CD2 3.41Å; N323-F325 WeakPolarHBondContact O-CE2 3.22Å; N323-F325 PolarHBondContact O-N 2.96Å
326	S	58.5	Low	67.6	Low	68 Å²	68	53.8 Å²	53.8	48%	0.476	30%	0.304	S	S	.	.			trans	-138	140.7	166.2	59	0	0	0	0	108.6
327	A	57.3	Low	68.1	Low	4 Å²	4	53.7 Å²	53.7	3%	0.033	30%	0.303	C	S	.	.			trans	-101	111.7	-178.5	0	0	0	0	0	108.9	F235 W262 P264 P313 A329 Y332	F235-A327 HydrophobicContact CE1-CB 3.59Å; F235-A327 HydrophobicContact CZ-CB 3.88Å; W262-A327 HydrophobicContact CH2-CB 3.77Å; W262-A327 WeakPolarHBondContact CZ2-O 3.41Å; W262-A327 HydrophobicContact CZ3-CB 4.29Å; P264-A327 HydrophobicContact CB-CB 3.85Å; P264-A327 HydrophobicContact CG-CB 4Å; P313-A327 WeakPolarHBondContact CB-O 3.43Å; P313-A327 WeakPolarHBondContact CG-O 3.49Å; A327-A329 PolarHBondContact O-N 3.25Å; A327-Y332 HydrophobicContact CB-CD2 4.44Å; A327-Y332 HydrophobicContact CB-CG 4.08Å
328	L	56.6	Low	68.6	Low	110 Å²	110	53 Å²	53	58%	0.576	30%	0.303	S	S	*	.			trans	-57.9	126.5	169.1	-74.1	170.5	0	0	0	108.6	T330 D331 Y332	L328-T330 PolarHBondContact O-N 2.62Å; L328-T330 VanDerWaalsContact O-N 3.11Å; L328-D331 HydrophobicContact CB-CB 4.32Å; L328-D331 PolarHBondContact O-N 2.69Å; L328-Y332 PolarHBondContact O-N 3.43Å
329	A	55.4	Low	69.4	Low	38 Å²	38	52.7 Å²	52.7	31%	0.314	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.6	-176.1	0	0	0	0	0	112.6	W262 Q303 A327 D331	W262-A329 HydrophobicContact CZ2-CB 3.91Å; Q303-A329 WeakPolarHBondContact CG-O 3.08Å; A327-A329 PolarHBondContact O-N 3.25Å; A329-D331 VanDerWaalsContact C-N 3.28Å; A329-D331 PolarHBondContact O-N 2.71Å
330	T	59.2	Low	70.5	Confident	102 Å²	102	54.5 Å²	54.5	63%	0.626	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-26.9	173.1	48.6	0	0	0	0	113.6	Q303 L328	Q303-T330 PolarHBondContact NE2-O 3.41Å; L328-T330 PolarHBondContact O-N 2.62Å; L328-T330 VanDerWaalsContact O-N 3.11Å
331	D	66.5	Low	71.9	Confident	119 Å²	119	51.5 Å²	51.5	64%	0.636	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-10.8	-164.3	-59.3	10.1	0	0	0	112.2	L328 A329	L328-D331 HydrophobicContact CB-CB 4.32Å; L328-D331 PolarHBondContact O-N 2.69Å; A329-D331 VanDerWaalsContact C-N 3.28Å; A329-D331 PolarHBondContact O-N 2.71Å
332	Y	74.9	Confident	73.4	Confident	23 Å²	23	52.4 Å²	52.4	9%	0.09	29%	0.293	C	S	.	.			trans	-118.4	111.3	-171.4	179.3	-91.6	0	0	0	112.4	F235 W262 P264 L265 V302 A327 L328 G334 P335	F235-Y332 HydrophobicContact CE1-CD2 4.08Å; W262-Y332 HydrophobicContact CH2-CD1 4.04Å; W262-Y332 AromaticContact CZ3-CD1 3.95Å; W262-Y332 HydrophobicContact CZ3-CD1 3.95Å; W262-Y332 HydrophobicContact CZ3-CE1 4.33Å; P264-Y332 HydrophobicContact CB-CE1 4.39Å; L265-Y332 PolarHBondContact O-OH 2.73Å; V302-Y332 HydrophobicContact CB-CD1 4.36Å; V302-Y332 HydrophobicContact CG2-CD1 4.3Å; V302-Y332 HydrophobicContact CG2-CE1 4.26Å; A327-Y332 HydrophobicContact CB-CD2 4.44Å; A327-Y332 HydrophobicContact CB-CG 4.08Å; L328-Y332 PolarHBondContact O-N 3.43Å; Y332-G334 VanDerWaalsContact CE1-O 3.27Å; Y332-G334 WeakPolarHBondContact CE1-O 3.03Å; Y332-G334 WeakPolarHBondContact OH-CA 3.41Å; Y332-P335 WeakPolarHBondContact CE1-O 3.32Å; Y332-P335 WeakPolarHBondContact OH-CD 3.46Å; Y332-P335 PolarHBondContact OH-O 3.47Å
333	N	76.4	Confident	74.9	Confident	76 Å²	76	46.1 Å²	46.1	41%	0.406	25%	0.254	S	S	.	.			trans	-114.5	40.8	-174.5	69.4	3.7	0	0	0	113.6	K267 N301 Q303	K267-N333 PolarHBondContact NZ-O 3.3Å; K267-N333 PolarHBondContact NZ-OD1 2.98Å; N301-N333 WeakPolarHBondContact OD1-CA 3.08Å; Q303-N333 HydrophobicContact CG-CB 4.21Å; Q303-N333 VanDerWaalsContact OE1-CB 3.24Å
334	G	80	Confident	76.5	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.01	25%	0.249	C	C	.	.	S	Bend	trans	-121.9	-167.9	174.7	0	0	0	0	0	112.1	D300 N301 V302 Y332	D300-G334 CarbonylContact O-C 3.57Å; N301-G334 WeakPolarHBondContact CA-O 3.04Å; V302-G334 PolarHBondContact N-O 3.39Å; V302-G334 VanDerWaalsContact N-O 3.16Å; Y332-G334 VanDerWaalsContact CE1-O 3.27Å; Y332-G334 WeakPolarHBondContact CE1-O 3.03Å; Y332-G334 WeakPolarHBondContact OH-CA 3.41Å
335	P	88.5	Confident	78	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.231	C	C	.	.			trans	-75.6	158.7	-177.2	28.9	-34.2	0	0	0	114.1	L265 Y281 L298 I299 D300 Y332 L355	L265-P335 HydrophobicContact CB-CB 4.36Å; L265-P335 HydrophobicContact CB-CG 4.03Å; L265-P335 WeakPolarHBondContact CB-O 3.37Å; L265-P335 HydrophobicContact CD1-CB 4.45Å; L265-P335 PolarHBondContact N-O 3.07Å; Y281-P335 HydrophobicContact CD1-CB 4.3Å; Y281-P335 HydrophobicContact CD1-CG 3.84Å; Y281-P335 HydrophobicContact CD2-CB 3.91Å; Y281-P335 HydrophobicContact CD2-CG 3.99Å; Y281-P335 HydrophobicContact CE1-CG 3.79Å; Y281-P335 HydrophobicContact CE2-CB 4.32Å; Y281-P335 HydrophobicContact CE2-CG 3.98Å; Y281-P335 HydrophobicContact CG-CB 3.92Å; Y281-P335 HydrophobicContact CG-CG 3.94Å; L298-P335 HydrophobicContact CD1-CB 4.22Å; I299-P335 CarbonylContact O-C 3.57Å; I299-P335 WeakPolarHBondContact O-CA 2.98Å; I299-P335 WeakPolarHBondContact O-CB 3.41Å; D300-P335 WeakPolarHBondContact O-CA 3.47Å; Y332-P335 WeakPolarHBondContact CE1-O 3.32Å; Y332-P335 WeakPolarHBondContact OH-CD 3.46Å; Y332-P335 PolarHBondContact OH-O 3.47Å; P335-L355 HydrophobicContact CG-CD2 4.37Å
336	G	87.9	Confident	79.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	163.3	175.9	0	0	0	0	0	113.6	I263 L298 I299	I263-G336 CarbonylContact O-C 3.47Å; I263-G336 WeakPolarHBondContact O-CA 3.31Å; L298-G336 CarbonylContact C-O 3.49Å; I299-G336 PolarHBondContact N-O 2.84Å; I299-G336 PolarHBondContact O-N 2.64Å
337	L	90.6	Very high	80.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	120.7	169.6	-55.3	176.4	0	0	0	110	W262 I263 L265 I283 W292 F296 K297 L298 F353 L374	W262-L337 CarbonylContact C-O 3.59Å; W262-L337 WeakPolarHBondContact CA-O 3.27Å; W262-L337 WeakPolarHBondContact CB-O 3.35Å; I263-L337 HydrophobicContact CB-CB 4.22Å; I263-L337 HydrophobicContact CD1-CD1 4.46Å; I263-L337 PolarHBondContact N-O 3.24Å; I263-L337 PolarHBondContact O-N 2.98Å; L265-L337 HydrophobicContact CD1-CD2 3.94Å; L265-L337 HydrophobicContact CD1-CG 3.96Å; L265-L337 HydrophobicContact CD2-CD1 4.34Å; L265-L337 HydrophobicContact CD2-CG 4.17Å; L265-L337 HydrophobicContact CG-CG 4.27Å; I283-L337 HydrophobicContact CD1-CD2 3.54Å; W292-L337 HydrophobicContact CH2-CD1 3.78Å; W292-L337 HydrophobicContact CH2-CD2 4.07Å; W292-L337 HydrophobicContact CZ2-CD1 4.34Å; W292-L337 HydrophobicContact CZ2-CD2 3.83Å; F296-L337 HydrophobicContact CB-CB 4.45Å; F296-L337 HydrophobicContact CD1-CB 4.09Å; F296-L337 HydrophobicContact CD1-CD1 4.19Å; F296-L337 HydrophobicContact CG-CD1 4.3Å; K297-L337 CarbonylContact O-C 3.48Å; K297-L337 WeakPolarHBondContact O-CA 3.37Å; L298-L337 HydrophobicContact CD1-CD2 4.5Å; L337-F353 HydrophobicContact CD1-CE1 4.1Å; L337-F353 HydrophobicContact CD1-CZ 3.84Å; L337-L374 HydrophobicContact CD1-CD2 4.36Å
338	L	89.1	Confident	82.3	Confident	32 Å²	32	46.8 Å²	46.8	17%	0.168	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	130.7	165.6	-174.2	67.5	0	0	0	109.5	F296 K297 I299 I307 L340	F296-L338 WeakPolarHBondContact CA-O 3.45Å; K297-L338 HydrophobicContact CB-CB 4.37Å; K297-L338 PolarHBondContact N-O 2.64Å; K297-L338 PolarHBondContact O-N 2.87Å; I299-L338 HydrophobicContact CD1-CB 3.93Å; I307-L338 HydrophobicContact CG2-CD1 4.39Å; L338-L340 HydrophobicContact CD2-CD2 3.94Å; L338-L340 HydrophobicContact CG-CD2 4.17Å
339	I	90.7	Very high	83.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.8	175.7	-56.5	177	0	0	0	108.8	I253 T257 N259 G260 R261 I263 Y295 F296 K341 L343	I253-I339 HydrophobicContact CD1-CD1 3.8Å; T257-I339 HydrophobicContact CG2-CD1 3.53Å; N259-I339 WeakPolarHBondContact CA-O 3Å; G260-I339 PolarHBondContact N-O 3.33Å; R261-I339 HydrophobicContact CB-CD1 4.42Å; R261-I339 WeakPolarHBondContact O-CB 3.32Å; R261-I339 PolarHBondContact O-N 3.21Å; I263-I339 HydrophobicContact CD1-CD1 4.21Å; I263-I339 HydrophobicContact CD1-CG1 4.28Å; I263-I339 HydrophobicContact CG1-CD1 4.2Å; I263-I339 HydrophobicContact CG1-CG1 4.43Å; Y295-I339 CarbonylContact O-C 3.32Å; Y295-I339 WeakPolarHBondContact O-CA 3.43Å; F296-I339 HydrophobicContact CD1-CG1 4.38Å; F296-I339 HydrophobicContact CE1-CG1 4.14Å; I339-K341 WeakPolarHBondContact CG2-O 3.34Å; I339-L343 HydrophobicContact CD1-CD1 4.41Å; I339-L343 HydrophobicContact CG2-CD2 4.32Å; I339-L343 HydrophobicContact CG2-CG 4.4Å
340	L	90.1	Very high	85.6	Confident	66 Å²	66	44.8 Å²	44.8	35%	0.346	24%	0.241	S	C	.	.			trans	-103.2	-41.5	-172.6	-56.9	178.2	0	0	0	112.8	N259 N293 D294 Y295 K297 L338	N259-L340 WeakPolarHBondContact CB-O 3.33Å; N259-L340 PolarHBondContact ND2-O 3.2Å; N293-L340 VanDerWaalsContact O-CD1 3.32Å; N293-L340 WeakPolarHBondContact O-CD1 3.37Å; D294-L340 WeakPolarHBondContact O-CB 3.31Å; Y295-L340 PolarHBondContact O-N 2.67Å; K297-L340 HydrophobicContact CB-CD1 4.13Å; K297-L340 HydrophobicContact CB-CD2 4.24Å; K297-L340 HydrophobicContact CB-CG 4.44Å; L338-L340 HydrophobicContact CD2-CD2 3.94Å; L338-L340 HydrophobicContact CG-CD2 4.17Å
341	K	88.8	Confident	87	Confident	72 Å²	72	40 Å²	40	31%	0.313	21%	0.212	S	C	.	.	S	Bend	trans	-113.8	145.7	172.5	-179.9	-174.8	165.9	-167.9	0	108.7	D294 Y295 I339 E347	D294-K341 VanDerWaalsContact O-CB 3.29Å; D294-K341 WeakPolarHBondContact O-CB 3.44Å; D294-K341 PolarHBondContact O-N 2.63Å; Y295-K341 HydrophobicContact CD1-CB 3.97Å; Y295-K341 HydrophobicContact CD1-CD 4.2Å; Y295-K341 HydrophobicContact CD1-CG 4.3Å; Y295-K341 HydrophobicContact CE1-CB 4.24Å; Y295-K341 HydrophobicContact CE1-CD 3.7Å; Y295-K341 HydrophobicContact CE1-CG 4.05Å; Y295-K341 HydrophobicContact CE2-CD 4.26Å; Y295-K341 PolarHBondContact OH-NZ 3.4Å; I339-K341 WeakPolarHBondContact CG2-O 3.34Å; K341-E347 WeakPolarHBondContact CE-OE2 3.49Å; K341-E347 IonicContact NZ-OE1 2.68Å; K341-E347 PolarHBondContact NZ-OE1 3.08Å; K341-E347 IonicContact NZ-OE2 2.76Å; K341-E347 PolarHBondContact NZ-OE2 3.44Å
342	T	89.3	Confident	88.1	Confident	61 Å²	61	37.4 Å²	37.4	37%	0.374	20%	0.198	S	C	.	.			trans	-54.4	142.5	172.8	-37.1	0	0	0	0	110.3	Y295	Y295-T342 WeakPolarHBondContact CE1-O 3.39Å
343	L	90.7	Very high	88.9	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.194	C	C	.	.			trans	-82.8	142.2	177.2	-55.5	-174.6	0	0	0	110.6	I253 N256 Y295 F296 I339 I376	I253-L343 HydrophobicContact CD1-CD1 3.85Å; I253-L343 HydrophobicContact CG1-CD1 4.32Å; I253-L343 HydrophobicContact CG2-CD1 3.68Å; N256-L343 PolarHBondContact N-O 3.2Å; Y295-L343 HydrophobicContact CD1-CD2 3.72Å; Y295-L343 HydrophobicContact CE1-CD2 4.25Å; F296-L343 HydrophobicContact CE1-CD2 4.18Å; F296-L343 HydrophobicContact CZ-CD2 3.83Å; I339-L343 HydrophobicContact CD1-CD1 4.41Å; I339-L343 HydrophobicContact CG2-CD2 4.32Å; I339-L343 HydrophobicContact CG2-CG 4.4Å; L343-I376 HydrophobicContact CB-CD1 4.16Å; L343-I376 HydrophobicContact CD1-CD1 4.23Å; L343-I376 HydrophobicContact CD1-CG1 4.18Å; L343-I376 HydrophobicContact CD2-CD1 4.29Å; L343-I376 HydrophobicContact CG-CD1 4.45Å
344	D	90.9	Very high	89.5	Confident	64 Å²	64	34.3 Å²	34.3	34%	0.342	18%	0.182	S	C	.	.			trans	-147.6	120.4	-172.7	170.1	-39.2	0	0	0	105.1	E346 E347 I348	D344-E346 WeakPolarHBondContact OD1-CB 3.41Å; D344-E346 PolarHBondContact OD1-N 2.75Å; D344-E346 VanDerWaalsContact OD1-N 3.14Å; D344-E347 HydrophobicContact CB-CB 4.25Å; D344-E347 WeakPolarHBondContact OD1-CB 3.25Å; D344-E347 PolarHBondContact OD1-N 2.7Å; D344-I348 PolarHBondContact O-N 3.5Å; D344-I348 VanDerWaalsContact O-N 3.16Å
345	R	93.5	Very high	90.1	Very high	20 Å²	20	34.2 Å²	34.2	8%	0.075	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-23.1	-170.5	-160.6	-164.2	59	32.7	1.5	112	E255 I348 S349 I376 D378 S412 D413	E255-R345 HydrophobicContact CB-CB 4.45Å; E255-R345 WeakPolarHBondContact OE1-CB 3.2Å; E255-R345 WeakPolarHBondContact OE2-CB 2.97Å; E255-R345 PolarHBondContact OE2-N 2.95Å; R345-I348 CarbonylContact O-C 3.59Å; R345-S349 WeakPolarHBondContact O-CA 3.13Å; R345-S349 PolarHBondContact O-N 3.29Å; R345-I376 HydrophobicContact CB-CG2 3.78Å; R345-I376 HydrophobicContact CG-CB 4.21Å; R345-I376 HydrophobicContact CG-CG2 3.89Å; R345-D378 IonicContact CZ-OD1 2.67Å; R345-D378 IonicContact NE-OD1 2.64Å; R345-D378 PolarHBondContact NE-OD1 3.28Å; R345-D378 IonicContact NH2-OD1 2.64Å; R345-D378 PolarHBondContact NH2-OD1 3.03Å; R345-S412 PolarHBondContact NH2-O 3.01Å; R345-D413 VanDerWaalsContact NH2-C 3.26Å; R345-D413 VanDerWaalsContact NH2-CA 3.27Å
346	E	91.4	Very high	90.3	Very high	61 Å²	61	35.7 Å²	35.7	29%	0.285	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-43.1	175.7	-83.7	43.8	-97.8	0	0	110.6	D344 N382	D344-E346 WeakPolarHBondContact OD1-CB 3.41Å; D344-E346 PolarHBondContact OD1-N 2.75Å; D344-E346 VanDerWaalsContact OD1-N 3.14Å; E346-N382 PolarHBondContact OE2-ND2 3.17Å
347	E	88.9	Confident	90.5	Very high	102 Å²	102	35.7 Å²	35.7	48%	0.477	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-52	174.7	-163.2	-179.5	178.2	0	0	110.4	Y295 K341 D344	Y295-E347 PolarHBondContact OH-OE1 2.97Å; Y295-E347 PolarHBondContact OH-OE2 3.03Å; K341-E347 WeakPolarHBondContact CE-OE2 3.49Å; K341-E347 IonicContact NZ-OE1 2.68Å; K341-E347 PolarHBondContact NZ-OE1 3.08Å; K341-E347 IonicContact NZ-OE2 2.76Å; K341-E347 PolarHBondContact NZ-OE2 3.44Å; D344-E347 HydrophobicContact CB-CB 4.25Å; D344-E347 WeakPolarHBondContact OD1-CB 3.25Å; D344-E347 PolarHBondContact OD1-N 2.7Å
348	I	88.1	Confident	90.6	Very high	33 Å²	33	37.5 Å²	37.5	17%	0.169	20%	0.2	C	C	.	.			trans	-146.3	107	177.9	-53	-177.7	0	0	0	112.2	V291 Y295 D344 R345 S350 F351 I376	V291-I348 HydrophobicContact CB-CD1 4.24Å; V291-I348 HydrophobicContact CG1-CD1 4.33Å; V291-I348 HydrophobicContact CG2-CD1 4.45Å; Y295-I348 HydrophobicContact CD2-CD1 4.28Å; Y295-I348 HydrophobicContact CE2-CD1 3.58Å; Y295-I348 HydrophobicContact CE2-CG1 4.49Å; D344-I348 PolarHBondContact O-N 3.5Å; D344-I348 VanDerWaalsContact O-N 3.16Å; R345-I348 CarbonylContact O-C 3.59Å; I348-S350 PolarHBondContact O-N 2.93Å; I348-F351 HydrophobicContact CB-CE2 4.17Å; I348-F351 HydrophobicContact CB-CZ 4.03Å; I348-F351 HydrophobicContact CD1-CE1 3.92Å; I348-F351 HydrophobicContact CD1-CZ 3.67Å; I348-F351 HydrophobicContact CG1-CZ 4.42Å; I348-F351 HydrophobicContact CG2-CD1 4.45Å; I348-F351 HydrophobicContact CG2-CD2 4.15Å; I348-F351 HydrophobicContact CG2-CE1 4.03Å; I348-F351 HydrophobicContact CG2-CE2 3.67Å; I348-F351 HydrophobicContact CG2-CZ 3.63Å; I348-I376 WeakPolarHBondContact O-CD1 3.33Å
349	S	90.4	Very high	90.7	Very high	68 Å²	68	36 Å²	36	48%	0.476	19%	0.193	S	C	.	.	S	Bend	trans	-76	-21.1	-178.3	59.8	0	0	0	0	116.2	R345 I376	R345-S349 WeakPolarHBondContact O-CA 3.13Å; R345-S349 PolarHBondContact O-N 3.29Å; S349-I376 PolarHBondContact O-N 3.12Å
350	S	91	Very high	90.5	Very high	38 Å²	38	39.3 Å²	39.3	27%	0.266	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-165	154.4	172.9	68.7	0	0	0	0	113.7	I348 W373 L374	I348-S350 PolarHBondContact O-N 2.93Å; S350-W373 VanDerWaalsContact CB-NE1 3.26Å; S350-W373 PolarHBondContact OG-NE1 3.39Å; S350-L374 CarbonylContact C-O 3.56Å; S350-L374 WeakPolarHBondContact CA-O 3.38Å; S350-L374 VanDerWaalsContact CB-O 3.23Å; S350-L374 WeakPolarHBondContact CB-O 3.46Å
351	F	90.4	Very high	90	Very high	1 Å²	1	36.2 Å²	36.2	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137	172.4	-62.9	-96.4	0	0	0	110.5	W292 Y295 F296 I348 L374 I376	W292-F351 HydrophobicContact CE3-CB 4.34Å; W292-F351 AromaticContact CE3-CD1 3.98Å; W292-F351 HydrophobicContact CE3-CD1 3.98Å; W292-F351 HydrophobicContact CE3-CG 4.42Å; W292-F351 HydrophobicContact CZ3-CB 4.05Å; W292-F351 HydrophobicContact CZ3-CD1 4.47Å; W292-F351 HydrophobicContact CZ3-CG 4.46Å; Y295-F351 HydrophobicContact CD1-CZ 4.45Å; Y295-F351 HydrophobicContact CD2-CE1 4.19Å; Y295-F351 AromaticContact CD2-CZ 3.68Å; Y295-F351 HydrophobicContact CD2-CZ 3.68Å; Y295-F351 HydrophobicContact CE2-CZ 4.09Å; Y295-F351 AromaticContact CG-CZ 3.86Å; Y295-F351 HydrophobicContact CG-CZ 3.86Å; F296-F351 HydrophobicContact CE2-CD1 4.16Å; F296-F351 AromaticContact CE2-CD2 3.57Å; F296-F351 HydrophobicContact CE2-CD2 3.57Å; F296-F351 HydrophobicContact CE2-CE1 4.14Å; F296-F351 AromaticContact CE2-CE2 3.57Å; F296-F351 HydrophobicContact CE2-CE2 3.57Å; F296-F351 AromaticContact CE2-CG 3.87Å; F296-F351 HydrophobicContact CE2-CG 3.87Å; F296-F351 AromaticContact CE2-CZ 3.84Å; F296-F351 HydrophobicContact CE2-CZ 3.84Å; F296-F351 HydrophobicContact CZ-CD2 4.12Å; F296-F351 HydrophobicContact CZ-CE2 4.07Å; I348-F351 HydrophobicContact CB-CE2 4.17Å; I348-F351 HydrophobicContact CB-CZ 4.03Å; I348-F351 HydrophobicContact CD1-CE1 3.92Å; I348-F351 HydrophobicContact CD1-CZ 3.67Å; I348-F351 HydrophobicContact CG1-CZ 4.42Å; I348-F351 HydrophobicContact CG2-CD1 4.45Å; I348-F351 HydrophobicContact CG2-CD2 4.15Å; I348-F351 HydrophobicContact CG2-CE1 4.03Å; I348-F351 HydrophobicContact CG2-CE2 3.67Å; I348-F351 HydrophobicContact CG2-CZ 3.63Å; F351-L374 HydrophobicContact CB-CB 4.48Å; F351-L374 PolarHBondContact N-O 3.17Å; F351-L374 PolarHBondContact O-N 2.92Å; F351-I376 HydrophobicContact CD2-CD1 4.28Å; F351-I376 HydrophobicContact CE2-CD1 3.9Å
352	L	89.4	Confident	89.4	Confident	66 Å²	66	39.7 Å²	39.7	35%	0.346	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118.9	174.6	-179.1	68.1	0	0	0	109.3	P286 W373	P286-L352 WeakPolarHBondContact CD-O 3.49Å; P286-L352 HydrophobicContact CG-CD2 4.25Å; P286-L352 HydrophobicContact CG-CG 4.2Å; L352-W373 HydrophobicContact CD1-CB 4.17Å
353	F	90.6	Very high	88.9	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	156.1	-178.6	68.7	-85.1	0	0	0	112.1	L265 I283 L285 W292 L337 L355 I372 L374	L265-F353 HydrophobicContact CD1-CE2 4.42Å; L265-F353 HydrophobicContact CD2-CE2 4.34Å; L265-F353 HydrophobicContact CD2-CZ 3.88Å; I283-F353 HydrophobicContact CD1-CD2 3.74Å; I283-F353 HydrophobicContact CD1-CE2 3.75Å; I283-F353 HydrophobicContact CG1-CD2 3.96Å; I283-F353 HydrophobicContact CG1-CE2 4.28Å; I283-F353 HydrophobicContact CG2-CB 3.89Å; I283-F353 HydrophobicContact CG2-CD2 3.92Å; I283-F353 HydrophobicContact CG2-CG 4.27Å; L285-F353 HydrophobicContact CD2-CB 3.93Å; W292-F353 HydrophobicContact CH2-CB 4.15Å; W292-F353 AromaticContact CH2-CD1 3.58Å; W292-F353 HydrophobicContact CH2-CD1 3.58Å; W292-F353 HydrophobicContact CH2-CD2 4.1Å; W292-F353 AromaticContact CH2-CE1 3.9Å; W292-F353 HydrophobicContact CH2-CE1 3.9Å; W292-F353 HydrophobicContact CH2-CE2 4.37Å; W292-F353 AromaticContact CH2-CG 3.69Å; W292-F353 HydrophobicContact CH2-CG 3.69Å; W292-F353 HydrophobicContact CH2-CZ 4.28Å; W292-F353 HydrophobicContact CZ3-CB 4.08Å; W292-F353 AromaticContact CZ3-CD1 3.6Å; W292-F353 HydrophobicContact CZ3-CD1 3.6Å; W292-F353 HydrophobicContact CZ3-CE1 4.19Å; W292-F353 AromaticContact CZ3-CG 3.93Å; W292-F353 HydrophobicContact CZ3-CG 3.93Å; L337-F353 HydrophobicContact CD1-CE1 4.1Å; L337-F353 HydrophobicContact CD1-CZ 3.84Å; F353-L355 HydrophobicContact CE2-CB 4.4Å; F353-I372 HydrophobicContact CD1-CB 4.33Å; F353-I372 HydrophobicContact CD2-CB 4.38Å; F353-I372 HydrophobicContact CE1-CB 3.88Å; F353-I372 HydrophobicContact CE1-CG2 3.66Å; F353-I372 HydrophobicContact CE2-CB 3.94Å; F353-I372 HydrophobicContact CE2-CD1 3.85Å; F353-I372 HydrophobicContact CE2-CG1 4.32Å; F353-I372 HydrophobicContact CE2-CG2 4.32Å; F353-I372 HydrophobicContact CZ-CB 3.67Å; F353-I372 HydrophobicContact CZ-CD1 3.96Å; F353-I372 HydrophobicContact CZ-CG1 4.36Å; F353-I372 HydrophobicContact CZ-CG2 3.56Å; F353-I372 PolarHBondContact N-O 2.99Å; F353-I372 PolarHBondContact O-N 3.16Å; F353-L374 HydrophobicContact CE1-CB 4.14Å
354	I	90.2	Very high	88.5	Confident	32 Å²	32	49.2 Å²	49.2	16%	0.164	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.2	176.8	-49.6	-179.2	0	0	0	107.4	I283 K284 P286 I356 L370	I283-I354 WeakPolarHBondContact CA-O 3.37Å; K284-I354 HydrophobicContact CB-CB 4.29Å; K284-I354 PolarHBondContact N-O 3.47Å; K284-I354 WeakPolarHBondContact O-CB 3.47Å; K284-I354 PolarHBondContact O-N 3.01Å; P286-I354 HydrophobicContact CG-CG1 4.44Å; I354-I356 HydrophobicContact CG2-CG1 4.09Å; I354-L370 WeakPolarHBondContact CA-O 3.47Å
355	L	91.8	Very high	88.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	121.7	169.7	-176.6	63.8	0	0	0	107.9	F230 L265 Y281 I283 L298 P335 F353 S369 L370 I372	F230-L355 HydrophobicContact CE1-CD2 3.63Å; F230-L355 HydrophobicContact CE1-CG 3.94Å; F230-L355 HydrophobicContact CZ-CB 4.3Å; F230-L355 HydrophobicContact CZ-CD2 4.07Å; F230-L355 HydrophobicContact CZ-CG 3.84Å; F230-L355 WeakPolarHBondContact CZ-O 3.42Å; L265-L355 HydrophobicContact CB-CD2 4.05Å; L265-L355 HydrophobicContact CD1-CD1 4.09Å; L265-L355 HydrophobicContact CD1-CD2 4.14Å; Y281-L355 HydrophobicContact CD1-CD1 4.25Å; Y281-L355 HydrophobicContact CD1-CG 4.43Å; I283-L355 HydrophobicContact CD1-CD1 4.4Å; I283-L355 HydrophobicContact CG1-CD1 3.92Å; L298-L355 HydrophobicContact CD1-CD1 4.41Å; P335-L355 HydrophobicContact CG-CD2 4.37Å; F353-L355 HydrophobicContact CE2-CB 4.4Å; L355-S369 CarbonylContact O-C 3.44Å; L355-S369 WeakPolarHBondContact O-CA 3.49Å; L355-L370 PolarHBondContact N-O 2.82Å; L355-L370 PolarHBondContact O-N 3.1Å; L355-I372 HydrophobicContact CB-CD1 3.88Å; L355-I372 HydrophobicContact CD2-CD1 3.96Å
356	I	92.6	Very high	88.1	Confident	30 Å²	30	53 Å²	53	15%	0.154	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.3	179.3	-59.1	175.6	0	0	0	107.8	Y281 S282 K284 I354 S368	Y281-I356 CarbonylContact C-O 3.17Å; Y281-I356 WeakPolarHBondContact CA-O 3.4Å; S282-I356 PolarHBondContact N-O 3.37Å; S282-I356 PolarHBondContact O-N 3.38Å; K284-I356 HydrophobicContact CB-CD1 3.74Å; K284-I356 HydrophobicContact CD-CD1 4.17Å; I354-I356 HydrophobicContact CG2-CG1 4.09Å; I356-S368 WeakPolarHBondContact CA-O 3.45Å
357	A	92.1	Very high	88.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.8	173.2	0	0	0	0	0	108.3	P228 F230 A268 V279 Q280 Y281 S367 S368	P228-A357 HydrophobicContact CB-CB 4Å; F230-A357 HydrophobicContact CE1-CB 4.18Å; F230-A357 HydrophobicContact CE2-CB 3.89Å; F230-A357 HydrophobicContact CZ-CB 3.59Å; A268-A357 HydrophobicContact CB-CB 3.53Å; V279-A357 HydrophobicContact CG1-CB 3.67Å; Q280-A357 WeakPolarHBondContact O-CA 3.25Å; Y281-A357 HydrophobicContact CD1-CB 3.98Å; Y281-A357 HydrophobicContact CE1-CB 3.76Å; A357-S367 CarbonylContact O-C 3.46Å; A357-S367 WeakPolarHBondContact O-CA 3.2Å; A357-S367 WeakPolarHBondContact O-CB 3.26Å; A357-S368 PolarHBondContact N-O 2.77Å; A357-S368 PolarHBondContact O-N 3.44Å
358	T	93.1	Very high	88.2	Confident	38 Å²	38	50.2 Å²	50.2	23%	0.233	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.7	-172.8	-48.3	0	0	0	0	109.5	V279 Q280 P365 R366	V279-T358 CarbonylContact C-O 3.56Å; V279-T358 WeakPolarHBondContact CA-O 3.26Å; Q280-T358 PolarHBondContact N-O 2.95Å; Q280-T358 PolarHBondContact O-N 3.26Å; T358-P365 HydrophobicContact CG2-CB 4.24Å; T358-R366 VanDerWaalsContact CA-O 3.28Å; T358-R366 WeakPolarHBondContact CA-O 3.24Å; T358-R366 VanDerWaalsContact CG2-O 3.3Å; T358-R366 WeakPolarHBondContact CG2-O 3.35Å
359	D	89.8	Confident	88.3	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.011	29%	0.292	C	S	.	.			trans	-76.3	172.8	172.2	62.8	72.1	0	0	0	112.2	N224 P228 N276 Y278 G361 P365 R366	N224-D359 PolarHBondContact ND2-OD1 3.43Å; N224-D359 PolarHBondContact ND2-OD2 3.35Å; N224-D359 PolarHBondContact OD1-OD1 3.35Å; P228-D359 HydrophobicContact CG-CB 3.97Å; N276-D359 WeakPolarHBondContact O-CB 3.34Å; Y278-D359 CarbonylContact O-C 3.57Å; Y278-D359 WeakPolarHBondContact O-CA 3.47Å; D359-G361 WeakPolarHBondContact OD1-CA 3.43Å; D359-G361 PolarHBondContact OD1-N 2.84Å; D359-P365 WeakPolarHBondContact O-CB 3.26Å; D359-P365 WeakPolarHBondContact OD1-CA 3.31Å; D359-R366 VanDerWaalsContact CG-N 3.33Å; D359-R366 PolarHBondContact N-O 2.88Å; D359-R366 PolarHBondContact OD1-N 2.8Å; D359-R366 VanDerWaalsContact OD2-C 3.24Å; D359-R366 WeakPolarHBondContact OD2-CA 3.05Å; D359-R366 WeakPolarHBondContact OD2-CB 3.42Å; D359-R366 PolarHBondContact OD2-N 2.81Å
360	M	86.7	Confident	88.1	Confident	70 Å²	70	50 Å²	50	35%	0.345	27%	0.273	S	S	.	.			trans	-104.9	20.2	174.6	-66.1	-67.6	-74.3	0	0	112.3	L275 Y278 Q280	L275-M360 HydrophobicContact CB-CB 4.31Å; L275-M360 HydrophobicContact CD2-CB 4.25Å; L275-M360 CarbonylContact O-C 3.59Å; L275-M360 WeakPolarHBondContact O-CA 3.47Å; L275-M360 WeakPolarHBondContact O-CB 3.46Å; L275-M360 PolarHBondContact O-N 2.74Å; L275-M360 VanDerWaalsContact O-N 3.08Å; Y278-M360 HydrophobicContact CD1-CG 3.65Å; Y278-M360 HydrophobicContact CE1-CG 4.47Å; Y278-M360 HydrophobicContact CG-CG 4.45Å; Y278-M360 PolarHBondContact O-N 2.81Å; Q280-M360 HydrophobicContact CG-CG 4.21Å; Q280-M360 HydrophobicContact CG-SD 3.92Å
361	G	80.1	Confident	87.9	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.			trans	-60.5	150.9	177.3	0	0	0	0	0	112.4	L275 N276 D359	L275-G361 PolarHBondContact O-N 3.27Å; N276-G361 WeakPolarHBondContact OD1-CA 3.41Å; D359-G361 WeakPolarHBondContact OD1-CA 3.43Å; D359-G361 PolarHBondContact OD1-N 2.84Å
362	Q	77.4	Confident	87.8	Confident	146 Å²	146	51 Å²	51	68%	0.682	28%	0.276	S	S	*	.	S	Bend	trans	-134.7	140.7	-175.3	-68.7	-64.8	-67.1	0	0	110.9
363	P	78	Confident	87.7	Confident	97 Å²	97	50.6 Å²	50.6	63%	0.63	27%	0.27	S	S	*	.	S	Bend	cis	-85.5	-2.4	1.5	35.5	-36.3	0	0	0	114.2	P365	P363-P365 WeakPolarHBondContact O-CD 3.32Å
364	F	82.7	Confident	87.7	Confident	164 Å²	164	50.6 Å²	50.6	72%	0.719	27%	0.27	S	S	*	.	S	Bend	trans	-118.8	91.9	-176.2	-55.8	-60.1	0	0	0	110.5	N224	N224-F364 PolarHBondContact ND2-O 2.75Å
365	P	87.7	Confident	87.7	Confident	66 Å²	66	53.2 Å²	53.2	43%	0.429	28%	0.277	S	S	.	.			trans	-71.2	143.9	171.3	30	-33.9	0	0	0	110.2	T358 D359 P363	T358-P365 HydrophobicContact CG2-CB 4.24Å; D359-P365 WeakPolarHBondContact O-CB 3.26Å; D359-P365 WeakPolarHBondContact OD1-CA 3.31Å; P363-P365 WeakPolarHBondContact O-CD 3.32Å
366	R	88.4	Confident	87.7	Confident	97 Å²	97	53.6 Å²	53.6	37%	0.366	28%	0.279	S	S	.	.			trans	-114.4	165.1	-177.7	-57.9	167.9	62.1	172.2	-17.3	109.2	N224 D225 N226 A227 T358 D359	N224-R366 VanDerWaalsContact O-CD 3.29Å; N224-R366 WeakPolarHBondContact O-CD 3.3Å; N224-R366 PolarHBondContact O-NH1 2.92Å; D225-R366 VanDerWaalsContact CA-NH1 3.34Å; D225-R366 PolarHBondContact O-NH1 2.89Å; D225-R366 PolarHBondContact O-NH2 2.82Å; N226-R366 VanDerWaalsContact O-CD 3.26Å; N226-R366 WeakPolarHBondContact O-CD 3.39Å; N226-R366 PolarHBondContact O-NE 2.86Å; N226-R366 PolarHBondContact O-NH1 3.1Å; N226-R366 PolarHBondContact O-NH2 3.41Å; A227-R366 HydrophobicContact CB-CB 3.78Å; T358-R366 VanDerWaalsContact CA-O 3.28Å; T358-R366 WeakPolarHBondContact CA-O 3.24Å; T358-R366 VanDerWaalsContact CG2-O 3.3Å; T358-R366 WeakPolarHBondContact CG2-O 3.35Å; D359-R366 VanDerWaalsContact CG-N 3.33Å; D359-R366 PolarHBondContact N-O 2.88Å; D359-R366 PolarHBondContact OD1-N 2.8Å; D359-R366 VanDerWaalsContact OD2-C 3.24Å; D359-R366 WeakPolarHBondContact OD2-CA 3.05Å; D359-R366 WeakPolarHBondContact OD2-CB 3.42Å; D359-R366 PolarHBondContact OD2-N 2.81Å
367	S	91.8	Very high	87.6	Confident	70 Å²	70	54.3 Å²	54.3	49%	0.49	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	156.8	-174	54	0	0	0	0	113.1	A357	A357-S367 CarbonylContact O-C 3.46Å; A357-S367 WeakPolarHBondContact O-CA 3.2Å; A357-S367 WeakPolarHBondContact O-CB 3.26Å
368	S	90.3	Very high	87.5	Confident	35 Å²	35	55.8 Å²	55.8	25%	0.245	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	167.1	161.5	79	0	0	0	0	111.5	P228 F230 I356 A357	P228-S368 WeakPolarHBondContact O-CB 3.22Å; P228-S368 PolarHBondContact O-OG 3.39Å; F230-S368 VanDerWaalsContact CD2-OG 3.24Å; F230-S368 WeakPolarHBondContact CD2-OG 3.24Å; F230-S368 WeakPolarHBondContact CE2-OG 3.5Å; I356-S368 WeakPolarHBondContact CA-O 3.45Å; A357-S368 PolarHBondContact N-O 2.77Å; A357-S368 PolarHBondContact O-N 3.44Å
369	S	90.2	Very high	87.4	Confident	80 Å²	80	57.7 Å²	57.7	56%	0.559	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	135.1	-173.3	60.4	0	0	0	0	111.4	L355	L355-S369 CarbonylContact O-C 3.44Å; L355-S369 WeakPolarHBondContact O-CA 3.49Å
370	L	86.2	Confident	87.5	Confident	16 Å²	16	58.5 Å²	58.5	8%	0.084	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.2	178	178.3	55.8	0	0	0	110.5	F230 F249 P266 I354 L355 I372	F230-L370 HydrophobicContact CB-CD2 4.21Å; F230-L370 HydrophobicContact CD1-CB 4.36Å; F230-L370 HydrophobicContact CD1-CD2 3.95Å; F230-L370 HydrophobicContact CD2-CB 3.7Å; F230-L370 HydrophobicContact CD2-CD2 4.47Å; F230-L370 HydrophobicContact CE1-CB 4.4Å; F230-L370 HydrophobicContact CE1-CD2 4.48Å; F230-L370 HydrophobicContact CE2-CB 3.74Å; F230-L370 HydrophobicContact CG-CB 4.03Å; F230-L370 HydrophobicContact CG-CD2 3.95Å; F230-L370 HydrophobicContact CZ-CB 4.09Å; F249-L370 HydrophobicContact CB-CD1 4.31Å; P266-L370 HydrophobicContact CB-CD2 3.59Å; P266-L370 HydrophobicContact CG-CD2 3.57Å; I354-L370 WeakPolarHBondContact CA-O 3.47Å; L355-L370 PolarHBondContact N-O 2.82Å; L355-L370 PolarHBondContact O-N 3.1Å; L370-I372 HydrophobicContact CG-CG1 4.2Å; L370-I372 PolarHBondContact O-N 3.33Å
371	N	87.1	Confident	87.7	Confident	61 Å²	61	58.7 Å²	58.7	33%	0.326	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.1	177.3	-62.7	-21.6	0	0	0	109.7	R248 F249	R248-N371 WeakPolarHBondContact CA-O 3.36Å; R248-N371 HydrophobicContact CG-CB 4.22Å; F249-N371 PolarHBondContact N-O 2.98Å
372	I	87.3	Confident	88.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.5	179.8	-56.3	-178.1	0	0	0	109.4	F249 I251 L265 P266 F353 L355 L370	F249-I372 HydrophobicContact CD1-CG1 4.42Å; F249-I372 HydrophobicContact CD1-CG2 4.49Å; F249-I372 WeakPolarHBondContact O-CA 3.32Å; I251-I372 HydrophobicContact CD1-CG2 3.82Å; I251-I372 HydrophobicContact CG1-CG2 4.1Å; L265-I372 HydrophobicContact CD2-CD1 4.14Å; P266-I372 HydrophobicContact CG-CD1 3.9Å; F353-I372 HydrophobicContact CD1-CB 4.33Å; F353-I372 HydrophobicContact CD2-CB 4.38Å; F353-I372 HydrophobicContact CE1-CB 3.88Å; F353-I372 HydrophobicContact CE1-CG2 3.66Å; F353-I372 HydrophobicContact CE2-CB 3.94Å; F353-I372 HydrophobicContact CE2-CD1 3.85Å; F353-I372 HydrophobicContact CE2-CG1 4.32Å; F353-I372 HydrophobicContact CE2-CG2 4.32Å; F353-I372 HydrophobicContact CZ-CB 3.67Å; F353-I372 HydrophobicContact CZ-CD1 3.96Å; F353-I372 HydrophobicContact CZ-CG1 4.36Å; F353-I372 HydrophobicContact CZ-CG2 3.56Å; F353-I372 PolarHBondContact N-O 2.99Å; F353-I372 PolarHBondContact O-N 3.16Å; L355-I372 HydrophobicContact CB-CD1 3.88Å; L355-I372 HydrophobicContact CD2-CD1 3.96Å; L370-I372 HydrophobicContact CG-CG1 4.2Å; L370-I372 PolarHBondContact O-N 3.33Å
373	W	87.5	Confident	89	Confident	58 Å²	58	56.7 Å²	56.7	22%	0.22	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	104.1	172.1	-172.8	25.1	0	0	0	108.3	R248 F249 I250 I251 S350 L352 R375	R248-W373 HydrophobicContact CB-CB 4.46Å; R248-W373 VanDerWaalsContact CZ-CE3 3.49Å; F249-W373 PolarHBondContact O-N 2.59Å; I250-W373 WeakPolarHBondContact CA-O 3.46Å; I250-W373 HydrophobicContact CD1-CE3 3.76Å; I250-W373 HydrophobicContact CD1-CZ3 3.99Å; I250-W373 HydrophobicContact CG1-CE3 3.98Å; I251-W373 PolarHBondContact N-O 3.15Å; I251-W373 VanDerWaalsContact N-O 3.08Å; S350-W373 VanDerWaalsContact CB-NE1 3.26Å; S350-W373 PolarHBondContact OG-NE1 3.39Å; L352-W373 HydrophobicContact CD1-CB 4.17Å; W373-R375 HydrophobicContact CD2-CG 3.79Å; W373-R375 HydrophobicContact CE3-CG 4.25Å; W373-R375 HydrophobicContact CG-CG 4.16Å; W373-R375 HydrophobicContact CH2-CG 4.43Å; W373-R375 HydrophobicContact CZ2-CG 3.99Å
374	L	90.5	Very high	89.7	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	107.7	174.4	176.9	62.7	0	0	0	108.2	I251 I253 I263 F296 L337 S350 F351 F353	I251-L374 HydrophobicContact CB-CD1 4.02Å; I251-L374 HydrophobicContact CG2-CD1 3.86Å; I251-L374 CarbonylContact O-C 3.4Å; I251-L374 WeakPolarHBondContact O-CA 3.29Å; I253-L374 HydrophobicContact CB-CD1 4.43Å; I253-L374 HydrophobicContact CG2-CD1 3.87Å; I253-L374 HydrophobicContact CG2-CG 4.49Å; I263-L374 HydrophobicContact CD1-CD1 4.08Å; I263-L374 HydrophobicContact CD1-CD2 3.81Å; F296-L374 HydrophobicContact CE1-CD2 3.88Å; F296-L374 HydrophobicContact CE2-CD2 3.99Å; F296-L374 HydrophobicContact CZ-CD2 3.46Å; F296-L374 VanDerWaalsContact CZ-CD2 3.46Å; L337-L374 HydrophobicContact CD1-CD2 4.36Å; S350-L374 CarbonylContact C-O 3.56Å; S350-L374 WeakPolarHBondContact CA-O 3.38Å; S350-L374 VanDerWaalsContact CB-O 3.23Å; S350-L374 WeakPolarHBondContact CB-O 3.46Å; F351-L374 HydrophobicContact CB-CB 4.48Å; F351-L374 PolarHBondContact N-O 3.17Å; F351-L374 PolarHBondContact O-N 2.92Å; F353-L374 HydrophobicContact CE1-CB 4.14Å
375	R	89.8	Confident	90.1	Very high	87 Å²	87	48.5 Å²	48.5	33%	0.328	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.2	178.6	-64.8	179.1	66.8	-126	1.5	110.1	I250 I251 N252 I253 W373	I250-R375 HydrophobicContact CG2-CG 4.11Å; I251-R375 PolarHBondContact O-N 3.43Å; N252-R375 CarbonylContact C-O 3.37Å; N252-R375 VanDerWaalsContact CA-O 3.28Å; N252-R375 WeakPolarHBondContact CA-O 3.39Å; N252-R375 PolarHBondContact OD1-NH1 2.84Å; I253-R375 PolarHBondContact N-O 2.84Å; W373-R375 HydrophobicContact CD2-CG 3.79Å; W373-R375 HydrophobicContact CE3-CG 4.25Å; W373-R375 HydrophobicContact CG-CG 4.16Å; W373-R375 HydrophobicContact CH2-CG 4.43Å; W373-R375 HydrophobicContact CZ2-CG 3.99Å
376	I	91.9	Very high	90.3	Very high	8 Å²	8	46.4 Å²	46.4	4%	0.041	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.8	171.5	-67.1	162.7	0	0	0	107.7	I253 E255 L343 R345 I348 S349 F351	I253-I376 HydrophobicContact CG2-CG1 3.96Å; I253-I376 CarbonylContact O-C 3.52Å; I253-I376 WeakPolarHBondContact O-CA 3.46Å; E255-I376 HydrophobicContact CB-CG2 3.59Å; L343-I376 HydrophobicContact CB-CD1 4.16Å; L343-I376 HydrophobicContact CD1-CD1 4.23Å; L343-I376 HydrophobicContact CD1-CG1 4.18Å; L343-I376 HydrophobicContact CD2-CD1 4.29Å; L343-I376 HydrophobicContact CG-CD1 4.45Å; R345-I376 HydrophobicContact CB-CG2 3.78Å; R345-I376 HydrophobicContact CG-CB 4.21Å; R345-I376 HydrophobicContact CG-CG2 3.89Å; I348-I376 WeakPolarHBondContact O-CD1 3.33Å; S349-I376 PolarHBondContact O-N 3.12Å; F351-I376 HydrophobicContact CD2-CD1 4.28Å; F351-I376 HydrophobicContact CE2-CD1 3.9Å
377	L	89.9	Confident	90.2	Very high	44 Å²	44	48.3 Å²	48.3	23%	0.23	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143.3	-177.2	-62.4	176.6	0	0	0	110	N252 I253 M254 E255 Y317	N252-L377 HydrophobicContact CB-CD1 3.71Å; N252-L377 HydrophobicContact CB-CD2 3.97Å; N252-L377 HydrophobicContact CB-CG 3.82Å; I253-L377 WeakPolarHBondContact O-CB 3.42Å; I253-L377 PolarHBondContact O-N 2.81Å; M254-L377 HydrophobicContact SD-CB 3.71Å; M254-L377 HydrophobicContact SD-CD1 3.66Å; M254-L377 HydrophobicContact SD-CG 4.32Å; E255-L377 PolarHBondContact N-O 2.7Å; Y317-L377 HydrophobicContact CD2-CD1 3.83Å; Y317-L377 HydrophobicContact CE2-CD1 4.23Å
378	D	91.1	Very high	90	Very high	31 Å²	31	51 Å²	51	17%	0.166	26%	0.263	C	S	.	.			trans	-70.8	129.1	-171.4	-161.9	71.5	0	0	0	113.3	E255 R345 I414 N417	E255-D378 WeakPolarHBondContact OE1-CA 3.37Å; R345-D378 IonicContact CZ-OD1 2.67Å; R345-D378 IonicContact NE-OD1 2.64Å; R345-D378 PolarHBondContact NE-OD1 3.28Å; R345-D378 IonicContact NH2-OD1 2.64Å; R345-D378 PolarHBondContact NH2-OD1 3.03Å; D378-I414 HydrophobicContact CB-CD1 4.12Å; D378-I414 HydrophobicContact CB-CG1 3.6Å; D378-I414 VanDerWaalsContact OD1-CG1 3.3Å; D378-I414 WeakPolarHBondContact OD1-CG1 3Å; D378-I414 PolarHBondContact OD1-N 3.09Å; D378-I414 VanDerWaalsContact OD1-N 3.08Å; D378-I414 PolarHBondContact OD2-N 3.31Å; D378-N417 WeakPolarHBondContact OD2-CB 3.4Å; D378-N417 PolarHBondContact OD2-ND2 3.14Å
379	E	90	Very high	89.9	Confident	79 Å²	79	54.2 Å²	54.2	37%	0.369	29%	0.286	S	S	.	.			trans	-114.7	150.7	161.3	-64.6	-164.8	161.2	0	0	109.7	E255 D381	E255-E379 HydrophobicContact CG-CB 4.11Å; E255-E379 HydrophobicContact CG-CG 4.24Å; E255-E379 PolarHBondContact OE1-N 2.84Å; E379-D381 PolarHBondContact O-N 2.99Å
380	N	92.6	Very high	90	Very high	18 Å²	18	55.2 Å²	55.2	10%	0.096	28%	0.281	C	S	.	.	S	Bend	trans	-84.8	75	-172.6	-163.6	112.9	0	0	0	112	D413 N417 D475 G477 P479 L481	N380-D413 VanDerWaalsContact CA-OD2 3.23Å; N380-D413 WeakPolarHBondContact CA-OD2 3.25Å; N380-N417 HydrophobicContact CB-CB 4.08Å; N380-N417 WeakPolarHBondContact OD1-CA 3.32Å; N380-N417 WeakPolarHBondContact OD1-CB 3.05Å; N380-N417 PolarHBondContact OD1-OD1 2.93Å; N380-D475 PolarHBondContact ND2-OD2 2.96Å; N380-G477 WeakPolarHBondContact OD1-CA 3.48Å; N380-P479 PolarHBondContact ND2-O 3.13Å; N380-L481 WeakPolarHBondContact ND2-CG 3.3Å
381	D	91.8	Very high	90.2	Very high	74 Å²	74	55.2 Å²	55.2	40%	0.396	28%	0.281	S	S	.	.			trans	-113.8	-13.8	-175.3	84.8	7.6	0	0	0	116.1	N256 E379 P383 D413	N256-D381 PolarHBondContact ND2-OD2 3.37Å; E379-D381 PolarHBondContact O-N 2.99Å; D381-P383 WeakPolarHBondContact O-CD 3.47Å; D381-D413 PolarHBondContact N-OD2 3.45Å
382	N	91.4	Very high	90.5	Very high	43 Å²	43	57 Å²	57	23%	0.23	29%	0.287	C	S	.	.	S	Bend	trans	-90	120.8	170.3	-62.4	-89.4	0	0	0	111	E346 D413	E346-N382 PolarHBondContact OE2-ND2 3.17Å; N382-D413 WeakPolarHBondContact CB-OD1 3.5Å; N382-D413 PolarHBondContact N-OD1 3.17Å; N382-D413 PolarHBondContact ND2-OD1 3.1Å
383	P	92	Very high	90.6	Very high	62 Å²	62	58 Å²	58	40%	0.403	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-77	150.3	172.7	31.1	-34.3	0	0	0	111.4	D381 V385 L481	D381-P383 WeakPolarHBondContact O-CD 3.47Å; P383-V385 VanDerWaalsContact O-CG2 3.25Å; P383-V385 WeakPolarHBondContact O-CG2 3.15Å; P383-V385 PolarHBondContact O-N 3.35Å; P383-L481 HydrophobicContact CB-CB 3.97Å; P383-L481 HydrophobicContact CB-CD1 4.12Å
384	P	93.5	Very high	90.8	Very high	2 Å²	2	61.2 Å²	61.2	1%	0.013	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-55	127.3	176.5	-21.7	25.3	0	0	0	113	V409 D411 L420 C473 D475 A483	P384-V409 HydrophobicContact CB-CG1 3.9Å; P384-D411 WeakPolarHBondContact CA-OD2 3.19Å; P384-D411 WeakPolarHBondContact CD-OD2 3.25Å; P384-D411 VanDerWaalsContact CG-OD2 3.23Å; P384-D411 WeakPolarHBondContact CG-OD2 3.32Å; P384-L420 HydrophobicContact CB-CD2 3.71Å; P384-L420 HydrophobicContact CG-CD2 3.57Å; P384-C473 HydrophobicContact CB-CB 4.33Å; P384-D475 HydrophobicContact CG-CB 4.47Å; P384-A483 WeakPolarHBondContact O-CB 3.36Å
385	V	91.6	Very high	90.7	Very high	87 Å²	87	61.3 Å²	61.3	53%	0.527	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	119.8	-175.7	-172	0	0	0	0	112.5	P383 V409 N410	P383-V385 VanDerWaalsContact O-CG2 3.25Å; P383-V385 WeakPolarHBondContact O-CG2 3.15Å; P383-V385 PolarHBondContact O-N 3.35Å; V385-V409 WeakPolarHBondContact O-CA 3.36Å; V385-N410 PolarHBondContact N-O 3.44Å; V385-N410 PolarHBondContact O-N 2.99Å
386	F	90.9	Very high	90.6	Very high	21 Å²	21	59 Å²	59	9%	0.092	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	138.8	170	-69.5	-100.1	0	0	0	111.2	K388 F391 I407 V409 I471 C473 A483 A485	F386-K388 WeakPolarHBondContact CB-O 3.48Å; F386-K388 PolarHBondContact O-N 2.72Å; F386-K388 VanDerWaalsContact O-N 3.1Å; F386-F391 HydrophobicContact CD1-CE2 4.4Å; F386-I407 HydrophobicContact CD1-CG2 3.7Å; F386-I407 HydrophobicContact CE1-CG2 3.89Å; F386-V409 HydrophobicContact CD1-CG2 3.45Å; F386-V409 VanDerWaalsContact CD1-CG2 3.45Å; F386-V409 HydrophobicContact CD2-CG1 4.41Å; F386-V409 HydrophobicContact CD2-CG2 4.33Å; F386-V409 HydrophobicContact CE1-CG2 3.45Å; F386-V409 VanDerWaalsContact CE1-CG2 3.45Å; F386-V409 HydrophobicContact CE2-CG2 4.33Å; F386-V409 HydrophobicContact CG-CG2 3.91Å; F386-V409 HydrophobicContact CZ-CG2 3.93Å; F386-I471 HydrophobicContact CD1-CG2 4.44Å; F386-I471 HydrophobicContact CE1-CG2 3.54Å; F386-I471 HydrophobicContact CZ-CG2 3.99Å; F386-C473 HydrophobicContact CE2-CB 3.71Å; F386-C473 HydrophobicContact CZ-CB 3.62Å; F386-A483 HydrophobicContact CD2-CB 3.99Å; F386-A483 HydrophobicContact CE2-CB 3.97Å; F386-A485 HydrophobicContact CB-CB 4.2Å; F386-A485 HydrophobicContact CD1-CB 3.62Å; F386-A485 HydrophobicContact CD2-CB 4.31Å; F386-A485 HydrophobicContact CE1-CB 4.02Å; F386-A485 HydrophobicContact CG-CB 3.79Å; F386-A485 HydrophobicContact CZ-CB 4.49Å
387	Q	86.5	Confident	90.4	Very high	137 Å²	137	58.7 Å²	58.7	64%	0.64	30%	0.303	S	S	*	.	S	Bend	trans	-58.4	-23.5	174.3	-71.1	-173.7	-18	0	0	114.4	H408	Q387-H408 HydrophobicContact CG-CB 4.13Å; Q387-H408 PolarHBondContact N-O 2.86Å; Q387-H408 PolarHBondContact NE2-CD2 2.89Å
388	K	88.4	Confident	90.1	Very high	128 Å²	128	61.1 Å²	61.1	56%	0.557	32%	0.316	S	S	*	.			trans	-145.2	145.1	177.6	-60.3	-178.2	-178.7	175.8	0	110	F386 F391 A485	F386-K388 WeakPolarHBondContact CB-O 3.48Å; F386-K388 PolarHBondContact O-N 2.72Å; F386-K388 VanDerWaalsContact O-N 3.1Å; K388-F391 HydrophobicContact CB-CD1 4.47Å; K388-F391 HydrophobicContact CB-CE1 3.98Å; K388-F391 HydrophobicContact CB-CE2 4.16Å; K388-F391 HydrophobicContact CB-CZ 3.81Å; K388-F391 HydrophobicContact CD-CD1 4.29Å; K388-F391 HydrophobicContact CD-CE1 4.06Å; K388-F391 HydrophobicContact CG-CE1 4.24Å; K388-F391 HydrophobicContact CG-CZ 4.44Å; K388-F391 WeakPolarHBondContact O-CE2 3.35Å; K388-A485 WeakPolarHBondContact O-CB 3.46Å
389	S	88.5	Confident	89.5	Confident	102 Å²	102	64.6 Å²	64.6	71%	0.713	33%	0.329	S	S	*	.	S	Bend	trans	-78.1	-22.7	173.9	53	0	0	0	0	113.7	A485 Q486	S389-A485 CarbonylContact O-C 3.45Å; S389-A485 WeakPolarHBondContact O-CA 3.5Å; S389-Q486 PolarHBondContact O-N 2.92Å
390	E	91.8	Very high	89.1	Confident	100 Å²	100	62.8 Å²	62.8	47%	0.467	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139	175.8	-171.3	-176.8	174.9	0	0	110.5	Q486	E390-Q486 CarbonylContact C-O 3.57Å; E390-Q486 WeakPolarHBondContact CA-O 3.01Å; E390-Q486 HydrophobicContact CG-CB 4.43Å
391	F	90.8	Very high	88.3	Confident	17 Å²	17	63.3 Å²	63.3	8%	0.075	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.8	171.2	-62.8	-89.4	0	0	0	109.7	F386 K388 L405 I407 A485 Q486 I487 K488	F386-F391 HydrophobicContact CD1-CE2 4.4Å; K388-F391 HydrophobicContact CB-CD1 4.47Å; K388-F391 HydrophobicContact CB-CE1 3.98Å; K388-F391 HydrophobicContact CB-CE2 4.16Å; K388-F391 HydrophobicContact CB-CZ 3.81Å; K388-F391 HydrophobicContact CD-CD1 4.29Å; K388-F391 HydrophobicContact CD-CE1 4.06Å; K388-F391 HydrophobicContact CG-CE1 4.24Å; K388-F391 HydrophobicContact CG-CZ 4.44Å; K388-F391 WeakPolarHBondContact O-CE2 3.35Å; F391-L405 HydrophobicContact CB-CD2 3.8Å; F391-L405 HydrophobicContact CD1-CD1 4.43Å; F391-L405 HydrophobicContact CD1-CD2 3.61Å; F391-L405 HydrophobicContact CE1-CD2 4.35Å; F391-L405 HydrophobicContact CG-CD2 3.8Å; F391-I407 HydrophobicContact CE2-CG2 4.05Å; F391-I407 HydrophobicContact CZ-CG2 3.95Å; F391-A485 HydrophobicContact CD2-CB 4.18Å; F391-A485 HydrophobicContact CE2-CB 3.89Å; F391-Q486 PolarHBondContact N-O 2.85Å; F391-I487 HydrophobicContact CB-CG1 4.49Å; F391-I487 WeakPolarHBondContact O-CA 3.48Å; F391-K488 PolarHBondContact O-N 3.19Å
392	H	92	Very high	87.6	Confident	98 Å²	98	64.8 Å²	64.8	45%	0.454	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.7	171.2	-170.5	28.7	0	0	0	110.1	K488 T490	H392-K488 WeakPolarHBondContact CA-O 3.29Å; H392-K488 PolarHBondContact ND1-O 2.79Å; H392-T490 PolarHBondContact CE1-OG1 2.86Å
393	I	90.1	Very high	87.1	Confident	20 Å²	20	66.1 Å²	66.1	10%	0.103	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	129	179.4	-40.7	178	0	0	0	108.8	V395 L404 L405 I487 K488 I489 T490	I393-V395 HydrophobicContact CB-CG2 4.37Å; I393-V395 HydrophobicContact CG2-CG2 3.62Å; I393-L404 HydrophobicContact CG2-CB 4.41Å; I393-L404 HydrophobicContact CG2-CD1 4.4Å; I393-L405 HydrophobicContact CD1-CB 3.96Å; I393-L405 HydrophobicContact CD1-CD2 3.83Å; I393-L405 HydrophobicContact CG1-CD2 4.34Å; I393-I487 HydrophobicContact CD1-CG2 4.02Å; I393-K488 PolarHBondContact N-O 2.98Å; I393-I489 WeakPolarHBondContact O-CA 3.41Å; I393-T490 PolarHBondContact O-N 2.94Å
394	E	90.8	Very high	86.6	Confident	127 Å²	127	65.7 Å²	65.7	59%	0.593	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.6	169.8	-66.7	-178.8	166.5	0	0	109.4	T490 L492	E394-T490 WeakPolarHBondContact CA-O 3.42Å; E394-L492 HydrophobicContact CB-CD1 4.03Å; E394-L492 HydrophobicContact CB-CD2 4.21Å; E394-L492 HydrophobicContact CB-CG 4.08Å; E394-L492 HydrophobicContact CG-CD2 4.46Å
395	V	89.4	Confident	86.2	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.012	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	123	-174.4	-162.6	0	0	0	0	112.2	I393 E397 K399 L404 I455 I489 T490 V491 L492	I393-V395 HydrophobicContact CB-CG2 4.37Å; I393-V395 HydrophobicContact CG2-CG2 3.62Å; V395-E397 PolarHBondContact O-N 2.85Å; V395-K399 HydrophobicContact CG1-CB 4.03Å; V395-K399 HydrophobicContact CG1-CD 4.21Å; V395-L404 HydrophobicContact CG1-CD1 4.48Å; V395-L404 HydrophobicContact CG1-CD2 3.83Å; V395-L404 HydrophobicContact CG2-CD1 3.7Å; V395-L404 HydrophobicContact CG2-CD2 4.02Å; V395-L404 HydrophobicContact CG2-CG 4.49Å; V395-I455 HydrophobicContact CB-CD1 4.39Å; V395-I455 HydrophobicContact CG1-CD1 3.73Å; V395-I489 HydrophobicContact CG2-CG2 4.3Å; V395-T490 PolarHBondContact N-O 2.98Å; V395-V491 CarbonylContact O-C 3.56Å; V395-V491 WeakPolarHBondContact O-CA 3.26Å; V395-L492 PolarHBondContact O-N 2.8Å
396	N	87.6	Confident	86	Confident	39 Å²	39	68.4 Å²	68.4	21%	0.209	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	129.1	168.9	-46.6	74.4	0	0	0	110	N398 K399 L492 M494	N396-N398 VanDerWaalsContact C-N 3.3Å; N396-N398 PolarHBondContact O-N 2.87Å; N396-K399 HydrophobicContact CB-CD 3.95Å; N396-K399 HydrophobicContact CB-CG 4.14Å; N396-K399 VanDerWaalsContact O-CB 3.32Å; N396-K399 WeakPolarHBondContact O-CB 3.37Å; N396-K399 PolarHBondContact O-N 3.16Å; N396-K399 WeakPolarHBondContact OD1-CE 3.48Å; N396-K399 PolarHBondContact OD1-NZ 3.15Å; N396-L492 WeakPolarHBondContact CA-O 3.32Å; N396-M494 HydrophobicContact CB-CG 3.85Å; N396-M494 HydrophobicContact CB-SD 3.89Å; N396-M494 PolarHBondContact ND2-SD 3.13Å
397	E	88.7	Confident	86	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.009	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-40.8	-168.8	69.2	-147.2	101.2	0	0	114.7	V395 K399 L459 Y461 V491 L492 N493 M494	V395-E397 PolarHBondContact O-N 2.85Å; E397-K399 PolarHBondContact O-N 3.38Å; E397-L459 HydrophobicContact CB-CB 4.23Å; E397-L459 WeakPolarHBondContact CB-O 3.27Å; E397-L459 PolarHBondContact O-N 3.34Å; E397-Y461 WeakPolarHBondContact OE2-CB 3.38Å; E397-Y461 PolarHBondContact OE2-N 2.79Å; E397-V491 HydrophobicContact CB-CG1 3.5Å; E397-L492 PolarHBondContact N-O 2.75Å; E397-N493 VanDerWaalsContact OE1-CA 3.32Å; E397-N493 WeakPolarHBondContact OE1-CA 3.45Å; E397-M494 HydrophobicContact CG-CB 4.36Å; E397-M494 HydrophobicContact CG-CG 4.48Å; E397-M494 WeakPolarHBondContact OE1-CB 3.11Å; E397-M494 PolarHBondContact OE1-N 3.3Å
398	N	83.9	Confident	86.1	Confident	95 Å²	95	63.3 Å²	63.3	51%	0.508	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.4	177.5	-81.5	-87.5	0	0	0	114.8	N396 A400 D496	N396-N398 VanDerWaalsContact C-N 3.3Å; N396-N398 PolarHBondContact O-N 2.87Å; N398-A400 PolarHBondContact O-N 3.23Å; N398-D496 PolarHBondContact ND2-OD2 3.16Å
399	K	77	Confident	86.2	Confident	104 Å²	104	57.5 Å²	57.5	45%	0.452	31%	0.312	S	S	.	.			trans	-84.1	89.2	177.7	-74.8	175	172.7	169.7	0	112.5	V395 N396 E397 I455	V395-K399 HydrophobicContact CG1-CB 4.03Å; V395-K399 HydrophobicContact CG1-CD 4.21Å; N396-K399 HydrophobicContact CB-CD 3.95Å; N396-K399 HydrophobicContact CB-CG 4.14Å; N396-K399 VanDerWaalsContact O-CB 3.32Å; N396-K399 WeakPolarHBondContact O-CB 3.37Å; N396-K399 PolarHBondContact O-N 3.16Å; N396-K399 WeakPolarHBondContact OD1-CE 3.48Å; N396-K399 PolarHBondContact OD1-NZ 3.15Å; E397-K399 PolarHBondContact O-N 3.38Å; K399-I455 WeakPolarHBondContact O-CG2 3.44Å
400	A	81.4	Confident	86.2	Confident	41 Å²	41	56.4 Å²	56.4	34%	0.339	30%	0.299	S	S	.	.			trans	-99.3	154	166.8	0	0	0	0	0	113	N398 I402 I455 P458	N398-A400 PolarHBondContact O-N 3.23Å; A400-I402 PolarHBondContact O-N 3.35Å; A400-I455 HydrophobicContact CB-CG2 4.42Å; A400-P458 HydrophobicContact CB-CB 4.3Å
401	G	77.5	Confident	86.2	Confident	29 Å²	29	52.4 Å²	52.4	30%	0.299	28%	0.28	S	S	.	.	S	Bend	trans	85.3	-3.3	164.1	0	0	0	0	0	117	R454 I455	G401-R454 VanDerWaalsContact C-NE 3.34Å; G401-R454 VanDerWaalsContact O-CZ 3.27Å; G401-R454 PolarHBondContact O-NE 2.79Å; G401-R454 PolarHBondContact O-NH2 3.44Å; G401-I455 WeakPolarHBondContact CA-O 3.46Å; G401-I455 PolarHBondContact N-O 2.96Å
402	I	75.6	Confident	86.3	Confident	105 Å²	105	53.9 Å²	53.9	54%	0.538	29%	0.292	S	S	.	.	S	Bend	trans	-106	139.6	-178.9	-53.7	177.9	0	0	0	109.7	A400	A400-I402 PolarHBondContact O-N 3.35Å
403	P	80.5	Confident	86.4	Confident	71 Å²	71	49.5 Å²	49.5	46%	0.461	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.5	168.3	28.1	-34.2	0	0	0	110.9	S452 L453	P403-S452 VanDerWaalsContact CB-OG 3.26Å; P403-S452 WeakPolarHBondContact CB-OG 3.42Å; P403-L453 CarbonylContact C-O 3.59Å
404	L	82.3	Confident	86.3	Confident	52 Å²	52	52.2 Å²	52.2	27%	0.272	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-40.4	-178.3	-62.7	178	0	0	0	112.9	I393 V395 L453 I455	I393-L404 HydrophobicContact CG2-CB 4.41Å; I393-L404 HydrophobicContact CG2-CD1 4.4Å; V395-L404 HydrophobicContact CG1-CD1 4.48Å; V395-L404 HydrophobicContact CG1-CD2 3.83Å; V395-L404 HydrophobicContact CG2-CD1 3.7Å; V395-L404 HydrophobicContact CG2-CD2 4.02Å; V395-L404 HydrophobicContact CG2-CG 4.49Å; L404-L453 HydrophobicContact CD1-CD2 4Å; L404-L453 PolarHBondContact N-O 3.42Å; L404-I455 HydrophobicContact CD1-CD1 3.72Å; L404-I455 HydrophobicContact CD1-CG1 3.73Å; L404-I455 HydrophobicContact CD2-CD1 4.47Å; L404-I455 HydrophobicContact CG-CD1 4.47Å; L404-I455 HydrophobicContact CG-CG1 4.42Å
405	L	85.3	Confident	86.2	Confident	43 Å²	43	53.2 Å²	53.2	23%	0.225	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	126.6	-168.8	177	65.4	0	0	0	109.6	F391 I393 I407 S452 L453	F391-L405 HydrophobicContact CB-CD2 3.8Å; F391-L405 HydrophobicContact CD1-CD1 4.43Å; F391-L405 HydrophobicContact CD1-CD2 3.61Å; F391-L405 HydrophobicContact CE1-CD2 4.35Å; F391-L405 HydrophobicContact CG-CD2 3.8Å; I393-L405 HydrophobicContact CD1-CB 3.96Å; I393-L405 HydrophobicContact CD1-CD2 3.83Å; I393-L405 HydrophobicContact CG1-CD2 4.34Å; L405-I407 HydrophobicContact CD2-CD1 4.11Å; L405-I407 HydrophobicContact CD2-CG1 3.71Å; L405-I407 HydrophobicContact CG-CG1 3.81Å; L405-S452 WeakPolarHBondContact O-CA 3.02Å; L405-L453 PolarHBondContact O-N 3.25Å
406	N	87.7	Confident	86.1	Confident	104 Å²	104	55.8 Å²	55.8	56%	0.556	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	117.6	164.7	-67.3	-14.5	0	0	0	107.9	S452	N406-S452 VanDerWaalsContact OD1-CB 3.25Å; N406-S452 WeakPolarHBondContact OD1-CB 3.25Å; N406-S452 PolarHBondContact OD1-OG 2.88Å
407	I	90	Very high	86.3	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	107.8	178.1	-57.1	176.6	0	0	0	107	F386 F391 L405 V409 V451 I471 I487	F386-I407 HydrophobicContact CD1-CG2 3.7Å; F386-I407 HydrophobicContact CE1-CG2 3.89Å; F391-I407 HydrophobicContact CE2-CG2 4.05Å; F391-I407 HydrophobicContact CZ-CG2 3.95Å; L405-I407 HydrophobicContact CD2-CD1 4.11Å; L405-I407 HydrophobicContact CD2-CG1 3.71Å; L405-I407 HydrophobicContact CG-CG1 3.81Å; I407-V409 HydrophobicContact CG2-CG2 4.12Å; I407-V451 HydrophobicContact CB-CG1 3.97Å; I407-V451 PolarHBondContact N-O 2.97Å; I407-V451 PolarHBondContact O-N 3.48Å; I407-V451 VanDerWaalsContact O-N 3.11Å; I407-I471 HydrophobicContact CD1-CD1 4.01Å; I407-I471 HydrophobicContact CD1-CG2 4.23Å; I407-I487 HydrophobicContact CD1-CD1 3.59Å
408	H	89.9	Confident	86.3	Confident	48 Å²	48	56.2 Å²	56.2	22%	0.222	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	127.7	169.4	-178.2	66.3	0	0	0	109.7	Q387 E449	Q387-H408 HydrophobicContact CG-CB 4.13Å; Q387-H408 PolarHBondContact N-O 2.86Å; Q387-H408 PolarHBondContact NE2-CD2 2.89Å; H408-E449 WeakPolarHBondContact CA-O 3.29Å; H408-E449 PolarHBondContact ND1-O 2.93Å
409	V	89.7	Confident	86.6	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.042	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	120.4	169.1	-174.1	0	0	0	0	105.4	P384 V385 F386 I407 L420 Y422 C473	P384-V409 HydrophobicContact CB-CG1 3.9Å; V385-V409 WeakPolarHBondContact O-CA 3.36Å; F386-V409 HydrophobicContact CD1-CG2 3.45Å; F386-V409 VanDerWaalsContact CD1-CG2 3.45Å; F386-V409 HydrophobicContact CD2-CG1 4.41Å; F386-V409 HydrophobicContact CD2-CG2 4.33Å; F386-V409 HydrophobicContact CE1-CG2 3.45Å; F386-V409 VanDerWaalsContact CE1-CG2 3.45Å; F386-V409 HydrophobicContact CE2-CG2 4.33Å; F386-V409 HydrophobicContact CG-CG2 3.91Å; F386-V409 HydrophobicContact CZ-CG2 3.93Å; I407-V409 HydrophobicContact CG2-CG2 4.12Å; V409-L420 HydrophobicContact CB-CD1 3.82Å; V409-L420 HydrophobicContact CG1-CD1 3.68Å; V409-Y422 HydrophobicContact CB-CE1 4.3Å; V409-Y422 HydrophobicContact CG2-CE1 3.89Å; V409-C473 HydrophobicContact CG1-CB 4.34Å
410	N	89.1	Confident	87.2	Confident	79 Å²	79	55.3 Å²	55.3	42%	0.422	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	141.3	174.7	-165.8	82.4	0	0	0	109	V385	V385-N410 PolarHBondContact N-O 3.44Å; V385-N410 PolarHBondContact O-N 2.99Å
411	D	92.4	Very high	87.7	Confident	16 Å²	16	57 Å²	57	9%	0.086	31%	0.313	C	S	.	.			trans	-124.8	141.1	166.2	-157.6	-53.5	0	0	0	106.4	P384 D413 A418 L420	P384-D411 WeakPolarHBondContact CA-OD2 3.19Å; P384-D411 WeakPolarHBondContact CD-OD2 3.25Å; P384-D411 VanDerWaalsContact CG-OD2 3.23Å; P384-D411 WeakPolarHBondContact CG-OD2 3.32Å; D411-D413 PolarHBondContact OD1-N 2.99Å; D411-A418 HydrophobicContact CB-CB 3.8Å; D411-L420 HydrophobicContact CB-CD1 4.41Å; D411-L420 HydrophobicContact CB-CD2 3.97Å; D411-L420 HydrophobicContact CB-CG 4.4Å
412	S	91.6	Very high	88.3	Confident	47 Å²	47	58.4 Å²	58.4	33%	0.329	31%	0.31	S	S	.	.			trans	-93.1	-20.7	-169.4	-47.6	0	0	0	0	112.4	R345	R345-S412 PolarHBondContact NH2-O 3.01Å
413	D	93.7	Very high	89	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.032	31%	0.305	C	S	.	.	S	Bend	trans	-69.4	-171	-178.2	-59	-6.5	0	0	0	111.5	R345 N380 D381 N382 D411 N417 A418	R345-D413 VanDerWaalsContact NH2-C 3.26Å; R345-D413 VanDerWaalsContact NH2-CA 3.27Å; N380-D413 VanDerWaalsContact CA-OD2 3.23Å; N380-D413 WeakPolarHBondContact CA-OD2 3.25Å; D381-D413 PolarHBondContact N-OD2 3.45Å; N382-D413 WeakPolarHBondContact CB-OD1 3.5Å; N382-D413 PolarHBondContact N-OD1 3.17Å; N382-D413 PolarHBondContact ND2-OD1 3.1Å; D411-D413 PolarHBondContact OD1-N 2.99Å; D413-N417 HydrophobicContact CB-CB 3.45Å; D413-N417 VanDerWaalsContact CB-CB 3.45Å; D413-A418 HydrophobicContact CB-CB 4.44Å; D413-A418 WeakPolarHBondContact O-CB 3.35Å
414	I	89.7	Confident	89.6	Confident	77 Å²	77	57.8 Å²	57.8	40%	0.395	30%	0.296	S	S	.	.			trans	-128.5	169.7	175.4	55.1	160.8	0	0	0	115.2	D378 S416 N417	D378-I414 HydrophobicContact CB-CD1 4.12Å; D378-I414 HydrophobicContact CB-CG1 3.6Å; D378-I414 VanDerWaalsContact OD1-CG1 3.3Å; D378-I414 WeakPolarHBondContact OD1-CG1 3Å; D378-I414 PolarHBondContact OD1-N 3.09Å; D378-I414 VanDerWaalsContact OD1-N 3.08Å; D378-I414 PolarHBondContact OD2-N 3.31Å; I414-S416 PolarHBondContact O-N 2.9Å; I414-N417 WeakPolarHBondContact O-CB 3.37Å; I414-N417 PolarHBondContact O-N 2.98Å
415	D	86.8	Confident	89.8	Confident	149 Å²	149	60.1 Å²	60.1	80%	0.797	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	-91.9	174.4	-74.2	-31.1	0	0	0	116.1	R419	D415-R419 WeakPolarHBondContact O-CB 3.32Å
416	S	88.8	Confident	89.9	Confident	56 Å²	56	60.2 Å²	60.2	39%	0.392	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-27.3	176.3	48.6	0	0	0	0	113.1	I414 R419 Q476	I414-S416 PolarHBondContact O-N 2.9Å; S416-R419 VanDerWaalsContact O-CB 3.26Å; S416-R419 WeakPolarHBondContact O-CB 3.48Å; S416-R419 PolarHBondContact O-N 3.05Å; S416-Q476 CarbonylContact O-C 3.58Å; S416-Q476 WeakPolarHBondContact O-CA 3.23Å; S416-Q476 WeakPolarHBondContact O-CB 3.34Å; S416-Q476 PolarHBondContact O-N 3.5Å
417	N	90.3	Very high	89.6	Confident	18 Å²	18	56.8 Å²	56.8	10%	0.096	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-46.4	-169.1	-63.7	-1.2	0	0	0	109	D378 N380 D413 I414 R419 D475	D378-N417 WeakPolarHBondContact OD2-CB 3.4Å; D378-N417 PolarHBondContact OD2-ND2 3.14Å; N380-N417 HydrophobicContact CB-CB 4.08Å; N380-N417 WeakPolarHBondContact OD1-CA 3.32Å; N380-N417 WeakPolarHBondContact OD1-CB 3.05Å; N380-N417 PolarHBondContact OD1-OD1 2.93Å; D413-N417 HydrophobicContact CB-CB 3.45Å; D413-N417 VanDerWaalsContact CB-CB 3.45Å; I414-N417 WeakPolarHBondContact O-CB 3.37Å; I414-N417 PolarHBondContact O-N 2.98Å; N417-R419 PolarHBondContact O-N 2.81Å; N417-D475 WeakPolarHBondContact O-CB 3.13Å
418	A	89.1	Confident	88.7	Confident	32 Å²	32	63.4 Å²	63.4	26%	0.264	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	14.9	165.8	0	0	0	0	0	115.7	D411 D413 L420	D411-A418 HydrophobicContact CB-CB 3.8Å; D413-A418 HydrophobicContact CB-CB 4.44Å; D413-A418 WeakPolarHBondContact O-CB 3.35Å; A418-L420 PolarHBondContact O-N 3.33Å
419	R	89.8	Confident	87.5	Confident	147 Å²	147	63 Å²	63	56%	0.555	33%	0.331	S	S	*	.			trans	-94	84.7	-170.6	-160	175.8	175.5	-145.3	6.5	114.9	D415 S416 N417 D475 Q476	D415-R419 WeakPolarHBondContact O-CB 3.32Å; S416-R419 VanDerWaalsContact O-CB 3.26Å; S416-R419 WeakPolarHBondContact O-CB 3.48Å; S416-R419 PolarHBondContact O-N 3.05Å; N417-R419 PolarHBondContact O-N 2.81Å; R419-D475 CarbonylContact O-C 3.59Å; R419-Q476 HydrophobicContact CB-CB 4.29Å; R419-Q476 HydrophobicContact CB-CG 4.39Å; R419-Q476 WeakPolarHBondContact O-CG 3.46Å; R419-Q476 PolarHBondContact O-N 2.79Å; R419-Q476 PolarHBondContact O-NE2 2.79Å
420	L	90.2	Very high	85.6	Confident	33 Å²	33	71 Å²	71	17%	0.173	37%	0.37	C	S	.	.			trans	-68.2	134.6	-171.3	-55.4	-171.6	0	0	0	116.1	P384 V409 D411 A418 Y422 V474	P384-L420 HydrophobicContact CB-CD2 3.71Å; P384-L420 HydrophobicContact CG-CD2 3.57Å; V409-L420 HydrophobicContact CB-CD1 3.82Å; V409-L420 HydrophobicContact CG1-CD1 3.68Å; D411-L420 HydrophobicContact CB-CD1 4.41Å; D411-L420 HydrophobicContact CB-CD2 3.97Å; D411-L420 HydrophobicContact CB-CG 4.4Å; A418-L420 PolarHBondContact O-N 3.33Å; L420-Y422 HydrophobicContact CB-CE2 3.95Å; L420-Y422 WeakPolarHBondContact CD1-OH 3.45Å; L420-V474 CarbonylContact C-O 3.52Å
421	N	91	Very high	84.3	Confident	76 Å²	76	70.2 Å²	70.2	41%	0.406	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.2	168.9	-68.6	-62	0	0	0	109.9	C473 V474 D475 Q476	N421-C473 WeakPolarHBondContact O-CA 3.44Å; N421-V474 PolarHBondContact N-O 2.56Å; N421-V474 PolarHBondContact O-N 3Å; N421-D475 PolarHBondContact ND2-O 3Å; N421-Q476 WeakPolarHBondContact ND2-CG 3.23Å; N421-Q476 PolarHBondContact ND2-NE2 3.1Å; N421-Q476 PolarHBondContact OD1-NE2 2.96Å
422	Y	91.9	Very high	83.2	Confident	59 Å²	59	74.8 Å²	74.8	23%	0.231	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.5	-174.3	-56.7	-87.5	0	0	0	113	V409 L420 G450 V451 I471 V472 C473	V409-Y422 HydrophobicContact CB-CE1 4.3Å; V409-Y422 HydrophobicContact CG2-CE1 3.89Å; L420-Y422 HydrophobicContact CB-CE2 3.95Å; L420-Y422 WeakPolarHBondContact CD1-OH 3.45Å; Y422-G450 WeakPolarHBondContact OH-CA 3.24Å; Y422-V451 HydrophobicContact CD1-CB 4.01Å; Y422-V451 HydrophobicContact CD1-CG1 3.66Å; Y422-V451 HydrophobicContact CD2-CB 3.98Å; Y422-V451 HydrophobicContact CD2-CG2 4.28Å; Y422-V451 HydrophobicContact CE1-CB 4.04Å; Y422-V451 HydrophobicContact CE1-CG1 3.69Å; Y422-V451 HydrophobicContact CE2-CB 4.04Å; Y422-V451 HydrophobicContact CG-CB 3.97Å; Y422-V451 HydrophobicContact CG-CG1 4.09Å; Y422-V451 HydrophobicContact CG-CG2 4.17Å; Y422-I471 HydrophobicContact CD1-CD1 4.36Å; Y422-V472 WeakPolarHBondContact CA-O 3.41Å; Y422-C473 HydrophobicContact CD1-CB 4.05Å; Y422-C473 HydrophobicContact CE1-CB 4.03Å; Y422-C473 WeakPolarHBondContact CE1-SG 3.2Å
423	Y	90.1	Very high	82.5	Confident	113 Å²	113	73.1 Å²	73.1	44%	0.443	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	168.1	168.9	60.2	-92.3	0	0	0	113	V472 V474	Y423-V472 HydrophobicContact CD1-CB 4.44Å; Y423-V472 HydrophobicContact CD2-CB 3.94Å; Y423-V472 HydrophobicContact CD2-CG2 4.14Å; Y423-V472 HydrophobicContact CE1-CB 4.13Å; Y423-V472 HydrophobicContact CE1-CG1 4.08Å; Y423-V472 HydrophobicContact CE2-CB 3.59Å; Y423-V472 HydrophobicContact CE2-CG1 3.95Å; Y423-V472 HydrophobicContact CE2-CG2 3.73Å; Y423-V472 HydrophobicContact CG-CB 4.36Å; Y423-V472 PolarHBondContact N-O 3.26Å; Y423-V472 PolarHBondContact O-N 2.71Å; Y423-V474 HydrophobicContact CE1-CG2 3.67Å
424	L	91.7	Very high	82	Confident	49 Å²	49	75.8 Å²	75.8	26%	0.257	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.6	179.5	-58.7	178.8	0	0	0	111.1	I442 L444 F469 E470 I471	L424-I442 HydrophobicContact CD1-CB 3.94Å; L424-I442 HydrophobicContact CD1-CG2 3.74Å; L424-L444 HydrophobicContact CD2-CD1 3.88Å; L424-L444 HydrophobicContact CD2-CD2 4.04Å; L424-L444 HydrophobicContact CD2-CG 4.05Å; L424-L444 HydrophobicContact CG-CD1 4.08Å; L424-L444 HydrophobicContact CG-CG 4.27Å; L424-F469 HydrophobicContact CD2-CD2 3.97Å; L424-F469 HydrophobicContact CD2-CE2 3.85Å; L424-E470 CarbonylContact C-O 3.56Å; L424-E470 WeakPolarHBondContact CA-O 3.35Å; L424-I471 HydrophobicContact CD2-CB 4.44Å; L424-I471 HydrophobicContact CD2-CG1 4.48Å
425	R	88	Confident	81.7	Confident	101 Å²	101	76.4 Å²	76.4	38%	0.381	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.7	177.7	-179.8	168.5	71.6	-154	-0	110.3	E470 V472 S484	R425-E470 HydrophobicContact CB-CB 4.2Å; R425-E470 IonicContact CZ-OE2 2.89Å; R425-E470 PolarHBondContact N-O 3.28Å; R425-E470 IonicContact NE-OE2 2.72Å; R425-E470 PolarHBondContact NE-OE2 3.02Å; R425-E470 IonicContact NH2-OE2 3.19Å; R425-E470 PolarHBondContact NH2-OE2 2.81Å; R425-E470 PolarHBondContact O-N 3.49Å; R425-V472 HydrophobicContact CB-CG2 3.92Å; R425-S484 PolarHBondContact NH2-OG 3.46Å; R425-S484 VanDerWaalsContact NH2-OG 3.12Å
426	T	86.1	Confident	81.6	Confident	45 Å²	45	75.5 Å²	75.5	28%	0.276	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	136.4	173.3	46.7	0	0	0	0	110.9	V433 P435 L438	T426-V433 WeakPolarHBondContact CG2-O 3.49Å; T426-P435 HydrophobicContact CG2-CB 4.42Å; T426-P435 HydrophobicContact CG2-CG 3.92Å; T426-L438 HydrophobicContact CG2-CD1 3.64Å
427	V	82.4	Confident	81.6	Confident	33 Å²	33	74.2 Å²	74.2	20%	0.2	38%	0.38	C	S	.	.			trans	-88.7	131.4	174.5	176.9	0	0	0	0	110.1	G429 Q432 I468 E470	V427-G429 PolarHBondContact O-N 3.4Å; V427-Q432 WeakPolarHBondContact O-CG 3.34Å; V427-I468 HydrophobicContact CG2-CG2 4.26Å; V427-E470 HydrophobicContact CG2-CB 4.39Å; V427-E470 HydrophobicContact CG2-CG 3.63Å
428	N	69.8	Low	81.5	Confident	141 Å²	141	73.6 Å²	73.6	75%	0.754	38%	0.377	S	S	*	.	S	Bend	trans	-80.2	109.3	175.5	-68.7	-17.4	0	0	0	110.2
429	G	64.8	Low	81.3	Confident	40 Å²	40	81.6 Å²	81.6	41%	0.412	40%	0.4	S	S	.	.	S	Bend	trans	-179.3	-163.9	-179.8	0	0	0	0	0	113.5	V427 Q432	V427-G429 PolarHBondContact O-N 3.4Å; G429-Q432 WeakPolarHBondContact O-CG 3.43Å; G429-Q432 PolarHBondContact O-NE2 2.88Å
430	M	50.3	Low	81.1	Confident	175 Å²	175	77.3 Å²	77.3	86%	0.862	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	152.2	160.3	-62.7	-173.5	-66.8	0	0	108.6	Q432	M430-Q432 VanDerWaalsContact C-N 3.34Å
431	N	61.3	Low	81	Confident	62 Å²	62	77.1 Å²	77.1	33%	0.332	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	31.7	-176.5	-43.7	-23.3	0	0	0	114.3	H466	N431-H466 PolarHBondContact ND2-CD2 2.77Å; N431-H466 PolarHBondContact ND2-NE2 3.4Å; N431-H466 PolarHBondContact OD1-NE2 3.31Å
432	Q	68.9	Low	80.9	Confident	112 Å²	112	73.9 Å²	73.9	52%	0.523	37%	0.369	S	S	.	.			trans	-60.6	135.9	167	-92.3	171.5	80.8	0	0	111.5	V427 G429 M430 Q464	V427-Q432 WeakPolarHBondContact O-CG 3.34Å; G429-Q432 WeakPolarHBondContact O-CG 3.43Å; G429-Q432 PolarHBondContact O-NE2 2.88Å; M430-Q432 VanDerWaalsContact C-N 3.34Å; Q432-Q464 PolarHBondContact O-NE2 3.47Å
433	V	78.9	Confident	80.8	Confident	12 Å²	12	74.5 Å²	74.5	7%	0.073	37%	0.374	C	S	.	.			trans	-111.3	150	162.6	-79.9	0	0	0	0	109.5	T426 Y437 L438 Q464 F467	T426-V433 WeakPolarHBondContact CG2-O 3.49Å; V433-Y437 HydrophobicContact CB-CD1 3.77Å; V433-Y437 HydrophobicContact CB-CE1 4.49Å; V433-Y437 HydrophobicContact CB-CG 4.23Å; V433-Y437 HydrophobicContact CG1-CD1 3.55Å; V433-Y437 HydrophobicContact CG1-CE1 3.81Å; V433-Y437 HydrophobicContact CG1-CG 4.15Å; V433-Y437 HydrophobicContact CG2-CD1 4.46Å; V433-L438 HydrophobicContact CG2-CD1 4.2Å; V433-L438 HydrophobicContact CG2-CD2 3.69Å; V433-L438 HydrophobicContact CG2-CG 3.73Å; V433-Q464 HydrophobicContact CG1-CG 4.09Å; V433-F467 HydrophobicContact CB-CB 4.45Å; V433-F467 HydrophobicContact CG1-CB 3.44Å; V433-F467 VanDerWaalsContact CG1-CB 3.44Å; V433-F467 HydrophobicContact CG1-CD2 4.16Å; V433-F467 HydrophobicContact CG1-CG 3.84Å; V433-F467 HydrophobicContact CG2-CB 4.18Å; V433-F467 HydrophobicContact CG2-CD2 4.09Å; V433-F467 HydrophobicContact CG2-CG 4.49Å
434	S	81.8	Confident	80.8	Confident	61 Å²	61	71.1 Å²	71.1	43%	0.427	36%	0.363	S	S	.	.			trans	-69.5	153.9	177.8	73.1	0	0	0	0	111.2	E436 Y437 L438	S434-E436 PolarHBondContact O-N 3.42Å; S434-E436 VanDerWaalsContact O-N 3.13Å; S434-Y437 PolarHBondContact O-N 3.31Å; S434-Y437 VanDerWaalsContact O-N 3.08Å; S434-Y437 WeakPolarHBondContact OG-CB 3.03Å; S434-Y437 PolarHBondContact OG-N 2.98Å; S434-L438 PolarHBondContact O-N 3.39Å; S434-L438 VanDerWaalsContact O-N 3.11Å
435	P	83.8	Confident	80.6	Confident	91 Å²	91	71.5 Å²	71.5	59%	0.591	37%	0.365	S	S	*	.	H	α-helix	trans	-58.4	-23.9	172.7	-24.7	34.3	0	0	0	113.5	T426 R439	T426-P435 HydrophobicContact CG2-CB 4.42Å; T426-P435 HydrophobicContact CG2-CG 3.92Å; P435-R439 WeakPolarHBondContact O-CB 3.25Å; P435-R439 PolarHBondContact O-N 2.97Å
436	E	85.5	Confident	80.4	Confident	130 Å²	130	72.7 Å²	72.7	61%	0.607	39%	0.386	S	S	*	.	H	α-helix	trans	-77.9	-40.6	174.7	-173.5	166.7	-160.3	0	0	112.1	S434 L438 R439 N440	S434-E436 PolarHBondContact O-N 3.42Å; S434-E436 VanDerWaalsContact O-N 3.13Å; E436-L438 VanDerWaalsContact C-N 3.35Å; E436-L438 PolarHBondContact O-N 3.39Å; E436-R439 PolarHBondContact O-N 3.37Å; E436-N440 WeakPolarHBondContact O-CB 3.38Å; E436-N440 PolarHBondContact O-N 2.97Å; E436-N440 PolarHBondContact O-ND2 2.87Å; E436-N440 PolarHBondContact O-OD1 2.99Å
437	Y	87.6	Confident	80.2	Confident	29 Å²	29	72.7 Å²	72.7	11%	0.114	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-45.7	173	-175.1	-83.7	0	0	0	111	V433 S434 N440 H441 F467	V433-Y437 HydrophobicContact CB-CD1 3.77Å; V433-Y437 HydrophobicContact CB-CE1 4.49Å; V433-Y437 HydrophobicContact CB-CG 4.23Å; V433-Y437 HydrophobicContact CG1-CD1 3.55Å; V433-Y437 HydrophobicContact CG1-CE1 3.81Å; V433-Y437 HydrophobicContact CG1-CG 4.15Å; V433-Y437 HydrophobicContact CG2-CD1 4.46Å; S434-Y437 PolarHBondContact O-N 3.31Å; S434-Y437 VanDerWaalsContact O-N 3.08Å; S434-Y437 WeakPolarHBondContact OG-CB 3.03Å; S434-Y437 PolarHBondContact OG-N 2.98Å; Y437-N440 PolarHBondContact O-N 3.22Å; Y437-H441 AromaticContact CD1-ND1 3.71Å; Y437-H441 AromaticContact CD2-CE1 3.4Å; Y437-H441 VanDerWaalsContact CD2-CE1 3.4Å; Y437-H441 WeakPolarHBondContact CD2-CE1 3.49Å; Y437-H441 AromaticContact CD2-ND1 3.53Å; Y437-H441 AromaticContact CE1-ND1 3.76Å; Y437-H441 AromaticContact CE2-CE1 3.35Å; Y437-H441 WeakPolarHBondContact CE2-CE1 3.44Å; Y437-H441 AromaticContact CE2-ND1 3.59Å; Y437-H441 AromaticContact CG-CE1 3.94Å; Y437-H441 AromaticContact CG-ND1 3.59Å; Y437-H441 AromaticContact CZ-CE1 3.86Å; Y437-H441 AromaticContact CZ-ND1 3.7Å; Y437-H441 PolarHBondContact O-N 2.99Å; Y437-H441 VanDerWaalsContact O-N 3.08Å; Y437-H441 PolarHBondContact O-ND1 3.47Å; Y437-F467 HydrophobicContact CE1-CD1 4.25Å; Y437-F467 HydrophobicContact CE1-CD2 4.45Å; Y437-F467 HydrophobicContact CE1-CE1 4.02Å; Y437-F467 HydrophobicContact CE1-CE2 4.23Å; Y437-F467 HydrophobicContact CE1-CG 4.47Å; Y437-F467 HydrophobicContact CE1-CZ 4.01Å
438	L	87.6	Confident	79.9	Confident	5 Å²	5	78.1 Å²	78.1	3%	0.026	42%	0.421	C	S	.	.	H	α-helix	trans	-61.3	-44.5	174.4	-71.9	179.2	0	0	0	112.3	T426 V433 S434 E436 N440 I442 F467 F469	T426-L438 HydrophobicContact CG2-CD1 3.64Å; V433-L438 HydrophobicContact CG2-CD1 4.2Å; V433-L438 HydrophobicContact CG2-CD2 3.69Å; V433-L438 HydrophobicContact CG2-CG 3.73Å; S434-L438 PolarHBondContact O-N 3.39Å; S434-L438 VanDerWaalsContact O-N 3.11Å; E436-L438 VanDerWaalsContact C-N 3.35Å; E436-L438 PolarHBondContact O-N 3.39Å; L438-N440 VanDerWaalsContact C-N 3.28Å; L438-N440 PolarHBondContact O-N 3.39Å; L438-I442 HydrophobicContact CD2-CG1 4.12Å; L438-I442 WeakPolarHBondContact O-CA 3.18Å; L438-I442 WeakPolarHBondContact O-CB 3.43Å; L438-I442 PolarHBondContact O-N 2.81Å; L438-F467 HydrophobicContact CD2-CD2 4.39Å; L438-F467 HydrophobicContact CD2-CE2 4.32Å; L438-F469 HydrophobicContact CD1-CB 3.67Å; L438-F469 HydrophobicContact CD1-CG 4.27Å; L438-F469 HydrophobicContact CD2-CB 3.84Å; L438-F469 HydrophobicContact CD2-CD1 3.64Å; L438-F469 HydrophobicContact CD2-CD2 4.25Å; L438-F469 HydrophobicContact CD2-CE1 4.22Å; L438-F469 HydrophobicContact CD2-CG 3.65Å; L438-F469 HydrophobicContact CG-CB 4.42Å
439	R	85.9	Confident	80.1	Confident	199 Å²	199	78 Å²	78	75%	0.751	42%	0.415	S	S	*	.	H	α-helix	trans	-61.8	-34.1	179.3	-179.3	-175.5	-63.6	-96.5	-0.6	113.1	P435 E436	P435-R439 WeakPolarHBondContact O-CB 3.25Å; P435-R439 PolarHBondContact O-N 2.97Å; E436-R439 PolarHBondContact O-N 3.37Å
440	N	85.5	Confident	80.9	Confident	57 Å²	57	76.6 Å²	76.6	31%	0.305	40%	0.402	S	S	.	.	H	α-helix	trans	-83.8	-38.4	-175.9	-66.5	-10.9	0	0	0	112.1	E436 Y437 L438 S456 Q457	E436-N440 WeakPolarHBondContact O-CB 3.38Å; E436-N440 PolarHBondContact O-N 2.97Å; E436-N440 PolarHBondContact O-ND2 2.87Å; E436-N440 PolarHBondContact O-OD1 2.99Å; Y437-N440 PolarHBondContact O-N 3.22Å; L438-N440 VanDerWaalsContact C-N 3.28Å; L438-N440 PolarHBondContact O-N 3.39Å; N440-S456 PolarHBondContact O-OG 3.43Å; N440-Q457 WeakPolarHBondContact O-CG 3.41Å
441	H	88	Confident	82.8	Confident	30 Å²	30	68.4 Å²	68.4	14%	0.139	36%	0.361	C	S	.	.	H	α-helix	trans	-97.8	-27.5	-174.7	-56.9	94.6	0	0	0	114.7	Y437 I455 S456 P458 L459	Y437-H441 AromaticContact CD1-ND1 3.71Å; Y437-H441 AromaticContact CD2-CE1 3.4Å; Y437-H441 VanDerWaalsContact CD2-CE1 3.4Å; Y437-H441 WeakPolarHBondContact CD2-CE1 3.49Å; Y437-H441 AromaticContact CD2-ND1 3.53Å; Y437-H441 AromaticContact CE1-ND1 3.76Å; Y437-H441 AromaticContact CE2-CE1 3.35Å; Y437-H441 WeakPolarHBondContact CE2-CE1 3.44Å; Y437-H441 AromaticContact CE2-ND1 3.59Å; Y437-H441 AromaticContact CG-CE1 3.94Å; Y437-H441 AromaticContact CG-ND1 3.59Å; Y437-H441 AromaticContact CZ-CE1 3.86Å; Y437-H441 AromaticContact CZ-ND1 3.7Å; Y437-H441 PolarHBondContact O-N 2.99Å; Y437-H441 VanDerWaalsContact O-N 3.08Å; Y437-H441 PolarHBondContact O-ND1 3.47Å; H441-I455 CarbonylContact O-C 3.59Å; H441-I455 VanDerWaalsContact O-CA 3.26Å; H441-I455 WeakPolarHBondContact O-CA 3.26Å; H441-S456 PolarHBondContact O-N 2.59Å; H441-S456 PolarHBondContact O-OG 3.01Å; H441-P458 PolarHBondContact CD2-O 2.83Å; H441-L459 HydrophobicContact CB-CD2 3.78Å
442	I	89.6	Confident	84.1	Confident	8 Å²	8	66 Å²	66	4%	0.041	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.5	-174.4	-49.8	-60.8	0	0	0	111.2	L424 L438 L453 I455 F467 F469 I489	L424-I442 HydrophobicContact CD1-CB 3.94Å; L424-I442 HydrophobicContact CD1-CG2 3.74Å; L438-I442 HydrophobicContact CD2-CG1 4.12Å; L438-I442 WeakPolarHBondContact O-CA 3.18Å; L438-I442 WeakPolarHBondContact O-CB 3.43Å; L438-I442 PolarHBondContact O-N 2.81Å; I442-L453 HydrophobicContact CG2-CD1 4.01Å; I442-L453 HydrophobicContact CG2-CD2 4.08Å; I442-L453 HydrophobicContact CG2-CG 3.9Å; I442-I455 HydrophobicContact CD1-CG1 4.46Å; I442-F467 HydrophobicContact CD1-CE2 4.22Å; I442-F467 HydrophobicContact CD1-CZ 4.29Å; I442-F467 HydrophobicContact CG1-CE2 4.42Å; I442-F469 HydrophobicContact CD1-CZ 4.33Å; I442-F469 HydrophobicContact CG1-CE1 4.38Å; I442-F469 HydrophobicContact CG1-CZ 4.15Å; I442-F469 HydrophobicContact CG2-CE2 4.19Å; I442-F469 HydrophobicContact CG2-CZ 4.11Å; I442-I489 HydrophobicContact CD1-CD1 3.82Å
443	Q	89.3	Confident	85.2	Confident	71 Å²	71	60.6 Å²	60.6	33%	0.332	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.1	173	-179.2	174	41.6	0	0	110.5	L445 R454	Q443-L445 HydrophobicContact CG-CD2 3.96Å; Q443-L445 HydrophobicContact CG-CG 4.31Å; Q443-R454 HydrophobicContact CB-CB 4.44Å; Q443-R454 PolarHBondContact N-O 2.73Å; Q443-R454 PolarHBondContact O-N 2.88Å
444	L	90.7	Very high	85.7	Confident	42 Å²	42	63.7 Å²	63.7	22%	0.22	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	133.5	164.4	-63	-178	0	0	0	109.6	L424 V451 L453 I471	L424-L444 HydrophobicContact CD2-CD1 3.88Å; L424-L444 HydrophobicContact CD2-CD2 4.04Å; L424-L444 HydrophobicContact CD2-CG 4.05Å; L424-L444 HydrophobicContact CG-CD1 4.08Å; L424-L444 HydrophobicContact CG-CG 4.27Å; L444-V451 HydrophobicContact CB-CG2 3.82Å; L444-V451 HydrophobicContact CD1-CG2 4.41Å; L444-V451 HydrophobicContact CD2-CG2 3.96Å; L444-V451 HydrophobicContact CG-CG2 4.28Å; L444-L453 HydrophobicContact CD2-CB 4.47Å; L444-L453 HydrophobicContact CD2-CD1 4.43Å; L444-L453 HydrophobicContact CD2-CG 4.42Å; L444-I471 HydrophobicContact CD1-CD1 4.03Å; L444-I471 HydrophobicContact CD1-CG1 4.33Å; L444-I471 HydrophobicContact CD2-CD1 3.76Å
445	L	86.8	Confident	86	Confident	57 Å²	57	60.8 Å²	60.8	30%	0.298	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.2	174	-65.8	-177.5	0	0	0	110.3	Q443 V451 S452 R454	Q443-L445 HydrophobicContact CG-CD2 3.96Å; Q443-L445 HydrophobicContact CG-CG 4.31Å; L445-V451 WeakPolarHBondContact O-CG2 3.45Å; L445-S452 PolarHBondContact N-O 2.72Å; L445-S452 PolarHBondContact O-N 2.95Å; L445-R454 HydrophobicContact CD1-CB 4.33Å; L445-R454 VanDerWaalsContact CD1-CD 3.49Å
446	P	83.6	Confident	86.2	Confident	126 Å²	126	58.7 Å²	58.7	82%	0.818	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	139.6	171.2	-22.7	33.9	0	0	0	111.9
447	S	81.9	Confident	86.2	Confident	46 Å²	46	57 Å²	57	32%	0.322	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	164.9	171	-169.7	0	0	0	0	109.9	E449 G450	S447-E449 PolarHBondContact O-N 2.97Å; S447-G450 WeakPolarHBondContact CB-O 3.25Å; S447-G450 PolarHBondContact N-O 3.23Å
448	V	76.8	Confident	86.1	Confident	146 Å²	146	58.9 Å²	58.9	89%	0.885	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-35.5	179.7	-179.8	0	0	0	0	111.6
449	E	73.4	Confident	86.2	Confident	138 Å²	138	59 Å²	59	65%	0.645	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	29.1	-173.8	-55.3	177.9	160.4	0	0	111.6	H408 S447	H408-E449 WeakPolarHBondContact CA-O 3.29Å; H408-E449 PolarHBondContact ND1-O 2.93Å; S447-E449 PolarHBondContact O-N 2.97Å
450	G	82.3	Confident	86.3	Confident	12 Å²	12	51.8 Å²	51.8	12%	0.124	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	141.8	-124.1	179.6	0	0	0	0	0	113.5	Y422 S447	Y422-G450 WeakPolarHBondContact OH-CA 3.24Å; S447-G450 WeakPolarHBondContact CB-O 3.25Å; S447-G450 PolarHBondContact N-O 3.23Å
451	V	89.2	Confident	86.5	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	137.6	-173.1	66.7	0	0	0	0	112.1	I407 Y422 L444 L445 I471	I407-V451 HydrophobicContact CB-CG1 3.97Å; I407-V451 PolarHBondContact N-O 2.97Å; I407-V451 PolarHBondContact O-N 3.48Å; I407-V451 VanDerWaalsContact O-N 3.11Å; Y422-V451 HydrophobicContact CD1-CB 4.01Å; Y422-V451 HydrophobicContact CD1-CG1 3.66Å; Y422-V451 HydrophobicContact CD2-CB 3.98Å; Y422-V451 HydrophobicContact CD2-CG2 4.28Å; Y422-V451 HydrophobicContact CE1-CB 4.04Å; Y422-V451 HydrophobicContact CE1-CG1 3.69Å; Y422-V451 HydrophobicContact CE2-CB 4.04Å; Y422-V451 HydrophobicContact CG-CB 3.97Å; Y422-V451 HydrophobicContact CG-CG1 4.09Å; Y422-V451 HydrophobicContact CG-CG2 4.17Å; L444-V451 HydrophobicContact CB-CG2 3.82Å; L444-V451 HydrophobicContact CD1-CG2 4.41Å; L444-V451 HydrophobicContact CD2-CG2 3.96Å; L444-V451 HydrophobicContact CG-CG2 4.28Å; L445-V451 WeakPolarHBondContact O-CG2 3.45Å; V451-I471 HydrophobicContact CG1-CD1 3.58Å
452	S	90.1	Very high	86.4	Confident	10 Å²	10	54.9 Å²	54.9	7%	0.07	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.6	175.3	-166	0	0	0	0	110.1	P403 L405 N406 L445	P403-S452 VanDerWaalsContact CB-OG 3.26Å; P403-S452 WeakPolarHBondContact CB-OG 3.42Å; L405-S452 WeakPolarHBondContact O-CA 3.02Å; N406-S452 VanDerWaalsContact OD1-CB 3.25Å; N406-S452 WeakPolarHBondContact OD1-CB 3.25Å; N406-S452 PolarHBondContact OD1-OG 2.88Å; L445-S452 PolarHBondContact N-O 2.72Å; L445-S452 PolarHBondContact O-N 2.95Å
453	L	90.6	Very high	86.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.6	177.8	-169.6	150.6	0	0	0	110.1	P403 L404 L405 I442 L444 F469 I487	P403-L453 CarbonylContact C-O 3.59Å; L404-L453 HydrophobicContact CD1-CD2 4Å; L404-L453 PolarHBondContact N-O 3.42Å; L405-L453 PolarHBondContact O-N 3.25Å; I442-L453 HydrophobicContact CG2-CD1 4.01Å; I442-L453 HydrophobicContact CG2-CD2 4.08Å; I442-L453 HydrophobicContact CG2-CG 3.9Å; L444-L453 HydrophobicContact CD2-CB 4.47Å; L444-L453 HydrophobicContact CD2-CD1 4.43Å; L444-L453 HydrophobicContact CD2-CG 4.42Å; L453-F469 HydrophobicContact CD1-CE2 3.92Å; L453-F469 HydrophobicContact CD1-CZ 3.84Å; L453-I487 HydrophobicContact CD1-CD1 3.46Å; L453-I487 VanDerWaalsContact CD1-CD1 3.46Å; L453-I487 HydrophobicContact CD1-CG2 4.37Å
454	R	90.1	Very high	86.1	Confident	77 Å²	77	58.9 Å²	58.9	29%	0.291	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.8	-174.6	175.1	175.3	-170.1	-117	3.6	110.7	G401 Q443 L445	G401-R454 VanDerWaalsContact C-NE 3.34Å; G401-R454 VanDerWaalsContact O-CZ 3.27Å; G401-R454 PolarHBondContact O-NE 2.79Å; G401-R454 PolarHBondContact O-NH2 3.44Å; Q443-R454 HydrophobicContact CB-CB 4.44Å; Q443-R454 PolarHBondContact N-O 2.73Å; Q443-R454 PolarHBondContact O-N 2.88Å; L445-R454 HydrophobicContact CD1-CB 4.33Å; L445-R454 VanDerWaalsContact CD1-CD 3.49Å
455	I	88.8	Confident	85.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	125.2	167.1	-71.5	173.9	0	0	0	109.3	V395 K399 A400 G401 L404 H441 I442 Q457 L459	V395-I455 HydrophobicContact CB-CD1 4.39Å; V395-I455 HydrophobicContact CG1-CD1 3.73Å; K399-I455 WeakPolarHBondContact O-CG2 3.44Å; A400-I455 HydrophobicContact CB-CG2 4.42Å; G401-I455 WeakPolarHBondContact CA-O 3.46Å; G401-I455 PolarHBondContact N-O 2.96Å; L404-I455 HydrophobicContact CD1-CD1 3.72Å; L404-I455 HydrophobicContact CD1-CG1 3.73Å; L404-I455 HydrophobicContact CD2-CD1 4.47Å; L404-I455 HydrophobicContact CG-CD1 4.47Å; L404-I455 HydrophobicContact CG-CG1 4.42Å; H441-I455 CarbonylContact O-C 3.59Å; H441-I455 VanDerWaalsContact O-CA 3.26Å; H441-I455 WeakPolarHBondContact O-CA 3.26Å; I442-I455 HydrophobicContact CD1-CG1 4.46Å; I455-Q457 WeakPolarHBondContact CG2-O 3.23Å; I455-L459 HydrophobicContact CD1-CD1 3.64Å; I455-L459 HydrophobicContact CD1-CG 3.99Å
456	S	86	Confident	86	Confident	46 Å²	46	59 Å²	59	32%	0.322	32%	0.32	S	S	.	.	S	Bend	trans	-93.3	-29.3	179.9	40.4	0	0	0	0	114.3	N440 H441	N440-S456 PolarHBondContact O-OG 3.43Å; H441-S456 PolarHBondContact O-N 2.59Å; H441-S456 PolarHBondContact O-OG 3.01Å
457	Q	85.8	Confident	86.3	Confident	94 Å²	94	53.1 Å²	53.1	44%	0.439	28%	0.281	S	S	.	.	S	Bend	trans	-135.1	142.5	175.9	-67	178.8	15.9	0	0	107.6	N440 I455	N440-Q457 WeakPolarHBondContact O-CG 3.41Å; I455-Q457 WeakPolarHBondContact CG2-O 3.23Å
458	P	85.5	Confident	86.8	Confident	69 Å²	69	52.9 Å²	52.9	45%	0.448	28%	0.276	S	S	.	.			trans	-55.6	148.9	-178.8	26.4	-35	0	0	0	110.8	A400 H441	A400-P458 HydrophobicContact CB-CB 4.3Å; H441-P458 PolarHBondContact CD2-O 2.83Å
459	L	89.5	Confident	87.5	Confident	9 Å²	9	45.9 Å²	45.9	5%	0.047	23%	0.233	C	C	.	.			trans	-83.6	179.4	173.4	-55.6	175.7	0	0	0	109.4	E397 H441 I455 F467 I489 V491	E397-L459 HydrophobicContact CB-CB 4.23Å; E397-L459 WeakPolarHBondContact CB-O 3.27Å; E397-L459 PolarHBondContact O-N 3.34Å; H441-L459 HydrophobicContact CB-CD2 3.78Å; I455-L459 HydrophobicContact CD1-CD1 3.64Å; I455-L459 HydrophobicContact CD1-CG 3.99Å; L459-F467 HydrophobicContact CD1-CE1 4.09Å; L459-F467 HydrophobicContact CD1-CZ 4.17Å; L459-F467 HydrophobicContact CD2-CE1 4.14Å; L459-F467 HydrophobicContact CD2-CZ 3.97Å; L459-I489 HydrophobicContact CD1-CG2 4.13Å; L459-V491 HydrophobicContact CB-CG1 4.32Å; L459-V491 HydrophobicContact CB-CG2 4.29Å; L459-V491 HydrophobicContact CD1-CG2 3.92Å
460	D	89.1	Confident	88.3	Confident	47 Å²	47	40.7 Å²	40.7	25%	0.251	21%	0.209	S	C	.	.			trans	-149.1	113.4	-175.2	171.6	-21.8	0	0	0	106.2	E462 L463 Q464	D460-E462 PolarHBondContact OD1-N 3.1Å; D460-L463 HydrophobicContact CB-CB 4Å; D460-L463 WeakPolarHBondContact OD1-CB 3.21Å; D460-L463 PolarHBondContact OD1-N 2.79Å; D460-L463 WeakPolarHBondContact OD2-CB 3.41Å; D460-Q464 CarbonylContact O-C 3.55Å; D460-Q464 PolarHBondContact O-N 2.83Å
461	Y	89.6	Confident	88.8	Confident	86 Å²	86	40.1 Å²	40.1	34%	0.337	20%	0.203	S	C	.	.	H	α-helix	trans	-75.4	-40.7	-174.6	174.4	-89.2	0	0	0	111.4	E397 L463 Q464 S465 V491 N493	E397-Y461 WeakPolarHBondContact OE2-CB 3.38Å; E397-Y461 PolarHBondContact OE2-N 2.79Å; Y461-L463 VanDerWaalsContact C-N 3.25Å; Y461-L463 PolarHBondContact O-N 2.7Å; Y461-Q464 CarbonylContact O-C 3.58Å; Y461-Q464 PolarHBondContact O-N 2.82Å; Y461-S465 VanDerWaalsContact CE2-CB 3.44Å; Y461-S465 WeakPolarHBondContact O-CA 3.13Å; Y461-S465 PolarHBondContact O-N 3.3Å; Y461-V491 HydrophobicContact CD2-CB 4.09Å; Y461-V491 HydrophobicContact CD2-CG1 4.27Å; Y461-V491 VanDerWaalsContact CD2-O 3.31Å; Y461-V491 WeakPolarHBondContact CD2-O 3.37Å; Y461-N493 HydrophobicContact CD1-CB 3.77Å; Y461-N493 VanDerWaalsContact CD1-ND2 3.3Å; Y461-N493 WeakPolarHBondContact CD1-ND2 3.09Å; Y461-N493 HydrophobicContact CD2-CB 3.86Å; Y461-N493 HydrophobicContact CE1-CB 3.81Å; Y461-N493 WeakPolarHBondContact CE1-ND2 3.32Å; Y461-N493 HydrophobicContact CE2-CB 3.92Å; Y461-N493 HydrophobicContact CG-CB 3.79Å
462	E	86.8	Confident	89	Confident	65 Å²	65	40.1 Å²	40.1	30%	0.304	20%	0.203	S	C	.	.	H	α-helix	trans	-58.4	-36.8	175.8	-82.7	48.5	-121.6	0	0	111.9	D460 L542	D460-E462 PolarHBondContact OD1-N 3.1Å; E462-L542 HydrophobicContact CG-CB 3.68Å; E462-L542 HydrophobicContact CG-CD1 4.17Å; E462-L542 HydrophobicContact CG-CG 4.46Å
463	L	85.7	Confident	89.1	Confident	119 Å²	119	39.7 Å²	39.7	62%	0.623	20%	0.2	S	C	*	.	H	α-helix	trans	-82.5	-45.4	174.7	-176.6	64.7	0	0	0	112.7	D460 Y461	D460-L463 HydrophobicContact CB-CB 4Å; D460-L463 WeakPolarHBondContact OD1-CB 3.21Å; D460-L463 PolarHBondContact OD1-N 2.79Å; D460-L463 WeakPolarHBondContact OD2-CB 3.41Å; Y461-L463 VanDerWaalsContact C-N 3.25Å; Y461-L463 PolarHBondContact O-N 2.7Å
464	Q	85.3	Confident	89.2	Confident	44 Å²	44	41.1 Å²	41.1	21%	0.206	21%	0.209	C	C	.	.	H	α-helix	trans	-154.3	71.6	-176	-168.4	73.3	-57.8	0	0	113.8	Q432 V433 D460 Y461 H466 F467 V491	Q432-Q464 PolarHBondContact O-NE2 3.47Å; V433-Q464 HydrophobicContact CG1-CG 4.09Å; D460-Q464 CarbonylContact O-C 3.55Å; D460-Q464 PolarHBondContact O-N 2.83Å; Y461-Q464 CarbonylContact O-C 3.58Å; Y461-Q464 PolarHBondContact O-N 2.82Å; Q464-H466 PolarHBondContact O-N 3.41Å; Q464-F467 HydrophobicContact CG-CB 4.1Å; Q464-F467 HydrophobicContact CG-CD1 3.94Å; Q464-F467 HydrophobicContact CG-CG 4.42Å; Q464-V491 WeakPolarHBondContact O-CG2 3.33Å
465	S	87.9	Confident	89.4	Confident	37 Å²	37	37.7 Å²	37.7	26%	0.259	20%	0.196	S	C	.	.	S	Bend	trans	-44.4	-26.2	172.2	56.8	0	0	0	0	116.9	Y461 V491	Y461-S465 VanDerWaalsContact CE2-CB 3.44Å; Y461-S465 WeakPolarHBondContact O-CA 3.13Å; Y461-S465 PolarHBondContact O-N 3.3Å; S465-V491 WeakPolarHBondContact O-CB 3.3Å; S465-V491 PolarHBondContact O-N 3.11Å
466	H	89.1	Confident	89.5	Confident	66 Å²	66	40.5 Å²	40.5	31%	0.306	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	144.6	176.9	60.2	-58.9	0	0	0	112.8	N431 Q464 I489	N431-H466 PolarHBondContact ND2-CD2 2.77Å; N431-H466 PolarHBondContact ND2-NE2 3.4Å; N431-H466 PolarHBondContact OD1-NE2 3.31Å; Q464-H466 PolarHBondContact O-N 3.41Å; H466-I489 VanDerWaalsContact CA-O 3.3Å; H466-I489 WeakPolarHBondContact CA-O 3.14Å
467	F	89.9	Confident	89.6	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	156.4	178.2	57.4	-84.3	0	0	0	113.4	V433 Y437 L438 I442 L459 Q464 F469 I489 V491	V433-F467 HydrophobicContact CB-CB 4.45Å; V433-F467 HydrophobicContact CG1-CB 3.44Å; V433-F467 VanDerWaalsContact CG1-CB 3.44Å; V433-F467 HydrophobicContact CG1-CD2 4.16Å; V433-F467 HydrophobicContact CG1-CG 3.84Å; V433-F467 HydrophobicContact CG2-CB 4.18Å; V433-F467 HydrophobicContact CG2-CD2 4.09Å; V433-F467 HydrophobicContact CG2-CG 4.49Å; Y437-F467 HydrophobicContact CE1-CD1 4.25Å; Y437-F467 HydrophobicContact CE1-CD2 4.45Å; Y437-F467 HydrophobicContact CE1-CE1 4.02Å; Y437-F467 HydrophobicContact CE1-CE2 4.23Å; Y437-F467 HydrophobicContact CE1-CG 4.47Å; Y437-F467 HydrophobicContact CE1-CZ 4.01Å; L438-F467 HydrophobicContact CD2-CD2 4.39Å; L438-F467 HydrophobicContact CD2-CE2 4.32Å; I442-F467 HydrophobicContact CD1-CE2 4.22Å; I442-F467 HydrophobicContact CD1-CZ 4.29Å; I442-F467 HydrophobicContact CG1-CE2 4.42Å; L459-F467 HydrophobicContact CD1-CE1 4.09Å; L459-F467 HydrophobicContact CD1-CZ 4.17Å; L459-F467 HydrophobicContact CD2-CE1 4.14Å; L459-F467 HydrophobicContact CD2-CZ 3.97Å; Q464-F467 HydrophobicContact CG-CB 4.1Å; Q464-F467 HydrophobicContact CG-CD1 3.94Å; Q464-F467 HydrophobicContact CG-CG 4.42Å; F467-F469 AromaticContact CD2-CD1 3.88Å; F467-F469 HydrophobicContact CD2-CD1 3.88Å; F467-F469 HydrophobicContact CD2-CE1 4.04Å; F467-F469 HydrophobicContact CE2-CD1 4.02Å; F467-F469 AromaticContact CE2-CE1 3.73Å; F467-F469 HydrophobicContact CE2-CE1 3.73Å; F467-I489 HydrophobicContact CD1-CB 4.48Å; F467-I489 HydrophobicContact CE1-CB 4.1Å; F467-I489 HydrophobicContact CE1-CG2 3.96Å; F467-I489 HydrophobicContact CE2-CB 4.19Å; F467-I489 HydrophobicContact CE2-CD1 3.92Å; F467-I489 HydrophobicContact CE2-CG1 4.38Å; F467-I489 HydrophobicContact CZ-CB 3.95Å; F467-I489 HydrophobicContact CZ-CD1 3.83Å; F467-I489 HydrophobicContact CZ-CG1 4.38Å; F467-I489 HydrophobicContact CZ-CG2 4.02Å; F467-I489 PolarHBondContact N-O 3.44Å; F467-I489 PolarHBondContact O-N 3.27Å; F467-V491 HydrophobicContact CE1-CG2 4.18Å
468	I	90.7	Very high	89.5	Confident	41 Å²	41	42.2 Å²	42.2	21%	0.21	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.8	-176.6	-54.2	176.2	0	0	0	110.2	V427 I487 K488	V427-I468 HydrophobicContact CG2-CG2 4.26Å; I468-I487 WeakPolarHBondContact CA-O 3.11Å; I468-K488 HydrophobicContact CD1-CG 4.48Å; I468-K488 HydrophobicContact CG1-CB 4.26Å; I468-K488 HydrophobicContact CG1-CG 4.1Å
469	F	91.2	Very high	89.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	168.4	173.5	59.3	-80.9	0	0	0	110.5	L424 L438 I442 L453 F467 I487 I489	L424-F469 HydrophobicContact CD2-CD2 3.97Å; L424-F469 HydrophobicContact CD2-CE2 3.85Å; L438-F469 HydrophobicContact CD1-CB 3.67Å; L438-F469 HydrophobicContact CD1-CG 4.27Å; L438-F469 HydrophobicContact CD2-CB 3.84Å; L438-F469 HydrophobicContact CD2-CD1 3.64Å; L438-F469 HydrophobicContact CD2-CD2 4.25Å; L438-F469 HydrophobicContact CD2-CE1 4.22Å; L438-F469 HydrophobicContact CD2-CG 3.65Å; L438-F469 HydrophobicContact CG-CB 4.42Å; I442-F469 HydrophobicContact CD1-CZ 4.33Å; I442-F469 HydrophobicContact CG1-CE1 4.38Å; I442-F469 HydrophobicContact CG1-CZ 4.15Å; I442-F469 HydrophobicContact CG2-CE2 4.19Å; I442-F469 HydrophobicContact CG2-CZ 4.11Å; L453-F469 HydrophobicContact CD1-CE2 3.92Å; L453-F469 HydrophobicContact CD1-CZ 3.84Å; F467-F469 AromaticContact CD2-CD1 3.88Å; F467-F469 HydrophobicContact CD2-CD1 3.88Å; F467-F469 HydrophobicContact CD2-CE1 4.04Å; F467-F469 HydrophobicContact CE2-CD1 4.02Å; F467-F469 AromaticContact CE2-CE1 3.73Å; F467-F469 HydrophobicContact CE2-CE1 3.73Å; F469-I487 HydrophobicContact CD2-CB 4.29Å; F469-I487 HydrophobicContact CE1-CB 4.12Å; F469-I487 HydrophobicContact CE1-CG2 3.99Å; F469-I487 HydrophobicContact CE2-CB 3.89Å; F469-I487 HydrophobicContact CE2-CD1 3.89Å; F469-I487 HydrophobicContact CE2-CG1 4.31Å; F469-I487 HydrophobicContact CE2-CG2 4.19Å; F469-I487 HydrophobicContact CZ-CB 3.8Å; F469-I487 HydrophobicContact CZ-CD1 4.31Å; F469-I487 HydrophobicContact CZ-CG2 3.64Å; F469-I487 PolarHBondContact N-O 3.31Å; F469-I487 PolarHBondContact O-N 3.18Å; F469-I489 HydrophobicContact CE1-CD1 3.82Å; F469-I489 HydrophobicContact CE1-CG1 4.09Å; F469-I489 HydrophobicContact CZ-CD1 4.12Å
470	E	91.5	Very high	89.8	Confident	29 Å²	29	46.9 Å²	46.9	14%	0.136	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.2	175	-78.9	166	173.5	0	0	110.2	L424 R425 V427 A485 Q486	L424-E470 CarbonylContact C-O 3.56Å; L424-E470 WeakPolarHBondContact CA-O 3.35Å; R425-E470 HydrophobicContact CB-CB 4.2Å; R425-E470 IonicContact CZ-OE2 2.89Å; R425-E470 PolarHBondContact N-O 3.28Å; R425-E470 IonicContact NE-OE2 2.72Å; R425-E470 PolarHBondContact NE-OE2 3.02Å; R425-E470 IonicContact NH2-OE2 3.19Å; R425-E470 PolarHBondContact NH2-OE2 2.81Å; R425-E470 PolarHBondContact O-N 3.49Å; V427-E470 HydrophobicContact CG2-CB 4.39Å; V427-E470 HydrophobicContact CG2-CG 3.63Å; E470-A485 WeakPolarHBondContact CA-O 3.46Å; E470-Q486 HydrophobicContact CG-CG 3.53Å; E470-Q486 PolarHBondContact OE1-NE2 3.45Å
471	I	92.3	Very high	90	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.3	157.6	-171.4	167.3	0	0	0	107.9	F386 I407 Y422 L424 L444 V451 S484 A485 I487	F386-I471 HydrophobicContact CD1-CG2 4.44Å; F386-I471 HydrophobicContact CE1-CG2 3.54Å; F386-I471 HydrophobicContact CZ-CG2 3.99Å; I407-I471 HydrophobicContact CD1-CD1 4.01Å; I407-I471 HydrophobicContact CD1-CG2 4.23Å; Y422-I471 HydrophobicContact CD1-CD1 4.36Å; L424-I471 HydrophobicContact CD2-CB 4.44Å; L424-I471 HydrophobicContact CD2-CG1 4.48Å; L444-I471 HydrophobicContact CD1-CD1 4.03Å; L444-I471 HydrophobicContact CD1-CG1 4.33Å; L444-I471 HydrophobicContact CD2-CD1 3.76Å; V451-I471 HydrophobicContact CG1-CD1 3.58Å; I471-S484 CarbonylContact O-C 3.58Å; I471-S484 WeakPolarHBondContact O-CA 3.36Å; I471-S484 VanDerWaalsContact O-CB 3.3Å; I471-S484 WeakPolarHBondContact O-CB 3.33Å; I471-A485 HydrophobicContact CG2-CB 4.19Å; I471-A485 PolarHBondContact N-O 3.22Å; I471-A485 PolarHBondContact O-N 2.98Å; I471-I487 HydrophobicContact CB-CD1 4Å; I471-I487 HydrophobicContact CG2-CD1 3.78Å; I471-I487 HydrophobicContact CG2-CG1 4.19Å
472	V	92.7	Very high	90.2	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.1	178.5	-167.9	0	0	0	0	108.3	Y422 Y423 R425 V474 A483	Y422-V472 WeakPolarHBondContact CA-O 3.41Å; Y423-V472 HydrophobicContact CD1-CB 4.44Å; Y423-V472 HydrophobicContact CD2-CB 3.94Å; Y423-V472 HydrophobicContact CD2-CG2 4.14Å; Y423-V472 HydrophobicContact CE1-CB 4.13Å; Y423-V472 HydrophobicContact CE1-CG1 4.08Å; Y423-V472 HydrophobicContact CE2-CB 3.59Å; Y423-V472 HydrophobicContact CE2-CG1 3.95Å; Y423-V472 HydrophobicContact CE2-CG2 3.73Å; Y423-V472 HydrophobicContact CG-CB 4.36Å; Y423-V472 PolarHBondContact N-O 3.26Å; Y423-V472 PolarHBondContact O-N 2.71Å; R425-V472 HydrophobicContact CB-CG2 3.92Å; V472-V474 HydrophobicContact CG1-CG2 4.48Å; V472-A483 WeakPolarHBondContact CA-O 3.44Å; V472-A483 WeakPolarHBondContact CG1-O 3.08Å
473	C	92.4	Very high	90.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.8	176.3	-169.3	0	0	0	0	109.4	P384 F386 V409 N421 Y422 S482 A483	P384-C473 HydrophobicContact CB-CB 4.33Å; F386-C473 HydrophobicContact CE2-CB 3.71Å; F386-C473 HydrophobicContact CZ-CB 3.62Å; V409-C473 HydrophobicContact CG1-CB 4.34Å; N421-C473 WeakPolarHBondContact O-CA 3.44Å; Y422-C473 HydrophobicContact CD1-CB 4.05Å; Y422-C473 HydrophobicContact CE1-CB 4.03Å; Y422-C473 WeakPolarHBondContact CE1-SG 3.2Å; C473-S482 CarbonylContact O-C 3.55Å; C473-S482 WeakPolarHBondContact O-CA 3.27Å; C473-S482 VanDerWaalsContact O-CB 3.25Å; C473-S482 WeakPolarHBondContact O-CB 3.15Å; C473-A483 PolarHBondContact N-O 2.68Å; C473-A483 PolarHBondContact O-N 2.88Å
474	V	93.6	Very high	90.9	Very high	31 Å²	31	41.5 Å²	41.5	19%	0.188	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	141.1	178.5	-170.5	0	0	0	0	107.9	L420 N421 Y423 V472 P480 L481	L420-V474 CarbonylContact C-O 3.52Å; N421-V474 PolarHBondContact N-O 2.56Å; N421-V474 PolarHBondContact O-N 3Å; Y423-V474 HydrophobicContact CE1-CG2 3.67Å; V472-V474 HydrophobicContact CG1-CG2 4.48Å; V474-P480 HydrophobicContact CG1-CB 4.23Å; V474-L481 WeakPolarHBondContact CA-O 3.21Å; V474-L481 WeakPolarHBondContact CG1-O 3.45Å
475	D	93.5	Very high	91.2	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	23%	0.227	C	C	.	.			trans	-73	-163.3	174	58.4	37.2	0	0	0	113.6	N380 P384 N417 R419 N421 G477 P480 L481	N380-D475 PolarHBondContact ND2-OD2 2.96Å; P384-D475 HydrophobicContact CG-CB 4.47Å; N417-D475 WeakPolarHBondContact O-CB 3.13Å; R419-D475 CarbonylContact O-C 3.59Å; N421-D475 PolarHBondContact ND2-O 3Å; D475-G477 WeakPolarHBondContact OD1-CA 3.24Å; D475-G477 PolarHBondContact OD1-N 3.14Å; D475-P480 WeakPolarHBondContact OD1-CA 3.31Å; D475-P480 WeakPolarHBondContact OD1-CB 3.22Å; D475-L481 VanDerWaalsContact CG-N 3.31Å; D475-L481 PolarHBondContact N-O 2.83Å; D475-L481 PolarHBondContact OD1-N 3.46Å; D475-L481 WeakPolarHBondContact OD2-CA 3.42Å; D475-L481 VanDerWaalsContact OD2-CB 3.27Å; D475-L481 WeakPolarHBondContact OD2-CB 3.44Å; D475-L481 PolarHBondContact OD2-N 3.35Å
476	Q	91.6	Very high	91.4	Very high	59 Å²	59	41.1 Å²	41.1	28%	0.276	23%	0.231	S	C	.	.	S	Bend	trans	-119.7	27.4	162.7	-67	166.5	43	0	0	111.3	S416 R419 N421 H478	S416-Q476 CarbonylContact O-C 3.58Å; S416-Q476 WeakPolarHBondContact O-CA 3.23Å; S416-Q476 WeakPolarHBondContact O-CB 3.34Å; S416-Q476 PolarHBondContact O-N 3.5Å; R419-Q476 HydrophobicContact CB-CB 4.29Å; R419-Q476 HydrophobicContact CB-CG 4.39Å; R419-Q476 WeakPolarHBondContact O-CG 3.46Å; R419-Q476 PolarHBondContact O-N 2.79Å; R419-Q476 PolarHBondContact O-NE2 2.79Å; N421-Q476 WeakPolarHBondContact ND2-CG 3.23Å; N421-Q476 PolarHBondContact ND2-NE2 3.1Å; N421-Q476 PolarHBondContact OD1-NE2 2.96Å; Q476-H478 PolarHBondContact O-ND1 3.03Å
477	G	87.2	Confident	91.5	Very high	2 Å²	2	38 Å²	38	2%	0.021	22%	0.217	C	C	.	.			trans	-68	167.3	-179.9	0	0	0	0	0	115.1	N380 D475 P479 P480	N380-G477 WeakPolarHBondContact OD1-CA 3.48Å; D475-G477 WeakPolarHBondContact OD1-CA 3.24Å; D475-G477 PolarHBondContact OD1-N 3.14Å; G477-P479 VanDerWaalsContact C-C 3.49Å; G477-P479 CarbonylContact C-O 3.58Å; G477-P479 CarbonylContact O-C 3.58Å; G477-P480 WeakPolarHBondContact O-CB 3.26Å; G477-P480 WeakPolarHBondContact O-CD 3.08Å
478	H	85	Confident	91.5	Very high	174 Å²	174	41.3 Å²	41.3	81%	0.806	23%	0.231	S	C	*	.	S	Bend	trans	-139.8	91.5	178.4	-72	71.4	0	0	0	109.9	Q476	Q476-H478 PolarHBondContact O-ND1 3.03Å
479	P	88.1	Confident	91.5	Very high	94 Å²	94	39.4 Å²	39.4	61%	0.61	22%	0.221	S	C	*	.	S	Bend	cis	-74.7	149.7	6.3	32.9	-36.2	0	0	0	112.9	N380 G477	N380-P479 PolarHBondContact ND2-O 3.13Å; G477-P479 VanDerWaalsContact C-C 3.49Å; G477-P479 CarbonylContact C-O 3.58Å; G477-P479 CarbonylContact O-C 3.58Å
480	P	91.9	Very high	91.5	Very high	83 Å²	83	41.1 Å²	41.1	54%	0.539	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-79.6	133.6	178.2	30.5	-34	0	0	0	112.3	V474 D475 G477	V474-P480 HydrophobicContact CG1-CB 4.23Å; D475-P480 WeakPolarHBondContact OD1-CA 3.31Å; D475-P480 WeakPolarHBondContact OD1-CB 3.22Å; G477-P480 WeakPolarHBondContact O-CB 3.26Å; G477-P480 WeakPolarHBondContact O-CD 3.08Å
481	L	93.5	Very high	91.4	Very high	49 Å²	49	39.8 Å²	39.8	26%	0.257	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-101.5	163.2	177.2	-54.5	178.3	0	0	0	111	N380 P383 V474 D475	N380-L481 WeakPolarHBondContact ND2-CG 3.3Å; P383-L481 HydrophobicContact CB-CB 3.97Å; P383-L481 HydrophobicContact CB-CD1 4.12Å; V474-L481 WeakPolarHBondContact CA-O 3.21Å; V474-L481 WeakPolarHBondContact CG1-O 3.45Å; D475-L481 VanDerWaalsContact CG-N 3.31Å; D475-L481 PolarHBondContact N-O 2.83Å; D475-L481 PolarHBondContact OD1-N 3.46Å; D475-L481 WeakPolarHBondContact OD2-CA 3.42Å; D475-L481 VanDerWaalsContact OD2-CB 3.27Å; D475-L481 WeakPolarHBondContact OD2-CB 3.44Å; D475-L481 PolarHBondContact OD2-N 3.35Å
482	S	93.9	Very high	91.3	Very high	73 Å²	73	42.7 Å²	42.7	51%	0.51	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	155.4	-174.6	64.6	0	0	0	0	113.8	C473	C473-S482 CarbonylContact O-C 3.55Å; C473-S482 WeakPolarHBondContact O-CA 3.27Å; C473-S482 VanDerWaalsContact O-CB 3.25Å; C473-S482 WeakPolarHBondContact O-CB 3.15Å
483	A	93.5	Very high	91	Very high	30 Å²	30	44.9 Å²	44.9	25%	0.248	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	169.6	171.4	0	0	0	0	0	111.4	P384 F386 V472 C473	P384-A483 WeakPolarHBondContact O-CB 3.36Å; F386-A483 HydrophobicContact CD2-CB 3.99Å; F386-A483 HydrophobicContact CE2-CB 3.97Å; V472-A483 WeakPolarHBondContact CA-O 3.44Å; V472-A483 WeakPolarHBondContact CG1-O 3.08Å; C473-A483 PolarHBondContact N-O 2.68Å; C473-A483 PolarHBondContact O-N 2.88Å
484	S	93	Very high	90.6	Very high	51 Å²	51	48.3 Å²	48.3	36%	0.357	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	144.7	175.8	55.2	0	0	0	0	112.6	R425 I471	R425-S484 PolarHBondContact NH2-OG 3.46Å; R425-S484 VanDerWaalsContact NH2-OG 3.12Å; I471-S484 CarbonylContact O-C 3.58Å; I471-S484 WeakPolarHBondContact O-CA 3.36Å; I471-S484 VanDerWaalsContact O-CB 3.3Å; I471-S484 WeakPolarHBondContact O-CB 3.33Å
485	A	92.3	Very high	90.2	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146.4	172.8	0	0	0	0	0	110.6	F386 K388 S389 F391 E470 I471	F386-A485 HydrophobicContact CB-CB 4.2Å; F386-A485 HydrophobicContact CD1-CB 3.62Å; F386-A485 HydrophobicContact CD2-CB 4.31Å; F386-A485 HydrophobicContact CE1-CB 4.02Å; F386-A485 HydrophobicContact CG-CB 3.79Å; F386-A485 HydrophobicContact CZ-CB 4.49Å; K388-A485 WeakPolarHBondContact O-CB 3.46Å; S389-A485 CarbonylContact O-C 3.45Å; S389-A485 WeakPolarHBondContact O-CA 3.5Å; F391-A485 HydrophobicContact CD2-CB 4.18Å; F391-A485 HydrophobicContact CE2-CB 3.89Å; E470-A485 WeakPolarHBondContact CA-O 3.46Å; I471-A485 HydrophobicContact CG2-CB 4.19Å; I471-A485 PolarHBondContact N-O 3.22Å; I471-A485 PolarHBondContact O-N 2.98Å
486	Q	91.5	Very high	89.7	Confident	73 Å²	73	51 Å²	51	34%	0.341	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	143.3	176.8	-73.1	-175.3	2.8	0	0	111.1	S389 E390 F391 E470	S389-Q486 PolarHBondContact O-N 2.92Å; E390-Q486 CarbonylContact C-O 3.57Å; E390-Q486 WeakPolarHBondContact CA-O 3.01Å; E390-Q486 HydrophobicContact CG-CB 4.43Å; F391-Q486 PolarHBondContact N-O 2.85Å; E470-Q486 HydrophobicContact CG-CG 3.53Å; E470-Q486 PolarHBondContact OE1-NE2 3.45Å
487	I	91.6	Very high	89.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	117.7	177.5	-53.5	-173.7	0	0	0	107.6	F391 I393 I407 L453 I468 F469 I471 I489	F391-I487 HydrophobicContact CB-CG1 4.49Å; F391-I487 WeakPolarHBondContact O-CA 3.48Å; I393-I487 HydrophobicContact CD1-CG2 4.02Å; I407-I487 HydrophobicContact CD1-CD1 3.59Å; L453-I487 HydrophobicContact CD1-CD1 3.46Å; L453-I487 VanDerWaalsContact CD1-CD1 3.46Å; L453-I487 HydrophobicContact CD1-CG2 4.37Å; I468-I487 WeakPolarHBondContact CA-O 3.11Å; F469-I487 HydrophobicContact CD2-CB 4.29Å; F469-I487 HydrophobicContact CE1-CB 4.12Å; F469-I487 HydrophobicContact CE1-CG2 3.99Å; F469-I487 HydrophobicContact CE2-CB 3.89Å; F469-I487 HydrophobicContact CE2-CD1 3.89Å; F469-I487 HydrophobicContact CE2-CG1 4.31Å; F469-I487 HydrophobicContact CE2-CG2 4.19Å; F469-I487 HydrophobicContact CZ-CB 3.8Å; F469-I487 HydrophobicContact CZ-CD1 4.31Å; F469-I487 HydrophobicContact CZ-CG2 3.64Å; F469-I487 PolarHBondContact N-O 3.31Å; F469-I487 PolarHBondContact O-N 3.18Å; I471-I487 HydrophobicContact CB-CD1 4Å; I471-I487 HydrophobicContact CG2-CD1 3.78Å; I471-I487 HydrophobicContact CG2-CG1 4.19Å; I487-I489 HydrophobicContact CG2-CG1 4.28Å
488	K	91.1	Very high	89.5	Confident	71 Å²	71	52.3 Å²	52.3	31%	0.309	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	103.7	-179.4	176.9	-177.5	175.1	-171.6	0	108.9	F391 H392 I393 I468	F391-K488 PolarHBondContact O-N 3.19Å; H392-K488 WeakPolarHBondContact CA-O 3.29Å; H392-K488 PolarHBondContact ND1-O 2.79Å; I393-K488 PolarHBondContact N-O 2.98Å; I468-K488 HydrophobicContact CD1-CG 4.48Å; I468-K488 HydrophobicContact CG1-CB 4.26Å; I468-K488 HydrophobicContact CG1-CG 4.1Å
489	I	90.3	Very high	89.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.5	173.9	-62.3	-175.8	0	0	0	108.1	I393 V395 I442 L459 H466 F467 F469 I487 V491	I393-I489 WeakPolarHBondContact O-CA 3.41Å; V395-I489 HydrophobicContact CG2-CG2 4.3Å; I442-I489 HydrophobicContact CD1-CD1 3.82Å; L459-I489 HydrophobicContact CD1-CG2 4.13Å; H466-I489 VanDerWaalsContact CA-O 3.3Å; H466-I489 WeakPolarHBondContact CA-O 3.14Å; F467-I489 HydrophobicContact CD1-CB 4.48Å; F467-I489 HydrophobicContact CE1-CB 4.1Å; F467-I489 HydrophobicContact CE1-CG2 3.96Å; F467-I489 HydrophobicContact CE2-CB 4.19Å; F467-I489 HydrophobicContact CE2-CD1 3.92Å; F467-I489 HydrophobicContact CE2-CG1 4.38Å; F467-I489 HydrophobicContact CZ-CB 3.95Å; F467-I489 HydrophobicContact CZ-CD1 3.83Å; F467-I489 HydrophobicContact CZ-CG1 4.38Å; F467-I489 HydrophobicContact CZ-CG2 4.02Å; F467-I489 PolarHBondContact N-O 3.44Å; F467-I489 PolarHBondContact O-N 3.27Å; F469-I489 HydrophobicContact CE1-CD1 3.82Å; F469-I489 HydrophobicContact CE1-CG1 4.09Å; F469-I489 HydrophobicContact CZ-CD1 4.12Å; I487-I489 HydrophobicContact CG2-CG1 4.28Å; I489-V491 HydrophobicContact CG2-CG2 4.43Å
490	T	91	Very high	89.8	Confident	37 Å²	37	42.9 Å²	42.9	23%	0.227	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.8	158.7	-76.6	0	0	0	0	107.1	H392 I393 E394 V395 L492	H392-T490 PolarHBondContact CE1-OG1 2.86Å; I393-T490 PolarHBondContact O-N 2.94Å; E394-T490 WeakPolarHBondContact CA-O 3.42Å; V395-T490 PolarHBondContact N-O 2.98Å; T490-L492 HydrophobicContact CG2-CD2 4.44Å
491	V	90	Very high	89.8	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	131.9	171.2	-171.4	0	0	0	0	107.6	V395 E397 L459 Y461 Q464 S465 F467 I489	V395-V491 CarbonylContact O-C 3.56Å; V395-V491 WeakPolarHBondContact O-CA 3.26Å; E397-V491 HydrophobicContact CB-CG1 3.5Å; L459-V491 HydrophobicContact CB-CG1 4.32Å; L459-V491 HydrophobicContact CB-CG2 4.29Å; L459-V491 HydrophobicContact CD1-CG2 3.92Å; Y461-V491 HydrophobicContact CD2-CB 4.09Å; Y461-V491 HydrophobicContact CD2-CG1 4.27Å; Y461-V491 VanDerWaalsContact CD2-O 3.31Å; Y461-V491 WeakPolarHBondContact CD2-O 3.37Å; Q464-V491 WeakPolarHBondContact O-CG2 3.33Å; S465-V491 WeakPolarHBondContact O-CB 3.3Å; S465-V491 PolarHBondContact O-N 3.11Å; F467-V491 HydrophobicContact CE1-CG2 4.18Å; I489-V491 HydrophobicContact CG2-CG2 4.43Å
492	L	88.6	Confident	89.7	Confident	60 Å²	60	41.3 Å²	41.3	31%	0.314	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	114.7	170.5	-61.5	-180	0	0	0	108	E394 V395 N396 E397 T490	E394-L492 HydrophobicContact CB-CD1 4.03Å; E394-L492 HydrophobicContact CB-CD2 4.21Å; E394-L492 HydrophobicContact CB-CG 4.08Å; E394-L492 HydrophobicContact CG-CD2 4.46Å; V395-L492 PolarHBondContact O-N 2.8Å; N396-L492 WeakPolarHBondContact CA-O 3.32Å; E397-L492 PolarHBondContact N-O 2.75Å; T490-L492 HydrophobicContact CG2-CD2 4.44Å
493	N	86.4	Confident	89.7	Confident	50 Å²	50	38 Å²	38	27%	0.267	21%	0.205	S	C	.	.			trans	-49.3	134.4	170.7	176.4	-74.4	0	0	0	111.5	E397 Y461 D543	E397-N493 VanDerWaalsContact OE1-CA 3.32Å; E397-N493 WeakPolarHBondContact OE1-CA 3.45Å; Y461-N493 HydrophobicContact CD1-CB 3.77Å; Y461-N493 VanDerWaalsContact CD1-ND2 3.3Å; Y461-N493 WeakPolarHBondContact CD1-ND2 3.09Å; Y461-N493 HydrophobicContact CD2-CB 3.86Å; Y461-N493 HydrophobicContact CE1-CB 3.81Å; Y461-N493 WeakPolarHBondContact CE1-ND2 3.32Å; Y461-N493 HydrophobicContact CE2-CB 3.92Å; Y461-N493 HydrophobicContact CG-CB 3.79Å; N493-D543 VanDerWaalsContact ND2-CA 3.33Å; N493-D543 WeakPolarHBondContact ND2-CA 3.19Å; N493-D543 PolarHBondContact ND2-O 2.91Å; N493-D543 VanDerWaalsContact ND2-O 3.08Å; N493-D543 PolarHBondContact OD1-O 2.81Å
494	M	84.7	Confident	89.5	Confident	72 Å²	72	39.2 Å²	39.2	36%	0.355	20%	0.204	S	C	.	.			trans	-125	150.2	174.9	-69.1	-65.2	-57.1	0	0	108.7	N396 E397 D496	N396-M494 HydrophobicContact CB-CG 3.85Å; N396-M494 HydrophobicContact CB-SD 3.89Å; N396-M494 PolarHBondContact ND2-SD 3.13Å; E397-M494 HydrophobicContact CG-CB 4.36Å; E397-M494 HydrophobicContact CG-CG 4.48Å; E397-M494 WeakPolarHBondContact OE1-CB 3.11Å; E397-M494 PolarHBondContact OE1-N 3.3Å; M494-D496 PolarHBondContact O-N 3.3Å
495	N	84.6	Confident	89.3	Confident	27 Å²	27	39 Å²	39	14%	0.144	20%	0.197	C	C	.	.	S	Bend	trans	-76.7	85.9	177.4	-166.4	104.6	0	0	0	111.2	D543 N544 D602 L609	N495-D543 VanDerWaalsContact C-OD2 3.27Å; N495-D543 WeakPolarHBondContact CA-OD2 3.42Å; N495-N544 PolarHBondContact OD1-ND2 2.76Å; N495-D602 PolarHBondContact ND2-OD1 2.77Å; N495-D602 PolarHBondContact ND2-OD2 3.33Å; N495-D602 WeakPolarHBondContact OD1-CB 3.2Å; N495-D602 PolarHBondContact OD1-OD2 2.89Å; N495-L609 WeakPolarHBondContact ND2-CG 3.27Å
496	D	85	Confident	88.9	Confident	63 Å²	63	47.1 Å²	47.1	34%	0.337	23%	0.234	S	C	.	.			trans	-119.8	-14.1	177.2	78.5	33	0	0	0	116.6	N398 M494 D543 L609	N398-D496 PolarHBondContact ND2-OD2 3.16Å; M494-D496 PolarHBondContact O-N 3.3Å; D496-D543 PolarHBondContact N-OD2 3.31Å; D496-L609 VanDerWaalsContact C-CD1 3.41Å; D496-L609 VanDerWaalsContact O-CD1 3.23Å; D496-L609 WeakPolarHBondContact O-CD1 3.27Å
497	N	85.2	Confident	88.2	Confident	54 Å²	54	46.1 Å²	46.1	29%	0.289	24%	0.243	S	C	.	.	S	Bend	trans	-100.8	84	175	-62.1	-84	0	0	0	113.4	L542 D543	N497-L542 HydrophobicContact CB-CB 4.03Å; N497-L542 HydrophobicContact CB-CD1 4.19Å; N497-L542 HydrophobicContact CB-CG 4.39Å; N497-D543 WeakPolarHBondContact CB-OD1 3.4Å; N497-D543 PolarHBondContact N-OD1 3.26Å; N497-D543 PolarHBondContact N-OD2 3.35Å; N497-D543 PolarHBondContact ND2-OD1 3.39Å
498	A	87.4	Confident	87.8	Confident	35 Å²	35	52.5 Å²	52.5	29%	0.289	27%	0.274	S	S	.	.			trans	-47	138.4	178.9	0	0	0	0	0	115.1	I500 L609	A498-I500 PolarHBondContact O-N 3.41Å; A498-L609 HydrophobicContact CB-CB 3.68Å; A498-L609 HydrophobicContact CB-CD1 4.21Å
499	P	90.6	Very high	87.6	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.013	28%	0.283	C	S	.	.			trans	-46.2	116.2	-174.1	-30.7	26.7	0	0	0	116.1	I501 V539 D541 I549 C600 D602 G611	P499-I501 PolarHBondContact O-N 3.39Å; P499-V539 HydrophobicContact CB-CG1 3.96Å; P499-D541 WeakPolarHBondContact CG-OD2 3.49Å; P499-I549 HydrophobicContact CG-CG2 4.43Å; P499-C600 HydrophobicContact CB-CB 3.87Å; P499-C600 HydrophobicContact CG-CB 4.43Å; P499-D602 VanDerWaalsContact CD-OD2 3.24Å; P499-D602 WeakPolarHBondContact CD-OD2 3.3Å; P499-D602 HydrophobicContact CG-CB 4.04Å; P499-G611 VanDerWaalsContact O-CA 3.27Å; P499-G611 WeakPolarHBondContact O-CA 3.31Å
500	I	90.1	Very high	87.6	Confident	69 Å²	69	54.8 Å²	54.8	35%	0.354	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	115.7	-177.9	-58.4	174.6	0	0	0	110.4	A498 K502 V539 T540	A498-I500 PolarHBondContact O-N 3.41Å; I500-K502 HydrophobicContact CG2-CD 4.42Å; I500-K502 HydrophobicContact CG2-CG 4.42Å; I500-V539 WeakPolarHBondContact O-CA 3.41Å; I500-T540 WeakPolarHBondContact CB-O 3.28Å; I500-T540 PolarHBondContact N-O 3.27Å; I500-T540 PolarHBondContact O-N 2.85Å
501	I	91.9	Very high	87.1	Confident	6 Å²	6	57.5 Å²	57.5	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	128	-177	-56.6	169.4	0	0	0	110.9	P499 F503 V537 V539 V598 C600 N613	P499-I501 PolarHBondContact O-N 3.39Å; I501-F503 HydrophobicContact CG2-CZ 4.32Å; I501-V537 HydrophobicContact CG2-CG1 3.55Å; I501-V539 HydrophobicContact CG1-CG1 4.45Å; I501-V539 HydrophobicContact CG1-CG2 4.4Å; I501-V598 HydrophobicContact CD1-CB 4.25Å; I501-V598 HydrophobicContact CD1-CG1 4.06Å; I501-V598 VanDerWaalsContact CD1-O 3.28Å; I501-V598 WeakPolarHBondContact CD1-O 3.15Å; I501-V598 HydrophobicContact CG2-CB 4.27Å; I501-V598 HydrophobicContact CG2-CG1 4.36Å; I501-C600 HydrophobicContact CD1-CB 3.89Å; I501-C600 HydrophobicContact CG1-CB 4.18Å; I501-N613 HydrophobicContact CB-CB 3.86Å; I501-N613 HydrophobicContact CG2-CB 3.99Å; I501-N613 PolarHBondContact O-ND2 3.01Å
502	K	91.2	Very high	86.1	Confident	93 Å²	93	60.8 Å²	60.8	40%	0.404	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.2	179.1	-68.7	174.1	-179.9	162.5	0	112.1	I500 Y504 H538	I500-K502 HydrophobicContact CG2-CD 4.42Å; I500-K502 HydrophobicContact CG2-CG 4.42Å; K502-Y504 HydrophobicContact CB-CE2 4.02Å; K502-H538 PolarHBondContact N-O 3.17Å; K502-H538 PolarHBondContact O-N 2.98Å
503	F	93.2	Very high	85.3	Confident	4 Å²	4	64.8 Å²	64.8	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	140.3	-178.1	-58.1	-79.8	0	0	0	112.4	I501 L510 A515 V537 V598 N613 Q614 L615	I501-F503 HydrophobicContact CG2-CZ 4.32Å; F503-L510 HydrophobicContact CB-CB 4.34Å; F503-L510 HydrophobicContact CB-CD1 3.84Å; F503-L510 HydrophobicContact CB-CG 4.31Å; F503-L510 PolarHBondContact O-N 3.12Å; F503-A515 HydrophobicContact CB-CB 4.29Å; F503-A515 HydrophobicContact CD2-CB 3.51Å; F503-A515 HydrophobicContact CE2-CB 4.2Å; F503-A515 HydrophobicContact CG-CB 4.2Å; F503-V537 HydrophobicContact CD1-CG1 4.42Å; F503-V537 HydrophobicContact CD1-CG2 3.97Å; F503-V537 HydrophobicContact CE1-CG1 4.28Å; F503-V537 HydrophobicContact CE1-CG2 4.01Å; F503-V598 HydrophobicContact CE1-CG2 3.7Å; F503-V598 HydrophobicContact CZ-CB 4.43Å; F503-V598 HydrophobicContact CZ-CG2 3.9Å; F503-N613 HydrophobicContact CE2-CB 3.83Å; F503-N613 HydrophobicContact CZ-CB 4.33Å; F503-Q614 WeakPolarHBondContact CE2-O 3.31Å; F503-L615 HydrophobicContact CD1-CB 4.24Å; F503-L615 HydrophobicContact CD1-CD1 4.41Å; F503-L615 HydrophobicContact CD1-CD2 4.26Å; F503-L615 HydrophobicContact CD2-CB 4.48Å; F503-L615 HydrophobicContact CE1-CB 3.88Å; F503-L615 HydrophobicContact CE1-CD2 4.36Å; F503-L615 HydrophobicContact CE2-CB 4.13Å; F503-L615 HydrophobicContact CG-CD1 4.28Å; F503-L615 HydrophobicContact CZ-CB 3.82Å
504	Y	90.2	Very high	85.1	Confident	55 Å²	55	68.2 Å²	68.2	22%	0.216	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	117.2	179.4	-75.9	-105.2	0	0	0	111.1	K502 Q508 P509 C535 H536 H538	K502-Y504 HydrophobicContact CB-CE2 4.02Å; Y504-Q508 CarbonylContact C-O 3.59Å; Y504-Q508 WeakPolarHBondContact CA-O 3.46Å; Y504-P509 HydrophobicContact CD1-CB 4.11Å; Y504-P509 HydrophobicContact CE1-CB 3.68Å; Y504-P509 HydrophobicContact CE1-CG 4.25Å; Y504-P509 HydrophobicContact CE2-CB 4.47Å; Y504-C535 WeakPolarHBondContact O-CA 3.46Å; Y504-C535 WeakPolarHBondContact O-CB 3.37Å; Y504-H536 PolarHBondContact N-O 2.87Å; Y504-H536 PolarHBondContact O-N 2.95Å; Y504-H538 HydrophobicContact CD2-CB 4.22Å; Y504-H538 AromaticContact CD2-CE1 3.56Å; Y504-H538 AromaticContact CD2-CG 3.78Å; Y504-H538 AromaticContact CD2-ND1 2.99Å; Y504-H538 WeakPolarHBondContact CD2-ND1 3.48Å; Y504-H538 HydrophobicContact CE2-CB 4.08Å; Y504-H538 AromaticContact CE2-CE1 3.89Å; Y504-H538 AromaticContact CE2-CG 3.88Å; Y504-H538 AromaticContact CE2-ND1 3.01Å; Y504-H538 WeakPolarHBondContact CE2-ND1 3.49Å; Y504-H538 AromaticContact CG-CE1 3.65Å; Y504-H538 AromaticContact CG-ND1 3.57Å; Y504-H538 AromaticContact CZ-ND1 3.6Å
505	H	88.7	Confident	85.3	Confident	47 Å²	47	64.9 Å²	64.9	22%	0.218	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.8	-179.3	-179.1	64.6	0	0	0	109.3	G507 Q508 L510 I517 L534 C535	H505-G507 PolarHBondContact O-N 3.03Å; H505-G507 VanDerWaalsContact O-N 3.08Å; H505-Q508 PolarHBondContact N-O 3.31Å; H505-Q508 PolarHBondContact O-N 3.06Å; H505-L510 HydrophobicContact CB-CD1 4.34Å; H505-L510 HydrophobicContact CB-CD2 4.01Å; H505-L510 HydrophobicContact CB-CG 4.29Å; H505-I517 HydrophobicContact CB-CG2 3.89Å; H505-L534 PolarHBondContact ND1-O 2.77Å; H505-C535 HydrophobicContact CB-CB 4.32Å
506	H	83.3	Confident	85.6	Confident	170 Å²	170	66.9 Å²	66.9	79%	0.787	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.6	38.6	-170	-59.7	-61.1	0	0	0	114.5	Q508	H506-Q508 VanDerWaalsContact C-N 3.27Å; H506-Q508 PolarHBondContact O-N 2.95Å
507	G	77.7	Confident	85.9	Confident	52 Å²	52	64 Å²	64	54%	0.536	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-7.2	179.7	0	0	0	0	0	116	H505	H505-G507 PolarHBondContact O-N 3.03Å; H505-G507 VanDerWaalsContact O-N 3.08Å
508	Q	82.8	Confident	86.1	Confident	135 Å²	135	63.5 Å²	63.5	63%	0.631	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	140.5	174.2	-59.7	-55.6	-42.9	0	0	111	Y504 H505 H506	Y504-Q508 CarbonylContact C-O 3.59Å; Y504-Q508 WeakPolarHBondContact CA-O 3.46Å; H505-Q508 PolarHBondContact N-O 3.31Å; H505-Q508 PolarHBondContact O-N 3.06Å; H506-Q508 VanDerWaalsContact C-N 3.27Å; H506-Q508 PolarHBondContact O-N 2.95Å
509	P	87.5	Confident	86.1	Confident	77 Å²	77	62.3 Å²	62.3	50%	0.5	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	138.1	169.7	29.1	-32.7	0	0	0	110.2	Y504	Y504-P509 HydrophobicContact CD1-CB 4.11Å; Y504-P509 HydrophobicContact CE1-CB 3.68Å; Y504-P509 HydrophobicContact CE1-CG 4.25Å; Y504-P509 HydrophobicContact CE2-CB 4.47Å
510	L	88.6	Confident	85.9	Confident	41 Å²	41	67.4 Å²	67.4	22%	0.215	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-79.5	162.6	165.3	-58.8	179.9	0	0	0	110	F503 H505 S512 A515 I517 L615	F503-L510 HydrophobicContact CB-CB 4.34Å; F503-L510 HydrophobicContact CB-CD1 3.84Å; F503-L510 HydrophobicContact CB-CG 4.31Å; F503-L510 PolarHBondContact O-N 3.12Å; H505-L510 HydrophobicContact CB-CD1 4.34Å; H505-L510 HydrophobicContact CB-CD2 4.01Å; H505-L510 HydrophobicContact CB-CG 4.29Å; L510-S512 PolarHBondContact O-N 2.86Å; L510-A515 HydrophobicContact CB-CB 3.84Å; L510-A515 HydrophobicContact CD1-CB 4.01Å; L510-I517 HydrophobicContact CD1-CG2 3.65Å; L510-I517 HydrophobicContact CD2-CG2 4.32Å; L510-L615 HydrophobicContact CD1-CD1 3.71Å
511	D	80.7	Confident	85.7	Confident	95 Å²	95	64.1 Å²	64.1	51%	0.508	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-60.2	127.5	174.5	-169.2	-35.8	0	0	0	109.5	N513 Y514 A515	D511-N513 PolarHBondContact O-N 3.2Å; D511-N513 WeakPolarHBondContact OD1-CB 3.33Å; D511-N513 PolarHBondContact OD1-N 3.43Å; D511-N513 PolarHBondContact OD1-ND2 3.19Å; D511-Y514 CarbonylContact O-C 3.58Å; D511-Y514 PolarHBondContact O-N 2.98Å; D511-A515 PolarHBondContact O-N 3.24Å; D511-A515 VanDerWaalsContact O-N 3.15Å
512	S	70.2	Confident	84.8	Confident	69 Å²	69	65.9 Å²	65.9	48%	0.483	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.4	-179.2	52	0	0	0	0	113.5	L510	L510-S512 PolarHBondContact O-N 2.86Å
513	N	72.1	Confident	83.5	Confident	144 Å²	144	65.1 Å²	65.1	77%	0.77	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-21.8	179.9	-53.1	-36.2	0	0	0	112.4	D511	D511-N513 PolarHBondContact O-N 3.2Å; D511-N513 WeakPolarHBondContact OD1-CB 3.33Å; D511-N513 PolarHBondContact OD1-N 3.43Å; D511-N513 PolarHBondContact OD1-ND2 3.19Å
514	Y	82.5	Confident	82	Confident	122 Å²	122	67.1 Å²	67.1	48%	0.478	35%	0.346	S	S	.	.	S	Bend	trans	-157.4	78.1	-178.2	-171.2	-103.7	0	0	0	110.8	D511 Q516 H616	D511-Y514 CarbonylContact O-C 3.58Å; D511-Y514 PolarHBondContact O-N 2.98Å; Y514-Q516 HydrophobicContact CD1-CB 4.32Å; Y514-Q516 HydrophobicContact CE1-CB 3.86Å; Y514-Q516 HydrophobicContact CE1-CG 4.35Å; Y514-Q516 PolarHBondContact O-N 2.65Å; Y514-Q516 PolarHBondContact OH-OE1 2.81Å; Y514-H616 AromaticContact CD2-CD2 3.88Å; Y514-H616 AromaticContact CE2-CD2 3.41Å; Y514-H616 VanDerWaalsContact CE2-CD2 3.41Å; Y514-H616 WeakPolarHBondContact CE2-CD2 3.37Å; Y514-H616 AromaticContact CE2-NE2 3.65Å; Y514-H616 AromaticContact CZ-CD2 3.96Å
515	A	88.1	Confident	80.3	Confident	2 Å²	2	68 Å²	68	2%	0.017	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	117	178.5	0	0	0	0	0	110.2	F503 L510 D511 L615 H616	F503-A515 HydrophobicContact CB-CB 4.29Å; F503-A515 HydrophobicContact CD2-CB 3.51Å; F503-A515 HydrophobicContact CE2-CB 4.2Å; F503-A515 HydrophobicContact CG-CB 4.2Å; L510-A515 HydrophobicContact CB-CB 3.84Å; L510-A515 HydrophobicContact CD1-CB 4.01Å; D511-A515 PolarHBondContact O-N 3.24Å; D511-A515 VanDerWaalsContact O-N 3.15Å; A515-L615 HydrophobicContact CB-CD1 4.03Å; A515-L615 WeakPolarHBondContact O-CA 3.26Å; A515-H616 PolarHBondContact O-N 2.74Å
516	Q	91.2	Very high	78.5	Confident	69 Å²	69	72.9 Å²	72.9	32%	0.322	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.6	179.3	-169	-174.5	-81.9	0	0	111.3	Y514 H616 I618	Y514-Q516 HydrophobicContact CD1-CB 4.32Å; Y514-Q516 HydrophobicContact CE1-CB 3.86Å; Y514-Q516 HydrophobicContact CE1-CG 4.35Å; Y514-Q516 PolarHBondContact O-N 2.65Å; Y514-Q516 PolarHBondContact OH-OE1 2.81Å; Q516-H616 CarbonylContact C-O 3.57Å; Q516-H616 VanDerWaalsContact CA-O 3.27Å; Q516-H616 WeakPolarHBondContact CA-O 3.01Å; Q516-H616 HydrophobicContact CB-CB 4.34Å; Q516-H616 HydrophobicContact CG-CB 4.07Å; Q516-H616 WeakPolarHBondContact CG-O 3.23Å; Q516-I618 HydrophobicContact CG-CD1 4.23Å; Q516-I618 HydrophobicContact CG-CG1 4.35Å
517	I	90.9	Very high	76.9	Confident	4 Å²	4	73.2 Å²	73.2	2%	0.021	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	159	167.9	60.7	-176.3	0	0	0	110.1	H505 L510 I519 L534 L615 H616 I617 I618	H505-I517 HydrophobicContact CB-CG2 3.89Å; L510-I517 HydrophobicContact CD1-CG2 3.65Å; L510-I517 HydrophobicContact CD2-CG2 4.32Å; I517-I519 HydrophobicContact CD1-CD1 3.7Å; I517-I519 HydrophobicContact CG1-CD1 4.11Å; I517-L534 HydrophobicContact CD1-CB 4.2Å; I517-L615 HydrophobicContact CD1-CD1 4.45Å; I517-L615 HydrophobicContact CD1-CD2 4.06Å; I517-L615 HydrophobicContact CG1-CD1 4.34Å; I517-L615 HydrophobicContact CG2-CD1 4.37Å; I517-H616 PolarHBondContact N-O 2.82Å; I517-I617 HydrophobicContact CD1-CD1 4.32Å; I517-I617 HydrophobicContact CD1-CG1 4.02Å; I517-I617 HydrophobicContact CG1-CB 4.36Å; I517-I617 HydrophobicContact CG1-CG1 3.91Å; I517-I617 HydrophobicContact CG1-CG2 4.34Å; I517-I618 PolarHBondContact O-N 3.39Å
518	S	89.2	Confident	75.4	Confident	42 Å²	42	75.2 Å²	75.2	29%	0.294	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	105.8	-176.3	-50	0	0	0	0	110.9	I618 K620	S518-I618 WeakPolarHBondContact CA-O 3.42Å; S518-K620 VanDerWaalsContact O-CE 3.26Å; S518-K620 WeakPolarHBondContact O-CE 3.34Å; S518-K620 PolarHBondContact O-NZ 2.96Å
519	I	88.1	Confident	73.8	Confident	10 Å²	10	79 Å²	79	5%	0.051	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.9	-165.9	-63.1	163.6	0	0	0	107.7	I517 E523 F524 L534 I617 I618 V619 K620	I517-I519 HydrophobicContact CD1-CD1 3.7Å; I517-I519 HydrophobicContact CG1-CD1 4.11Å; I519-E523 HydrophobicContact CG2-CB 4.42Å; I519-E523 WeakPolarHBondContact CG2-OE2 3.47Å; I519-F524 HydrophobicContact CG2-CE2 3.91Å; I519-F524 HydrophobicContact CG2-CZ 4.03Å; I519-L534 HydrophobicContact CD1-CB 4.3Å; I519-L534 HydrophobicContact CD1-CD2 4.01Å; I519-I617 HydrophobicContact CD1-CG2 4.44Å; I519-I618 PolarHBondContact N-O 3.4Å; I519-I618 VanDerWaalsContact N-O 3.09Å; I519-V619 CarbonylContact O-C 3.51Å; I519-V619 WeakPolarHBondContact O-CA 3.41Å; I519-K620 PolarHBondContact O-N 3.24Å
520	Y	85.8	Confident	71.8	Confident	109 Å²	109	83.2 Å²	83.2	43%	0.427	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	145.5	174.3	-64.8	-87.6	0	0	0	111.3	E523 K620 R622	Y520-E523 WeakPolarHBondContact CB-OE2 3.45Å; Y520-E523 WeakPolarHBondContact CD2-OE2 3.46Å; Y520-E523 PolarHBondContact N-OE2 3.47Å; Y520-E523 WeakPolarHBondContact O-CB 3.37Å; Y520-E523 PolarHBondContact O-N 2.9Å; Y520-K620 WeakPolarHBondContact CA-O 3.22Å; Y520-K620 HydrophobicContact CD1-CB 3.43Å; Y520-K620 VanDerWaalsContact CD1-CB 3.43Å; Y520-K620 HydrophobicContact CD1-CD 3.91Å; Y520-K620 HydrophobicContact CD1-CG 4.38Å; Y520-K620 HydrophobicContact CD2-CD 4.04Å; Y520-K620 HydrophobicContact CE1-CB 3.8Å; Y520-K620 HydrophobicContact CE1-CD 3.75Å; Y520-K620 HydrophobicContact CE1-CG 4.46Å; Y520-K620 HydrophobicContact CE2-CD 3.91Å; Y520-K620 HydrophobicContact CG-CB 3.97Å; Y520-K620 HydrophobicContact CG-CD 4.05Å; Y520-R622 HydrophobicContact CD1-CG 4.44Å
521	E	85.4	Confident	70.1	Confident	0 Å²	0	86.2 Å²	86.2	0%	0	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	156	165.2	69.7	-155.4	120.5	0	0	111.1	E523 L586 R588 V619 K620 D621 R622	E521-E523 PolarHBondContact O-N 2.94Å; E521-L586 VanDerWaalsContact CB-O 3.32Å; E521-L586 WeakPolarHBondContact CB-O 3.37Å; E521-R588 WeakPolarHBondContact OE1-CB 3.22Å; E521-R588 WeakPolarHBondContact OE2-CB 3.33Å; E521-R588 PolarHBondContact OE2-N 2.8Å; E521-V619 HydrophobicContact CB-CG1 3.67Å; E521-K620 PolarHBondContact N-O 2.93Å; E521-D621 VanDerWaalsContact OE1-C 3.3Å; E521-D621 WeakPolarHBondContact OE1-CA 3.36Å; E521-R622 HydrophobicContact CG-CB 4.01Å; E521-R622 HydrophobicContact CG-CG 4.02Å; E521-R622 WeakPolarHBondContact O-CD 3.27Å; E521-R622 PolarHBondContact O-NE 2.92Å; E521-R622 PolarHBondContact OE1-N 2.83Å
522	N	72.5	Confident	69.4	Low	43 Å²	43	83.7 Å²	83.7	23%	0.23	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	13.6	-178.9	-69.4	-48.4	0	0	0	115.9	F524 S525 L586 D624	N522-F524 VanDerWaalsContact C-N 3.27Å; N522-F524 PolarHBondContact O-N 2.76Å; N522-S525 VanDerWaalsContact O-CB 3.23Å; N522-S525 WeakPolarHBondContact O-CB 3.22Å; N522-S525 PolarHBondContact O-N 3.32Å; N522-S525 VanDerWaalsContact O-N 3.12Å; N522-S525 PolarHBondContact O-OG 2.64Å; N522-L586 PolarHBondContact N-O 3.4Å; N522-D624 PolarHBondContact ND2-OD2 2.78Å
523	E	65.7	Low	69.8	Low	78 Å²	78	83.5 Å²	83.5	36%	0.364	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-33.5	-171.2	-176	168.4	160	0	0	113.2	I519 Y520 E521	I519-E523 HydrophobicContact CG2-CB 4.42Å; I519-E523 WeakPolarHBondContact CG2-OE2 3.47Å; Y520-E523 WeakPolarHBondContact CB-OE2 3.45Å; Y520-E523 WeakPolarHBondContact CD2-OE2 3.46Å; Y520-E523 PolarHBondContact N-OE2 3.47Å; Y520-E523 WeakPolarHBondContact O-CB 3.37Å; Y520-E523 PolarHBondContact O-N 2.9Å; E521-E523 PolarHBondContact O-N 2.94Å
524	F	60.2	Low	70.6	Confident	46 Å²	46	76.8 Å²	76.8	20%	0.202	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	6.7	-177.4	-46.7	-72.3	0	0	0	114.1	I519 N522 N526 Y527 Q532 L534 T582	I519-F524 HydrophobicContact CG2-CE2 3.91Å; I519-F524 HydrophobicContact CG2-CZ 4.03Å; N522-F524 VanDerWaalsContact C-N 3.27Å; N522-F524 PolarHBondContact O-N 2.76Å; F524-N526 PolarHBondContact O-N 3.19Å; F524-N526 VanDerWaalsContact O-N 3.1Å; F524-Y527 PolarHBondContact O-N 2.7Å; F524-Q532 HydrophobicContact CB-CB 4.4Å; F524-Q532 HydrophobicContact CB-CG 3.93Å; F524-Q532 HydrophobicContact CD1-CB 4.39Å; F524-Q532 HydrophobicContact CD1-CG 4.47Å; F524-Q532 HydrophobicContact CG-CB 4.21Å; F524-Q532 HydrophobicContact CG-CG 4.23Å; F524-Q532 PolarHBondContact O-NE2 3.2Å; F524-L534 HydrophobicContact CE2-CD2 3.72Å; F524-L534 HydrophobicContact CZ-CD2 4Å; F524-T582 HydrophobicContact CD2-CG2 4.4Å
525	S	55	Low	70.9	Confident	72 Å²	72	71.1 Å²	71.1	50%	0.503	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-27.8	-178.4	52.7	0	0	0	0	114.8	N522	N522-S525 VanDerWaalsContact O-CB 3.23Å; N522-S525 WeakPolarHBondContact O-CB 3.22Å; N522-S525 PolarHBondContact O-N 3.32Å; N522-S525 VanDerWaalsContact O-N 3.12Å; N522-S525 PolarHBondContact O-OG 2.64Å
526	N	51.9	Low	71	Confident	150 Å²	150	74.1 Å²	74.1	80%	0.802	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	3.2	-176.5	-83	-30.4	0	0	0	115.2	F524	F524-N526 PolarHBondContact O-N 3.19Å; F524-N526 VanDerWaalsContact O-N 3.1Å
527	Y	49	Very low	71.1	Confident	178 Å²	178	70.9 Å²	70.9	70%	0.698	35%	0.351	S	S	*	.	S	Bend	trans	-112.8	144.7	-179.7	-71.4	-80.1	0	0	0	112.3	F524	F524-Y527 PolarHBondContact O-N 2.7Å
528	S	46.4	Very low	71.1	Confident	93 Å²	93	71.5 Å²	71.5	65%	0.65	35%	0.354	S	S	*	.			trans	-55	153	-177.4	43.7	0	0	0	0	113	E530	S528-E530 PolarHBondContact O-N 3.12Å
529	K	49.7	Very low	71.2	Confident	215 Å²	215	69.5 Å²	69.5	94%	0.935	34%	0.34	S	S	*	.	S	Bend	trans	-60.6	9.2	-172.5	-72.9	-173.6	170.7	-175.3	0	117
530	E	44.7	Very low	71.2	Confident	165 Å²	165	71 Å²	71	77%	0.771	35%	0.35	S	S	*	.	S	Bend	trans	-103.7	104.2	-178.1	-64.9	-174.4	162.9	0	0	110.5	S528	S528-E530 PolarHBondContact O-N 3.12Å
531	N	52	Low	71.3	Confident	104 Å²	104	66.7 Å²	66.7	56%	0.556	33%	0.334	S	S	*	.			trans	60.8	76.2	161.5	-57.7	-23.4	0	0	0	117.8	I533	N531-I533 HydrophobicContact CB-CG1 4.49Å; N531-I533 PolarHBondContact O-N 3.2Å
532	Q	67.7	Low	71.3	Confident	43 Å²	43	71.2 Å²	71.2	20%	0.201	36%	0.358	C	S	.	.			trans	-85.4	86.4	169.3	-62.2	171.3	0.5	0	0	110.3	F524 T581	F524-Q532 HydrophobicContact CB-CB 4.4Å; F524-Q532 HydrophobicContact CB-CG 3.93Å; F524-Q532 HydrophobicContact CD1-CB 4.39Å; F524-Q532 HydrophobicContact CD1-CG 4.47Å; F524-Q532 HydrophobicContact CG-CB 4.21Å; F524-Q532 HydrophobicContact CG-CG 4.23Å; F524-Q532 PolarHBondContact O-NE2 3.2Å; Q532-T581 WeakPolarHBondContact O-CA 3.46Å; Q532-T581 WeakPolarHBondContact O-CB 3.42Å
533	I	78.5	Confident	71.8	Confident	64 Å²	64	69.9 Å²	69.9	33%	0.328	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119	-174.2	-53.1	169.4	0	0	0	110.8	N531 D579 T581	N531-I533 HydrophobicContact CB-CG1 4.49Å; N531-I533 PolarHBondContact O-N 3.2Å; I533-D579 HydrophobicContact CD1-CB 4.26Å; I533-D579 WeakPolarHBondContact CD1-OD2 3.11Å; I533-D579 HydrophobicContact CG1-CB 4.13Å; I533-D579 HydrophobicContact CG2-CB 4.17Å; I533-T581 HydrophobicContact CG1-CG2 4.15Å
534	L	87.4	Confident	72	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.021	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-45.9	176.8	-47.3	178.9	0	0	0	110.9	H505 I517 I519 F524 F561 L580 T582 I617	H505-L534 PolarHBondContact ND1-O 2.77Å; I517-L534 HydrophobicContact CD1-CB 4.2Å; I519-L534 HydrophobicContact CD1-CB 4.3Å; I519-L534 HydrophobicContact CD1-CD2 4.01Å; F524-L534 HydrophobicContact CE2-CD2 3.72Å; F524-L534 HydrophobicContact CZ-CD2 4Å; L534-F561 HydrophobicContact CD1-CD1 3.66Å; L534-F561 HydrophobicContact CD1-CE1 3.72Å; L534-L580 PolarHBondContact N-O 3.26Å; L534-T582 HydrophobicContact CD2-CG2 4.45Å; L534-I617 HydrophobicContact CD1-CD1 4Å
535	C	90.1	Very high	72.4	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.02	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	161.5	173.4	66.6	0	0	0	0	110.8	Y504 H505 L580	Y504-C535 WeakPolarHBondContact O-CA 3.46Å; Y504-C535 WeakPolarHBondContact O-CB 3.37Å; H505-C535 HydrophobicContact CB-CB 4.32Å; C535-L580 WeakPolarHBondContact O-CB 3.39Å; C535-L580 PolarHBondContact O-N 3.39Å
536	H	90.6	Very high	73.2	Confident	65 Å²	65	69.7 Å²	69.7	30%	0.301	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137	167.3	-49.9	-71.9	0	0	0	110	Y504 F578 D579	Y504-H536 PolarHBondContact N-O 2.87Å; Y504-H536 PolarHBondContact O-N 2.95Å; H536-F578 CarbonylContact C-O 3.55Å; H536-F578 WeakPolarHBondContact CA-O 3.04Å; H536-D579 IonicContact CE1-OD1 2.82Å; H536-D579 PolarHBondContact CE1-OD1 3.38Å; H536-D579 IonicContact CG-OD1 2.71Å; H536-D579 IonicContact ND1-OD1 3.74Å; H536-D579 PolarHBondContact ND1-OD1 2.81Å
537	V	92.2	Very high	74.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.7	171.9	-169	0	0	0	0	108	I501 F503 V539 L563 I577 F578 L580 V598	I501-V537 HydrophobicContact CG2-CG1 3.55Å; F503-V537 HydrophobicContact CD1-CG1 4.42Å; F503-V537 HydrophobicContact CD1-CG2 3.97Å; F503-V537 HydrophobicContact CE1-CG1 4.28Å; F503-V537 HydrophobicContact CE1-CG2 4.01Å; V537-V539 HydrophobicContact CG1-CG2 4.26Å; V537-L563 HydrophobicContact CB-CD1 4.29Å; V537-L563 HydrophobicContact CG2-CD1 3.74Å; V537-I577 WeakPolarHBondContact O-CA 3.45Å; V537-F578 HydrophobicContact CB-CB 4.32Å; V537-F578 PolarHBondContact N-O 2.85Å; V537-F578 PolarHBondContact O-N 2.88Å; V537-L580 HydrophobicContact CG2-CB 4.2Å; V537-V598 HydrophobicContact CG1-CG1 4.38Å; V537-V598 HydrophobicContact CG2-CG2 4.45Å
538	H	90.9	Very high	75.5	Confident	17 Å²	17	59.5 Å²	59.5	8%	0.079	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	133.8	173.1	-68.3	152.9	0	0	0	109.8	K502 Y504 R575	K502-H538 PolarHBondContact N-O 3.17Å; K502-H538 PolarHBondContact O-N 2.98Å; Y504-H538 HydrophobicContact CD2-CB 4.22Å; Y504-H538 AromaticContact CD2-CE1 3.56Å; Y504-H538 AromaticContact CD2-CG 3.78Å; Y504-H538 AromaticContact CD2-ND1 2.99Å; Y504-H538 WeakPolarHBondContact CD2-ND1 3.48Å; Y504-H538 HydrophobicContact CE2-CB 4.08Å; Y504-H538 AromaticContact CE2-CE1 3.89Å; Y504-H538 AromaticContact CE2-CG 3.88Å; Y504-H538 AromaticContact CE2-ND1 3.01Å; Y504-H538 WeakPolarHBondContact CE2-ND1 3.49Å; Y504-H538 AromaticContact CG-CE1 3.65Å; Y504-H538 AromaticContact CG-ND1 3.57Å; Y504-H538 AromaticContact CZ-ND1 3.6Å; H538-R575 PolarHBondContact CE1-NH2 2.78Å; H538-R575 PolarHBondContact NE2-NH2 3.09Å; H538-R575 VanDerWaalsContact NE2-NH2 3.15Å
539	V	90.3	Very high	77.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.7	-179.5	-170.4	0	0	0	0	108.9	P499 I500 I501 V537 I549 R575 K576 F578 C600	P499-V539 HydrophobicContact CB-CG1 3.96Å; I500-V539 WeakPolarHBondContact O-CA 3.41Å; I501-V539 HydrophobicContact CG1-CG1 4.45Å; I501-V539 HydrophobicContact CG1-CG2 4.4Å; V537-V539 HydrophobicContact CG1-CG2 4.26Å; V539-I549 HydrophobicContact CG1-CG2 4.15Å; V539-R575 CarbonylContact O-C 3.51Å; V539-R575 WeakPolarHBondContact O-CA 3.26Å; V539-R575 WeakPolarHBondContact O-CB 3.38Å; V539-K576 HydrophobicContact CB-CB 4.32Å; V539-K576 PolarHBondContact N-O 3.12Å; V539-K576 PolarHBondContact O-N 3.48Å; V539-F578 HydrophobicContact CG2-CD2 4.04Å; V539-F578 HydrophobicContact CG2-CE2 3.89Å; V539-C600 HydrophobicContact CG1-CB 4.21Å
540	T	89.1	Confident	79.2	Confident	43 Å²	43	49.8 Å²	49.8	26%	0.264	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135	177.9	48.3	0	0	0	0	109.5	I500 R575	I500-T540 WeakPolarHBondContact CB-O 3.28Å; I500-T540 PolarHBondContact N-O 3.27Å; I500-T540 PolarHBondContact O-N 2.85Å; T540-R575 HydrophobicContact CG2-CB 3.57Å
541	D	88.2	Confident	81.4	Confident	17 Å²	17	43.3 Å²	43.3	9%	0.091	24%	0.235	C	C	.	.			trans	-114	160.9	173.5	-154.1	-72.5	0	0	0	107.6	P499 D543 N544 L546 I549	P499-D541 WeakPolarHBondContact CG-OD2 3.49Å; D541-D543 PolarHBondContact OD1-N 2.81Å; D541-N544 PolarHBondContact OD1-N 3.36Å; D541-L546 HydrophobicContact CB-CD2 4.29Å; D541-I549 HydrophobicContact CB-CD1 3.62Å
542	L	85.6	Confident	83.3	Confident	95 Å²	95	40.7 Å²	40.7	50%	0.497	23%	0.225	S	C	.	.	S	Bend	trans	-110.3	-48.8	177.3	-65.1	-178.8	0	0	0	109.7	E462 N497	E462-L542 HydrophobicContact CG-CB 3.68Å; E462-L542 HydrophobicContact CG-CD1 4.17Å; E462-L542 HydrophobicContact CG-CG 4.46Å; N497-L542 HydrophobicContact CB-CB 4.03Å; N497-L542 HydrophobicContact CB-CD1 4.19Å; N497-L542 HydrophobicContact CB-CG 4.39Å
543	D	82.4	Confident	84.4	Confident	15 Å²	15	39.8 Å²	39.8	8%	0.08	22%	0.222	C	C	.	.	S	Bend	trans	-67.7	-50.4	-176.4	-33.4	-27.5	0	0	0	110.9	N493 N495 D496 N497 D541	N493-D543 VanDerWaalsContact ND2-CA 3.33Å; N493-D543 WeakPolarHBondContact ND2-CA 3.19Å; N493-D543 PolarHBondContact ND2-O 2.91Å; N493-D543 VanDerWaalsContact ND2-O 3.08Å; N493-D543 PolarHBondContact OD1-O 2.81Å; N495-D543 VanDerWaalsContact C-OD2 3.27Å; N495-D543 WeakPolarHBondContact CA-OD2 3.42Å; D496-D543 PolarHBondContact N-OD2 3.31Å; N497-D543 WeakPolarHBondContact CB-OD1 3.4Å; N497-D543 PolarHBondContact N-OD1 3.26Å; N497-D543 PolarHBondContact N-OD2 3.35Å; N497-D543 PolarHBondContact ND2-OD1 3.39Å; D541-D543 PolarHBondContact OD1-N 2.81Å
544	N	69.2	Low	84.6	Confident	57 Å²	57	40 Å²	40	31%	0.305	22%	0.222	S	C	.	.	S	Bend	trans	-107.3	153.2	-157.5	-114.8	-45.7	0	0	0	113.7	N495 D541	N495-N544 PolarHBondContact OD1-ND2 2.76Å; D541-N544 PolarHBondContact OD1-N 3.36Å
545	D	68.5	Low	84	Confident	99 Å²	99	42.5 Å²	42.5	53%	0.529	25%	0.248	S	C	.	.			trans	-69.7	136.5	171.8	97.8	-85.8	0	0	0	110	S547 S548	D545-S547 VanDerWaalsContact CG-OG 3.32Å; D545-S547 PolarHBondContact O-N 3.44Å; D545-S547 PolarHBondContact OD1-OG 3.31Å; D545-S547 WeakPolarHBondContact OD2-CB 3.4Å; D545-S547 PolarHBondContact OD2-N 2.93Å; D545-S547 VanDerWaalsContact OD2-N 3.12Å; D545-S547 PolarHBondContact OD2-OG 2.92Å; D545-S548 PolarHBondContact O-N 3.41Å; D545-S548 VanDerWaalsContact O-N 3.16Å; D545-S548 PolarHBondContact O-OG 2.84Å
546	L	72	Confident	83	Confident	36 Å²	36	47.4 Å²	47.4	19%	0.188	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-7.5	-170.3	-57.9	165.5	0	0	0	114.2	D541 I549 Q573 R575	D541-L546 HydrophobicContact CB-CD2 4.29Å; L546-I549 HydrophobicContact CB-CD1 4.33Å; L546-I549 HydrophobicContact CD2-CD1 3.6Å; L546-Q573 HydrophobicContact CD1-CB 4.45Å; L546-Q573 VanDerWaalsContact CD1-O 3.26Å; L546-Q573 WeakPolarHBondContact CD1-O 3.29Å; L546-R575 VanDerWaalsContact CD1-N 3.34Å
547	S	71.7	Confident	81.9	Confident	90 Å²	90	47.3 Å²	47.3	63%	0.629	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-34.9	175.6	77.5	0	0	0	0	112.2	D545 I549	D545-S547 VanDerWaalsContact CG-OG 3.32Å; D545-S547 PolarHBondContact O-N 3.44Å; D545-S547 PolarHBondContact OD1-OG 3.31Å; D545-S547 WeakPolarHBondContact OD2-CB 3.4Å; D545-S547 PolarHBondContact OD2-N 2.93Å; D545-S547 VanDerWaalsContact OD2-N 3.12Å; D545-S547 PolarHBondContact OD2-OG 2.92Å; S547-I549 VanDerWaalsContact C-N 3.27Å; S547-I549 PolarHBondContact O-N 2.72Å
548	S	77.3	Confident	80.5	Confident	25 Å²	25	50.5 Å²	50.5	18%	0.175	30%	0.295	C	S	.	.	S	Bend	trans	-63	-29.4	179.9	63.4	0	0	0	0	113.7	D545 Q550 G603	D545-S548 PolarHBondContact O-N 3.41Å; D545-S548 VanDerWaalsContact O-N 3.16Å; D545-S548 PolarHBondContact O-OG 2.84Å; S548-Q550 PolarHBondContact O-N 3.18Å; S548-G603 WeakPolarHBondContact O-CA 3.25Å; S548-G603 PolarHBondContact O-N 3.41Å
549	I	85.6	Confident	79.6	Confident	1 Å²	1	56 Å²	56	1%	0.005	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.8	-165.1	-53.2	170.3	0	0	0	112	P499 V539 D541 L546 S547 K576 C600 Q601	P499-I549 HydrophobicContact CG-CG2 4.43Å; V539-I549 HydrophobicContact CG1-CG2 4.15Å; D541-I549 HydrophobicContact CB-CD1 3.62Å; L546-I549 HydrophobicContact CB-CD1 4.33Å; L546-I549 HydrophobicContact CD2-CD1 3.6Å; S547-I549 VanDerWaalsContact C-N 3.27Å; S547-I549 PolarHBondContact O-N 2.72Å; I549-K576 HydrophobicContact CB-CD 4.23Å; I549-K576 PolarHBondContact O-NZ 3.26Å; I549-C600 HydrophobicContact CG2-CB 4.23Å; I549-Q601 CarbonylContact C-O 3.55Å; I549-Q601 VanDerWaalsContact CA-O 3.28Å; I549-Q601 WeakPolarHBondContact CA-O 3.49Å
550	Q	88.4	Confident	79.1	Confident	103 Å²	103	58.7 Å²	58.7	48%	0.481	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.7	174.7	-61	-178.9	1.6	0	0	109.9	S548 C600 Q601	S548-Q550 PolarHBondContact O-N 3.18Å; Q550-C600 CarbonylContact O-C 3.55Å; Q550-C600 VanDerWaalsContact O-CA 3.32Å; Q550-C600 WeakPolarHBondContact O-CA 3.29Å; Q550-Q601 HydrophobicContact CB-CG 4.06Å; Q550-Q601 PolarHBondContact N-O 2.83Å; Q550-Q601 PolarHBondContact O-N 2.78Å
551	C	91.4	Very high	79.1	Confident	28 Å²	28	56.7 Å²	56.7	19%	0.189	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	147	179.9	-64.6	0	0	0	0	112.1	L563 F578 K599 C600	C551-L563 HydrophobicContact CB-CD2 3.92Å; C551-F578 HydrophobicContact CB-CD2 4.45Å; C551-F578 HydrophobicContact CB-CE1 3.99Å; C551-F578 HydrophobicContact CB-CE2 3.84Å; C551-F578 HydrophobicContact CB-CZ 3.59Å; C551-F578 WeakPolarHBondContact SG-CE2 3.36Å; C551-K599 CarbonylContact C-O 3.6Å; C551-K599 WeakPolarHBondContact CA-O 3.26Å; C551-C600 HydrophobicContact CB-CB 4.18Å; C551-C600 WeakPolarHBondContact CB-SG 3.46Å; C551-C600 WeakPolarHBondContact SG-CB 3.45Å; C551-C600 CovalentContact SG-SG 2.04Å; C551-C600 PolarHBondContact SG-SG 2.84Å
552	S	91.3	Very high	79	Confident	50 Å²	50	59.8 Å²	59.8	35%	0.35	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	165.4	-172.9	57.9	0	0	0	0	111.2	V598 K599	S552-V598 WeakPolarHBondContact O-CA 3.41Å; S552-K599 PolarHBondContact N-O 3.39Å; S552-K599 PolarHBondContact O-N 2.76Å; S552-K599 PolarHBondContact OG-O 2.86Å
553	L	91	Very high	79.3	Confident	24 Å²	24	56.8 Å²	56.8	13%	0.126	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.9	169.1	-66.2	171.5	0	0	0	109.1	F561 L563 L580 V598	L553-F561 HydrophobicContact CD1-CB 3.84Å; L553-F561 WeakPolarHBondContact CD1-O 3.49Å; L553-L563 HydrophobicContact CD1-CB 4.5Å; L553-L563 HydrophobicContact CG-CB 4.34Å; L553-L580 HydrophobicContact CD1-CD1 4.11Å; L553-L580 HydrophobicContact CD2-CD1 4.07Å; L553-V598 HydrophobicContact CD2-CG2 3.94Å
554	E	84.4	Confident	79.5	Confident	69 Å²	69	59.4 Å²	59.4	32%	0.322	33%	0.328	S	S	.	.			trans	-85.7	134.1	-176.3	-160.8	163.7	-151.7	0	0	111.5	I597 K599 R612	E554-I597 HydrophobicContact CB-CB 4.11Å; E554-I597 HydrophobicContact CB-CG2 4.37Å; E554-I597 PolarHBondContact N-O 2.88Å; E554-K599 HydrophobicContact CB-CB 4.47Å; E554-R612 IonicContact OE1-CZ 2.7Å; E554-R612 IonicContact OE1-NE 3.18Å; E554-R612 PolarHBondContact OE1-NE 2.87Å; E554-R612 IonicContact OE1-NH2 3.18Å; E554-R612 PolarHBondContact OE1-NH2 3.24Å; E554-R612 WeakPolarHBondContact OE2-CD 3.5Å; E554-R612 IonicContact OE2-CZ 3.46Å; E554-R612 IonicContact OE2-NE 2.82Å; E554-R612 PolarHBondContact OE2-NE 3.13Å; E554-R612 IonicContact OE2-NH2 3.44Å
555	G	74.8	Confident	80.4	Confident	55 Å²	55	61.9 Å²	61.9	57%	0.567	34%	0.337	S	S	*	.	S	Bend	trans	81.5	-174.4	-176.3	0	0	0	0	0	114.7	K557	G555-K557 PolarHBondContact O-N 3.09Å
556	D	69	Low	81.1	Confident	106 Å²	106	59.2 Å²	59.2	57%	0.567	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-73.8	16	-172.2	-157.9	33.6	0	0	0	114.4	S558 K559	D556-S558 VanDerWaalsContact C-N 3.28Å; D556-S558 PolarHBondContact O-N 2.81Å; D556-K559 WeakPolarHBondContact OD1-CD 3.38Å; D556-K559 WeakPolarHBondContact OD1-CE 3.32Å; D556-K559 IonicContact OD1-NZ 2.62Å; D556-K559 PolarHBondContact OD1-NZ 2.86Å; D556-K559 IonicContact OD2-NZ 2.64Å; D556-K559 PolarHBondContact OD2-NZ 2.97Å
557	K	67.3	Low	80.9	Confident	63 Å²	63	62.6 Å²	62.6	27%	0.274	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-75	-15.3	-179.6	-65.3	-63.6	-174.1	-176.6	0	113.3	G555 K559 Q560 F561 L596	G555-K557 PolarHBondContact O-N 3.09Å; K557-K559 PolarHBondContact O-N 2.86Å; K557-K559 VanDerWaalsContact O-N 3.12Å; K557-Q560 PolarHBondContact O-N 2.92Å; K557-F561 PolarHBondContact O-N 2.77Å; K557-L596 HydrophobicContact CB-CD2 3.77Å; K557-L596 HydrophobicContact CD-CD2 4Å; K557-L596 HydrophobicContact CG-CD2 3.79Å
558	S	63.3	Low	80.3	Confident	68 Å²	68	60.5 Å²	60.5	48%	0.476	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-60.6	-13.8	173.4	52.5	0	0	0	0	114.5	D556 I583	D556-S558 VanDerWaalsContact C-N 3.28Å; D556-S558 PolarHBondContact O-N 2.81Å; S558-I583 WeakPolarHBondContact O-CD1 3.43Å
559	K	71.9	Confident	79.3	Confident	132 Å²	132	67.5 Å²	67.5	57%	0.574	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-77.3	-19	170.3	-68.5	171.8	179.9	157.8	0	113.9	D556 K557 V584	D556-K559 WeakPolarHBondContact OD1-CD 3.38Å; D556-K559 WeakPolarHBondContact OD1-CE 3.32Å; D556-K559 IonicContact OD1-NZ 2.62Å; D556-K559 PolarHBondContact OD1-NZ 2.86Å; D556-K559 IonicContact OD2-NZ 2.64Å; D556-K559 PolarHBondContact OD2-NZ 2.97Å; K557-K559 PolarHBondContact O-N 2.86Å; K557-K559 VanDerWaalsContact O-N 3.12Å; K559-V584 WeakPolarHBondContact O-CG2 3.28Å
560	Q	78.9	Confident	77.9	Confident	56 Å²	56	77.1 Å²	77.1	26%	0.262	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-28.3	-175.4	-69.8	179.6	-34.3	0	0	112.7	K557 T582 I583 H594	K557-Q560 PolarHBondContact O-N 2.92Å; Q560-T582 PolarHBondContact O-OG1 3.36Å; Q560-I583 PolarHBondContact O-N 3.17Å; Q560-H594 PolarHBondContact OE1-CE1 2.04Å; Q560-H594 VanDerWaalsContact OE1-CE1 3.31Å; Q560-H594 PolarHBondContact OE1-ND1 2.77Å
561	F	88.5	Confident	76.1	Confident	2 Å²	2	81 Å²	81	1%	0.009	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	145.3	-174.7	-56.3	-89.4	0	0	0	111.7	L534 L553 K557 L580 T581 L586 H594 L596 I617	L534-F561 HydrophobicContact CD1-CD1 3.66Å; L534-F561 HydrophobicContact CD1-CE1 3.72Å; L553-F561 HydrophobicContact CD1-CB 3.84Å; L553-F561 WeakPolarHBondContact CD1-O 3.49Å; K557-F561 PolarHBondContact O-N 2.77Å; F561-L580 HydrophobicContact CB-CD1 4.43Å; F561-T581 CarbonylContact C-O 3.54Å; F561-T581 VanDerWaalsContact CA-O 3.32Å; F561-T581 WeakPolarHBondContact CA-O 3.49Å; F561-L586 HydrophobicContact CE1-CD1 4.35Å; F561-L586 HydrophobicContact CE1-CD2 3.99Å; F561-L586 HydrophobicContact CZ-CD1 4.49Å; F561-L586 HydrophobicContact CZ-CD2 3.64Å; F561-H594 HydrophobicContact CE2-CB 4.18Å; F561-H594 AromaticContact CE2-CG 3.93Å; F561-H594 AromaticContact CE2-ND1 3.44Å; F561-H594 WeakPolarHBondContact CE2-ND1 3.5Å; F561-H594 HydrophobicContact CZ-CB 4.12Å; F561-H594 AromaticContact CZ-CG 3.82Å; F561-H594 AromaticContact CZ-ND1 3.69Å; F561-L596 HydrophobicContact CB-CD1 4.18Å; F561-L596 HydrophobicContact CD1-CD1 3.8Å; F561-L596 HydrophobicContact CD2-CD1 3.89Å; F561-L596 HydrophobicContact CD2-CD2 3.59Å; F561-L596 HydrophobicContact CD2-CG 4.36Å; F561-L596 HydrophobicContact CE1-CD1 4.12Å; F561-L596 HydrophobicContact CE2-CD1 4.22Å; F561-L596 HydrophobicContact CE2-CD2 3.82Å; F561-L596 HydrophobicContact CG-CD1 3.67Å; F561-L596 HydrophobicContact CG-CD2 4.2Å; F561-L596 HydrophobicContact CZ-CD1 4.32Å; F561-I617 HydrophobicContact CD1-CD1 4.36Å; F561-I617 HydrophobicContact CE1-CD1 3.72Å; F561-I617 HydrophobicContact CZ-CD1 4.15Å
562	E	87.8	Confident	74.2	Confident	82 Å²	82	85.4 Å²	85.4	38%	0.383	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.2	-179	-149.9	-173.1	149.9	0	0	110.5	K564 T581 I583	E562-K564 VanDerWaalsContact CD-CE 3.47Å; E562-K564 HydrophobicContact CG-CG 4.47Å; E562-K564 WeakPolarHBondContact OE1-CE 3.41Å; E562-K564 IonicContact OE1-NZ 2.77Å; E562-K564 PolarHBondContact OE1-NZ 2.88Å; E562-K564 WeakPolarHBondContact OE2-CE 3.27Å; E562-K564 IonicContact OE2-NZ 2.7Å; E562-K564 PolarHBondContact OE2-NZ 2.95Å; E562-T581 PolarHBondContact N-O 2.85Å; E562-T581 PolarHBondContact O-N 2.75Å; E562-T581 PolarHBondContact O-OG1 3.28Å; E562-T581 VanDerWaalsContact O-OG1 3.12Å; E562-I583 HydrophobicContact CB-CD1 3.85Å; E562-I583 HydrophobicContact CB-CG1 3.76Å; E562-I583 HydrophobicContact CG-CD1 4.3Å
563	L	89.9	Confident	72.6	Confident	31 Å²	31	86.4 Å²	86.4	16%	0.162	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	105.8	178.5	-173.5	72	0	0	0	108.8	V537 C551 L553 F578 L580 V598	V537-L563 HydrophobicContact CB-CD1 4.29Å; V537-L563 HydrophobicContact CG2-CD1 3.74Å; C551-L563 HydrophobicContact CB-CD2 3.92Å; L553-L563 HydrophobicContact CD1-CB 4.5Å; L553-L563 HydrophobicContact CG-CB 4.34Å; L563-F578 HydrophobicContact CD1-CB 3.55Å; L563-F578 HydrophobicContact CD1-CG 4.28Å; L563-F578 HydrophobicContact CD2-CD1 4.35Å; L563-F578 HydrophobicContact CD2-CG 4.4Å; L563-F578 HydrophobicContact CG-CB 3.81Å; L563-F578 HydrophobicContact CG-CD1 4.07Å; L563-F578 HydrophobicContact CG-CG 4.1Å; L563-L580 HydrophobicContact CD1-CB 4.36Å; L563-L580 HydrophobicContact CD1-CD1 4.2Å; L563-V598 HydrophobicContact CD2-CG1 3.99Å
564	K	88.1	Confident	71.7	Confident	70 Å²	70	94 Å²	94	30%	0.304	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	129.4	-174.9	-68.3	-172.6	171.2	90.8	0	111.3	E562 F578 D579	E562-K564 VanDerWaalsContact CD-CE 3.47Å; E562-K564 HydrophobicContact CG-CG 4.47Å; E562-K564 WeakPolarHBondContact OE1-CE 3.41Å; E562-K564 IonicContact OE1-NZ 2.77Å; E562-K564 PolarHBondContact OE1-NZ 2.88Å; E562-K564 WeakPolarHBondContact OE2-CE 3.27Å; E562-K564 IonicContact OE2-NZ 2.7Å; E562-K564 PolarHBondContact OE2-NZ 2.95Å; K564-F578 CarbonylContact O-C 3.43Å; K564-F578 WeakPolarHBondContact O-CA 3.34Å; K564-F578 WeakPolarHBondContact O-CB 2.92Å; K564-D579 PolarHBondContact N-O 2.87Å; K564-D579 PolarHBondContact O-N 2.78Å
565	E	87.7	Confident	71.7	Confident	110 Å²	110	95.5 Å²	95.5	51%	0.514	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	130.1	175.9	-170.4	175	150.7	0	0	111.5	S567 K576 F578	E565-S567 PolarHBondContact O-N 3.38Å; E565-K576 WeakPolarHBondContact OE1-CE 3.48Å; E565-K576 IonicContact OE1-NZ 2.63Å; E565-K576 WeakPolarHBondContact OE2-CE 3.07Å; E565-K576 IonicContact OE2-NZ 3Å; E565-K576 PolarHBondContact OE2-NZ 2.85Å; E565-F578 HydrophobicContact CB-CD1 3.81Å; E565-F578 HydrophobicContact CB-CE1 3.74Å; E565-F578 HydrophobicContact CG-CD1 4.25Å; E565-F578 HydrophobicContact CG-CE1 3.96Å; E565-F578 HydrophobicContact CG-CZ 4.45Å
566	V	83.9	Confident	72.2	Confident	43 Å²	43	93.8 Å²	93.8	26%	0.261	47%	0.466	S	S	.	.			trans	-91.1	96.4	178.8	-175	0	0	0	0	109.2	T568 I577 D579	V566-T568 HydrophobicContact CG1-CG2 4.31Å; V566-T568 PolarHBondContact O-N 2.7Å; V566-I577 HydrophobicContact CB-CB 4.23Å; V566-I577 HydrophobicContact CB-CG2 4.03Å; V566-I577 HydrophobicContact CG2-CG2 3.99Å; V566-I577 PolarHBondContact N-O 3.41Å; V566-D579 HydrophobicContact CG2-CB 4.23Å; V566-D579 WeakPolarHBondContact CG2-OD1 3.45Å; V566-D579 WeakPolarHBondContact CG2-OD2 3.41Å
567	S	66.3	Low	73.2	Confident	106 Å²	106	90.1 Å²	90.1	74%	0.741	45%	0.446	S	S	*	.			trans	-63.2	127.1	175.1	57.8	0	0	0	0	111	E565	E565-S567 PolarHBondContact O-N 3.38Å
568	T	60.4	Low	74.3	Confident	47 Å²	47	87.6 Å²	87.6	29%	0.288	44%	0.435	S	S	.	.			trans	-127.8	126.3	173.7	86.9	0	0	0	0	111.1	V566 R570 Q573	V566-T568 HydrophobicContact CG1-CG2 4.31Å; V566-T568 PolarHBondContact O-N 2.7Å; T568-R570 PolarHBondContact O-N 2.77Å; T568-Q573 PolarHBondContact O-OE1 2.86Å; T568-Q573 PolarHBondContact OG1-OE1 3.29Å
569	N	55.4	Low	75.6	Confident	172 Å²	172	85.5 Å²	85.5	92%	0.92	42%	0.419	S	S	*	.			trans	-76.7	50.7	178.6	-68.5	-12.6	0	0	0	112
570	R	55.7	Low	76.5	Confident	202 Å²	202	79.2 Å²	79.2	76%	0.762	39%	0.391	S	S	*	.			trans	-118.7	108.4	178.9	-69.4	-172.3	177.5	-179	2.8	109.8	T568 V572 Q573	T568-R570 PolarHBondContact O-N 2.77Å; R570-V572 PolarHBondContact O-N 2.86Å; R570-Q573 PolarHBondContact O-N 3.39Å
571	L	50.4	Low	76.9	Confident	184 Å²	184	76.7 Å²	76.7	96%	0.963	38%	0.38	S	S	*	.	S	Bend	trans	-57.8	1.3	-174.3	-68.5	162.8	0	0	0	116.6
572	V	52.4	Low	76.7	Confident	121 Å²	121	77.5 Å²	77.5	73%	0.733	39%	0.385	S	S	*	.			trans	-143.1	73.1	172.4	-169.2	0	0	0	0	109.1	R570	R570-V572 PolarHBondContact O-N 2.86Å
573	Q	58	Low	76.2	Confident	72 Å²	72	77.9 Å²	77.9	34%	0.336	39%	0.389	S	S	.	.			trans	-73.7	124.5	164.5	-82.1	-174.8	-113.9	0	0	109.2	L546 T568 R570 R575	L546-Q573 HydrophobicContact CD1-CB 4.45Å; L546-Q573 VanDerWaalsContact CD1-O 3.26Å; L546-Q573 WeakPolarHBondContact CD1-O 3.29Å; T568-Q573 PolarHBondContact O-OE1 2.86Å; T568-Q573 PolarHBondContact OG1-OE1 3.29Å; R570-Q573 PolarHBondContact O-N 3.39Å; Q573-R575 PolarHBondContact NE2-O 2.9Å; Q573-R575 VanDerWaalsContact NE2-O 3.11Å
574	K	72	Confident	75.6	Confident	183 Å²	183	80 Å²	80	80%	0.796	40%	0.402	S	S	*	.	S	Bend	trans	-96.3	9.3	169.5	-70.7	-155.2	170.7	-143.6	0	113.4
575	R	83.2	Confident	75.2	Confident	101 Å²	101	81.3 Å²	81.3	38%	0.381	41%	0.413	S	S	.	.	S	Bend	trans	-162.4	148.4	174.9	69.9	-172.3	-170.1	-149.4	1.6	110.4	H538 V539 T540 L546 Q573 I577	H538-R575 PolarHBondContact CE1-NH2 2.78Å; H538-R575 PolarHBondContact NE2-NH2 3.09Å; H538-R575 VanDerWaalsContact NE2-NH2 3.15Å; V539-R575 CarbonylContact O-C 3.51Å; V539-R575 WeakPolarHBondContact O-CA 3.26Å; V539-R575 WeakPolarHBondContact O-CB 3.38Å; T540-R575 HydrophobicContact CG2-CB 3.57Å; L546-R575 VanDerWaalsContact CD1-N 3.34Å; Q573-R575 PolarHBondContact NE2-O 2.9Å; Q573-R575 VanDerWaalsContact NE2-O 3.11Å; R575-I577 HydrophobicContact CG-CD1 4.34Å; R575-I577 HydrophobicContact CG-CG1 4.01Å
576	K	85.9	Confident	75.1	Confident	19 Å²	19	76.7 Å²	76.7	8%	0.083	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	149	165.2	-150.9	161.7	-174.5	166	0	108.9	V539 I549 E565 F578	V539-K576 HydrophobicContact CB-CB 4.32Å; V539-K576 PolarHBondContact N-O 3.12Å; V539-K576 PolarHBondContact O-N 3.48Å; I549-K576 HydrophobicContact CB-CD 4.23Å; I549-K576 PolarHBondContact O-NZ 3.26Å; E565-K576 WeakPolarHBondContact OE1-CE 3.48Å; E565-K576 IonicContact OE1-NZ 2.63Å; E565-K576 WeakPolarHBondContact OE2-CE 3.07Å; E565-K576 IonicContact OE2-NZ 3Å; E565-K576 PolarHBondContact OE2-NZ 2.85Å; K576-F578 HydrophobicContact CB-CE2 4.1Å; K576-F578 HydrophobicContact CD-CE2 4.03Å; K576-F578 HydrophobicContact CD-CZ 3.78Å; K576-F578 HydrophobicContact CG-CE2 3.74Å; K576-F578 HydrophobicContact CG-CZ 3.88Å
577	I	89.2	Confident	75.2	Confident	29 Å²	29	77.8 Å²	77.8	15%	0.149	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	132.5	-175.9	-55.2	-172.5	0	0	0	108.1	V537 V566 R575	V537-I577 WeakPolarHBondContact O-CA 3.45Å; V566-I577 HydrophobicContact CB-CB 4.23Å; V566-I577 HydrophobicContact CB-CG2 4.03Å; V566-I577 HydrophobicContact CG2-CG2 3.99Å; V566-I577 PolarHBondContact N-O 3.41Å; R575-I577 HydrophobicContact CG-CD1 4.34Å; R575-I577 HydrophobicContact CG-CG1 4.01Å
578	F	91	Very high	76.4	Confident	9 Å²	9	74 Å²	74	4%	0.039	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.9	174	-55.8	-100.4	0	0	0	110.4	H536 V537 V539 C551 L563 K564 E565 K576	H536-F578 CarbonylContact C-O 3.55Å; H536-F578 WeakPolarHBondContact CA-O 3.04Å; V537-F578 HydrophobicContact CB-CB 4.32Å; V537-F578 PolarHBondContact N-O 2.85Å; V537-F578 PolarHBondContact O-N 2.88Å; V539-F578 HydrophobicContact CG2-CD2 4.04Å; V539-F578 HydrophobicContact CG2-CE2 3.89Å; C551-F578 HydrophobicContact CB-CD2 4.45Å; C551-F578 HydrophobicContact CB-CE1 3.99Å; C551-F578 HydrophobicContact CB-CE2 3.84Å; C551-F578 HydrophobicContact CB-CZ 3.59Å; C551-F578 WeakPolarHBondContact SG-CE2 3.36Å; L563-F578 HydrophobicContact CD1-CB 3.55Å; L563-F578 HydrophobicContact CD1-CG 4.28Å; L563-F578 HydrophobicContact CD2-CD1 4.35Å; L563-F578 HydrophobicContact CD2-CG 4.4Å; L563-F578 HydrophobicContact CG-CB 3.81Å; L563-F578 HydrophobicContact CG-CD1 4.07Å; L563-F578 HydrophobicContact CG-CG 4.1Å; K564-F578 CarbonylContact O-C 3.43Å; K564-F578 WeakPolarHBondContact O-CA 3.34Å; K564-F578 WeakPolarHBondContact O-CB 2.92Å; E565-F578 HydrophobicContact CB-CD1 3.81Å; E565-F578 HydrophobicContact CB-CE1 3.74Å; E565-F578 HydrophobicContact CG-CD1 4.25Å; E565-F578 HydrophobicContact CG-CE1 3.96Å; E565-F578 HydrophobicContact CG-CZ 4.45Å; K576-F578 HydrophobicContact CB-CE2 4.1Å; K576-F578 HydrophobicContact CD-CE2 4.03Å; K576-F578 HydrophobicContact CD-CZ 3.78Å; K576-F578 HydrophobicContact CG-CE2 3.74Å; K576-F578 HydrophobicContact CG-CZ 3.88Å
579	D	90.4	Very high	77.8	Confident	24 Å²	24	74 Å²	74	13%	0.128	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.5	168.4	-70.7	-22.6	0	0	0	109.2	I533 H536 K564 V566 T581	I533-D579 HydrophobicContact CD1-CB 4.26Å; I533-D579 WeakPolarHBondContact CD1-OD2 3.11Å; I533-D579 HydrophobicContact CG1-CB 4.13Å; I533-D579 HydrophobicContact CG2-CB 4.17Å; H536-D579 IonicContact CE1-OD1 2.82Å; H536-D579 PolarHBondContact CE1-OD1 3.38Å; H536-D579 IonicContact CG-OD1 2.71Å; H536-D579 IonicContact ND1-OD1 3.74Å; H536-D579 PolarHBondContact ND1-OD1 2.81Å; K564-D579 PolarHBondContact N-O 2.87Å; K564-D579 PolarHBondContact O-N 2.78Å; V566-D579 HydrophobicContact CG2-CB 4.23Å; V566-D579 WeakPolarHBondContact CG2-OD1 3.45Å; V566-D579 WeakPolarHBondContact CG2-OD2 3.41Å; D579-T581 HydrophobicContact CB-CG2 4.41Å
580	L	90.7	Very high	79.3	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	120.2	170.4	-175.5	66.9	0	0	0	108.7	L534 C535 V537 L553 F561 L563 L596 L615	L534-L580 PolarHBondContact N-O 3.26Å; C535-L580 WeakPolarHBondContact O-CB 3.39Å; C535-L580 PolarHBondContact O-N 3.39Å; V537-L580 HydrophobicContact CG2-CB 4.2Å; L553-L580 HydrophobicContact CD1-CD1 4.11Å; L553-L580 HydrophobicContact CD2-CD1 4.07Å; F561-L580 HydrophobicContact CB-CD1 4.43Å; L563-L580 HydrophobicContact CD1-CB 4.36Å; L563-L580 HydrophobicContact CD1-CD1 4.2Å; L580-L596 HydrophobicContact CD1-CD1 4.49Å; L580-L596 HydrophobicContact CD2-CD1 4.03Å; L580-L615 HydrophobicContact CD2-CD2 3.46Å; L580-L615 VanDerWaalsContact CD2-CD2 3.46Å
581	T	87.2	Confident	80.7	Confident	4 Å²	4	63 Å²	63	3%	0.025	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	157.7	-174.2	56.8	0	0	0	0	110.7	Q532 I533 F561 E562 D579	Q532-T581 WeakPolarHBondContact O-CA 3.46Å; Q532-T581 WeakPolarHBondContact O-CB 3.42Å; I533-T581 HydrophobicContact CG1-CG2 4.15Å; F561-T581 CarbonylContact C-O 3.54Å; F561-T581 VanDerWaalsContact CA-O 3.32Å; F561-T581 WeakPolarHBondContact CA-O 3.49Å; E562-T581 PolarHBondContact N-O 2.85Å; E562-T581 PolarHBondContact O-N 2.75Å; E562-T581 PolarHBondContact O-OG1 3.28Å; E562-T581 VanDerWaalsContact O-OG1 3.12Å; D579-T581 HydrophobicContact CB-CG2 4.41Å
582	T	84.8	Confident	82.6	Confident	18 Å²	18	57.4 Å²	57.4	11%	0.11	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	140.3	171.2	-160.9	0	0	0	0	110.8	F524 L534 Q560 V584	F524-T582 HydrophobicContact CD2-CG2 4.4Å; L534-T582 HydrophobicContact CD2-CG2 4.45Å; Q560-T582 PolarHBondContact O-OG1 3.36Å; T582-V584 PolarHBondContact OG1-O 2.82Å
583	I	77.7	Confident	84.4	Confident	90 Å²	90	57.8 Å²	57.8	46%	0.462	29%	0.291	S	S	.	.	S	Bend	trans	-96.6	-34.6	-179.2	-54.6	171.9	0	0	0	110.5	S558 Q560 E562	S558-I583 WeakPolarHBondContact O-CD1 3.43Å; Q560-I583 PolarHBondContact O-N 3.17Å; E562-I583 HydrophobicContact CB-CD1 3.85Å; E562-I583 HydrophobicContact CB-CG1 3.76Å; E562-I583 HydrophobicContact CG-CD1 4.3Å
584	V	77.8	Confident	85.8	Confident	75 Å²	75	54.5 Å²	54.5	46%	0.455	28%	0.276	S	S	.	.	S	Bend	trans	-114.7	153.7	-176.4	-172.4	0	0	0	0	107.7	K559 T582 L586	K559-V584 WeakPolarHBondContact O-CG2 3.28Å; T582-V584 PolarHBondContact OG1-O 2.82Å; V584-L586 PolarHBondContact O-N 3.48Å
585	L	79.1	Confident	86.7	Confident	99 Å²	99	48.3 Å²	48.3	52%	0.518	25%	0.254	S	S	.	.			trans	-60.6	135.7	168.3	-65.5	171.5	0	0	0	109.3
586	L	84.5	Confident	87	Confident	12 Å²	12	43.6 Å²	43.6	6%	0.063	24%	0.236	C	C	.	.			trans	-81.2	141.5	170.5	-56.8	-177.6	0	0	0	108.7	E521 N522 F561 V584 V619	E521-L586 VanDerWaalsContact CB-O 3.32Å; E521-L586 WeakPolarHBondContact CB-O 3.37Å; N522-L586 PolarHBondContact N-O 3.4Å; F561-L586 HydrophobicContact CE1-CD1 4.35Å; F561-L586 HydrophobicContact CE1-CD2 3.99Å; F561-L586 HydrophobicContact CZ-CD1 4.49Å; F561-L586 HydrophobicContact CZ-CD2 3.64Å; V584-L586 PolarHBondContact O-N 3.48Å; L586-V619 HydrophobicContact CB-CG1 4.47Å
587	D	87.5	Confident	87.2	Confident	67 Å²	67	44.8 Å²	44.8	36%	0.358	24%	0.243	S	C	.	.			trans	-144.2	121.5	-169.1	161.8	-33.6	0	0	0	105.2	E589 V590 V591	D587-E589 PolarHBondContact OD1-N 2.8Å; D587-V590 VanDerWaalsContact OD1-CB 3.26Å; D587-V590 WeakPolarHBondContact OD1-CB 3.22Å; D587-V590 VanDerWaalsContact OD1-CG2 3.23Å; D587-V590 WeakPolarHBondContact OD1-CG2 3.37Å; D587-V590 PolarHBondContact OD1-N 2.82Å; D587-V590 WeakPolarHBondContact OD2-CG2 3.34Å; D587-V591 PolarHBondContact O-N 2.8Å; D587-V591 VanDerWaalsContact O-N 3.11Å
588	R	90.8	Very high	87.3	Confident	25 Å²	25	43.4 Å²	43.4	9%	0.094	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-33.8	-168.6	-173.5	-157.3	68.8	84.2	2.5	111.7	E521 V590 V591 P592 V619 D621 L670 D671 I672	E521-R588 WeakPolarHBondContact OE1-CB 3.22Å; E521-R588 WeakPolarHBondContact OE2-CB 3.33Å; E521-R588 PolarHBondContact OE2-N 2.8Å; R588-V590 VanDerWaalsContact C-N 3.28Å; R588-V590 PolarHBondContact O-N 3.46Å; R588-V591 CarbonylContact O-C 3.5Å; R588-V591 PolarHBondContact O-N 2.78Å; R588-P592 HydrophobicContact CG-CB 3.97Å; R588-P592 WeakPolarHBondContact O-CA 3.3Å; R588-P592 VanDerWaalsContact O-CD 3.26Å; R588-P592 WeakPolarHBondContact O-CD 3.35Å; R588-P592 VanDerWaalsContact O-N 3.07Å; R588-V619 HydrophobicContact CB-CB 4.27Å; R588-V619 HydrophobicContact CB-CG1 3.82Å; R588-V619 HydrophobicContact CG-CB 4.29Å; R588-V619 HydrophobicContact CG-CG1 4.31Å; R588-D621 IonicContact CZ-OD1 3.75Å; R588-D621 IonicContact NE-OD1 3.52Å; R588-D621 PolarHBondContact NE-OD1 2.81Å; R588-D621 IonicContact NH2-OD1 3.49Å; R588-L670 PolarHBondContact NH2-O 2.8Å; R588-D671 PolarHBondContact NH2-O 2.8Å; R588-I672 VanDerWaalsContact NH1-CG2 3.31Å
589	E	89.7	Confident	87.4	Confident	49 Å²	49	45.1 Å²	45.1	23%	0.229	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-33.3	-179.9	-68.4	63.7	-127.6	0	0	110.8	D587 N625 L670	D587-E589 PolarHBondContact OD1-N 2.8Å; E589-N625 VanDerWaalsContact CD-ND2 3.32Å; E589-N625 WeakPolarHBondContact CG-ND2 3.38Å; E589-N625 PolarHBondContact OE2-ND2 2.95Å; E589-L670 HydrophobicContact CB-CB 4.43Å; E589-L670 HydrophobicContact CG-CB 3.63Å
590	V	86.9	Confident	87.4	Confident	109 Å²	109	44 Å²	44	66%	0.661	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-43.7	172.2	-176.6	0	0	0	0	111.5	D587 R588	D587-V590 VanDerWaalsContact OD1-CB 3.26Å; D587-V590 WeakPolarHBondContact OD1-CB 3.22Å; D587-V590 VanDerWaalsContact OD1-CG2 3.23Å; D587-V590 WeakPolarHBondContact OD1-CG2 3.37Å; D587-V590 PolarHBondContact OD1-N 2.82Å; D587-V590 WeakPolarHBondContact OD2-CG2 3.34Å; R588-V590 VanDerWaalsContact C-N 3.28Å; R588-V590 PolarHBondContact O-N 3.46Å
591	V	86.5	Confident	87.4	Confident	33 Å²	33	46 Å²	46	20%	0.2	25%	0.247	C	C	.	.			trans	-144.8	99.5	176.4	-171.3	0	0	0	0	112.9	D587 R588 Q593 V619	D587-V591 PolarHBondContact O-N 2.8Å; D587-V591 VanDerWaalsContact O-N 3.11Å; R588-V591 CarbonylContact O-C 3.5Å; R588-V591 PolarHBondContact O-N 2.78Å; V591-Q593 VanDerWaalsContact C-N 3.29Å; V591-Q593 WeakPolarHBondContact CG1-O 3.31Å; V591-Q593 PolarHBondContact O-N 3.25Å; V591-V619 WeakPolarHBondContact O-CG2 3.44Å
592	P	89.5	Confident	87.3	Confident	67 Å²	67	46.1 Å²	46.1	44%	0.435	25%	0.247	S	C	.	.	S	Bend	trans	-74.8	-15.4	-177.7	28.5	-35.1	0	0	0	114	R588 V619	R588-P592 HydrophobicContact CG-CB 3.97Å; R588-P592 WeakPolarHBondContact O-CA 3.3Å; R588-P592 VanDerWaalsContact O-CD 3.26Å; R588-P592 WeakPolarHBondContact O-CD 3.35Å; R588-P592 VanDerWaalsContact O-N 3.07Å; P592-V619 PolarHBondContact O-N 3.39Å
593	Q	90	Very high	86.8	Confident	128 Å²	128	45.7 Å²	45.7	60%	0.598	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-150.1	136.8	177.6	55.8	174.7	-16.8	0	0	112.8	V591 I617	V591-Q593 VanDerWaalsContact C-N 3.29Å; V591-Q593 WeakPolarHBondContact CG1-O 3.31Å; V591-Q593 PolarHBondContact O-N 3.25Å; Q593-I617 CarbonylContact C-O 3.56Å; Q593-I617 VanDerWaalsContact CA-O 3.28Å; Q593-I617 WeakPolarHBondContact CA-O 3.36Å
594	H	88	Confident	86.4	Confident	3 Å²	3	46.8 Å²	46.8	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.5	173.7	-54.2	-116.8	0	0	0	109.7	Q560 F561 L596 I617	Q560-H594 PolarHBondContact OE1-CE1 2.04Å; Q560-H594 VanDerWaalsContact OE1-CE1 3.31Å; Q560-H594 PolarHBondContact OE1-ND1 2.77Å; F561-H594 HydrophobicContact CE2-CB 4.18Å; F561-H594 AromaticContact CE2-CG 3.93Å; F561-H594 AromaticContact CE2-ND1 3.44Å; F561-H594 WeakPolarHBondContact CE2-ND1 3.5Å; F561-H594 HydrophobicContact CZ-CB 4.12Å; F561-H594 AromaticContact CZ-CG 3.82Å; F561-H594 AromaticContact CZ-ND1 3.69Å; H594-L596 HydrophobicContact CB-CD2 4.42Å; H594-I617 HydrophobicContact CB-CB 4.35Å; H594-I617 PolarHBondContact N-O 2.56Å; H594-I617 PolarHBondContact O-N 2.78Å
595	T	89.6	Confident	86	Confident	54 Å²	54	47.3 Å²	47.3	33%	0.331	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.9	159.8	-53.3	0	0	0	0	108.2	Q614 L615 H616	T595-Q614 HydrophobicContact CG2-CB 4.37Å; T595-L615 WeakPolarHBondContact CA-O 3.35Å; T595-H616 PolarHBondContact OG1-ND1 3.4Å
596	L	89.7	Confident	85.4	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.4	173.8	-58.9	-177.6	0	0	0	109.1	K557 F561 L580 H594 Q614 L615 I617	K557-L596 HydrophobicContact CB-CD2 3.77Å; K557-L596 HydrophobicContact CD-CD2 4Å; K557-L596 HydrophobicContact CG-CD2 3.79Å; F561-L596 HydrophobicContact CB-CD1 4.18Å; F561-L596 HydrophobicContact CD1-CD1 3.8Å; F561-L596 HydrophobicContact CD2-CD1 3.89Å; F561-L596 HydrophobicContact CD2-CD2 3.59Å; F561-L596 HydrophobicContact CD2-CG 4.36Å; F561-L596 HydrophobicContact CE1-CD1 4.12Å; F561-L596 HydrophobicContact CE2-CD1 4.22Å; F561-L596 HydrophobicContact CE2-CD2 3.82Å; F561-L596 HydrophobicContact CG-CD1 3.67Å; F561-L596 HydrophobicContact CG-CD2 4.2Å; F561-L596 HydrophobicContact CZ-CD1 4.32Å; L580-L596 HydrophobicContact CD1-CD1 4.49Å; L580-L596 HydrophobicContact CD2-CD1 4.03Å; H594-L596 HydrophobicContact CB-CD2 4.42Å; L596-Q614 CarbonylContact O-C 3.46Å; L596-Q614 WeakPolarHBondContact O-CA 3.17Å; L596-L615 PolarHBondContact N-O 3.21Å; L596-L615 PolarHBondContact O-N 2.79Å; L596-I617 HydrophobicContact CD1-CD1 3.57Å; L596-I617 HydrophobicContact CD1-CG1 4.45Å; L596-I617 HydrophobicContact CG-CD1 4.28Å
597	I	90.9	Very high	84.8	Confident	45 Å²	45	55.6 Å²	55.6	23%	0.231	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.9	174.1	-49.1	-177.6	0	0	0	107.1	E554 R612 Q614	E554-I597 HydrophobicContact CB-CB 4.11Å; E554-I597 HydrophobicContact CB-CG2 4.37Å; E554-I597 PolarHBondContact N-O 2.88Å; I597-R612 HydrophobicContact CG2-CB 4.29Å; I597-R612 HydrophobicContact CG2-CG 4.33Å; I597-Q614 HydrophobicContact CG1-CG 4.1Å
598	V	91.7	Very high	84.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.5	167.6	-176.4	0	0	0	0	107.4	I501 F503 V537 S552 L553 L563 R612 N613	I501-V598 HydrophobicContact CD1-CB 4.25Å; I501-V598 HydrophobicContact CD1-CG1 4.06Å; I501-V598 VanDerWaalsContact CD1-O 3.28Å; I501-V598 WeakPolarHBondContact CD1-O 3.15Å; I501-V598 HydrophobicContact CG2-CB 4.27Å; I501-V598 HydrophobicContact CG2-CG1 4.36Å; F503-V598 HydrophobicContact CE1-CG2 3.7Å; F503-V598 HydrophobicContact CZ-CB 4.43Å; F503-V598 HydrophobicContact CZ-CG2 3.9Å; V537-V598 HydrophobicContact CG1-CG1 4.38Å; V537-V598 HydrophobicContact CG2-CG2 4.45Å; S552-V598 WeakPolarHBondContact O-CA 3.41Å; L553-V598 HydrophobicContact CD2-CG2 3.94Å; L563-V598 HydrophobicContact CD2-CG1 3.99Å; V598-R612 WeakPolarHBondContact O-CA 3.29Å; V598-N613 PolarHBondContact N-O 2.87Å; V598-N613 PolarHBondContact O-N 2.73Å
599	K	92.1	Very high	84.3	Confident	44 Å²	44	55.3 Å²	55.3	19%	0.191	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.9	174.4	-176.2	-139.6	177.1	-161.7	0	108.7	C551 S552 E554 V610 G611 R612	C551-K599 CarbonylContact C-O 3.6Å; C551-K599 WeakPolarHBondContact CA-O 3.26Å; S552-K599 PolarHBondContact N-O 3.39Å; S552-K599 PolarHBondContact O-N 2.76Å; S552-K599 PolarHBondContact OG-O 2.86Å; E554-K599 HydrophobicContact CB-CB 4.47Å; K599-V610 HydrophobicContact CD-CG1 4.02Å; K599-V610 HydrophobicContact CG-CG1 3.41Å; K599-V610 VanDerWaalsContact CG-CG1 3.41Å; K599-G611 WeakPolarHBondContact CA-O 3.26Å; K599-R612 HydrophobicContact CG-CG 4.44Å
600	C	91.5	Very high	84.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.7	172	-65.4	0	0	0	0	110.3	P499 I501 V539 I549 Q550 C551 V610 G611	P499-C600 HydrophobicContact CB-CB 3.87Å; P499-C600 HydrophobicContact CG-CB 4.43Å; I501-C600 HydrophobicContact CD1-CB 3.89Å; I501-C600 HydrophobicContact CG1-CB 4.18Å; V539-C600 HydrophobicContact CG1-CB 4.21Å; I549-C600 HydrophobicContact CG2-CB 4.23Å; Q550-C600 CarbonylContact O-C 3.55Å; Q550-C600 VanDerWaalsContact O-CA 3.32Å; Q550-C600 WeakPolarHBondContact O-CA 3.29Å; C551-C600 HydrophobicContact CB-CB 4.18Å; C551-C600 WeakPolarHBondContact CB-SG 3.46Å; C551-C600 WeakPolarHBondContact SG-CB 3.45Å; C551-C600 CovalentContact SG-SG 2.04Å; C551-C600 PolarHBondContact SG-SG 2.84Å; C600-V610 CarbonylContact O-C 3.57Å; C600-V610 WeakPolarHBondContact O-CA 3.44Å; C600-G611 PolarHBondContact N-O 2.78Å; C600-G611 PolarHBondContact O-N 3.01Å
601	Q	89.8	Confident	84.4	Confident	44 Å²	44	50.5 Å²	50.5	21%	0.206	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	143.6	177.8	70.4	-172.7	48.9	0	0	110.4	I549 Q550 G603 L609 V610	I549-Q601 CarbonylContact C-O 3.55Å; I549-Q601 VanDerWaalsContact CA-O 3.28Å; I549-Q601 WeakPolarHBondContact CA-O 3.49Å; Q550-Q601 HydrophobicContact CB-CG 4.06Å; Q550-Q601 PolarHBondContact N-O 2.83Å; Q550-Q601 PolarHBondContact O-N 2.78Å; Q601-G603 PolarHBondContact NE2-O 3.32Å; Q601-G603 VanDerWaalsContact NE2-O 3.09Å; Q601-G603 PolarHBondContact O-N 3.32Å; Q601-L609 WeakPolarHBondContact CA-O 3.3Å; Q601-V610 HydrophobicContact CB-CG2 4.31Å
602	D	84.9	Confident	84.7	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.027	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	63.8	-175.4	44.1	32	0	0	0	111.6	N495 P499 S608 L609	N495-D602 PolarHBondContact ND2-OD1 2.77Å; N495-D602 PolarHBondContact ND2-OD2 3.33Å; N495-D602 WeakPolarHBondContact OD1-CB 3.2Å; N495-D602 PolarHBondContact OD1-OD2 2.89Å; P499-D602 VanDerWaalsContact CD-OD2 3.24Å; P499-D602 WeakPolarHBondContact CD-OD2 3.3Å; P499-D602 HydrophobicContact CG-CB 4.04Å; D602-S608 PolarHBondContact N-OG 3.36Å; D602-S608 VanDerWaalsContact OD1-C 3.24Å; D602-S608 WeakPolarHBondContact OD1-CA 3.18Å; D602-S608 WeakPolarHBondContact OD1-CB 3.26Å; D602-S608 PolarHBondContact OD1-OG 3.34Å; D602-L609 PolarHBondContact OD1-N 3.16Å; D602-L609 WeakPolarHBondContact OD2-CB 3.23Å; D602-L609 PolarHBondContact OD2-N 2.97Å
603	G	75.3	Confident	84.8	Confident	10 Å²	10	53.7 Å²	53.7	10%	0.103	28%	0.284	C	S	.	.	S	Bend	trans	103.7	-139.3	177.8	0	0	0	0	0	114.3	S548 Q601	S548-G603 WeakPolarHBondContact O-CA 3.25Å; S548-G603 PolarHBondContact O-N 3.41Å; Q601-G603 PolarHBondContact NE2-O 3.32Å; Q601-G603 VanDerWaalsContact NE2-O 3.09Å; Q601-G603 PolarHBondContact O-N 3.32Å
604	T	68.7	Low	84.8	Confident	112 Å²	112	51.8 Å²	51.8	69%	0.687	28%	0.275	S	S	*	.	S	Bend	trans	-145.8	1.9	-162.7	56	0	0	0	0	115.9
605	T	69	Low	85	Confident	87 Å²	87	51.6 Å²	51.6	53%	0.534	28%	0.275	S	S	.	.	S	Bend	trans	-88.9	166.3	179.5	47	0	0	0	0	112.2	S607 S608	T605-S607 PolarHBondContact O-N 3.42Å; T605-S607 VanDerWaalsContact O-N 3.13Å; T605-S607 PolarHBondContact OG1-OG 3Å; T605-S608 VanDerWaalsContact O-CB 3.23Å; T605-S608 WeakPolarHBondContact O-CB 3.43Å; T605-S608 PolarHBondContact O-N 2.79Å
606	E	65.9	Low	85.1	Confident	211 Å²	211	50.8 Å²	50.8	99%	0.986	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.7	173.7	-61.7	-171.7	154.4	0	0	113.6	S608	E606-S608 VanDerWaalsContact C-N 3.32Å
607	S	72.1	Confident	85.1	Confident	73 Å²	73	50.8 Å²	50.8	51%	0.51	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.2	173.4	64.2	0	0	0	0	114.2	T605	T605-S607 PolarHBondContact O-N 3.42Å; T605-S607 VanDerWaalsContact O-N 3.13Å; T605-S607 PolarHBondContact OG1-OG 3Å
608	S	82.1	Confident	85.1	Confident	26 Å²	26	51.4 Å²	51.4	18%	0.182	27%	0.27	C	S	.	.			trans	-72.8	127.6	-175.5	-178.4	0	0	0	0	111.5	D602 T605 E606	D602-S608 PolarHBondContact N-OG 3.36Å; D602-S608 VanDerWaalsContact OD1-C 3.24Å; D602-S608 WeakPolarHBondContact OD1-CA 3.18Å; D602-S608 WeakPolarHBondContact OD1-CB 3.26Å; D602-S608 PolarHBondContact OD1-OG 3.34Å; T605-S608 VanDerWaalsContact O-CB 3.23Å; T605-S608 WeakPolarHBondContact O-CB 3.43Å; T605-S608 PolarHBondContact O-N 2.79Å; E606-S608 VanDerWaalsContact C-N 3.32Å
609	L	86.6	Confident	85	Confident	61 Å²	61	51.8 Å²	51.8	32%	0.319	27%	0.273	S	S	.	.			trans	-90.5	167.1	173.6	-59.9	-179.5	0	0	0	111.6	N495 D496 A498 Q601 D602	N495-L609 WeakPolarHBondContact ND2-CG 3.27Å; D496-L609 VanDerWaalsContact C-CD1 3.41Å; D496-L609 VanDerWaalsContact O-CD1 3.23Å; D496-L609 WeakPolarHBondContact O-CD1 3.27Å; A498-L609 HydrophobicContact CB-CB 3.68Å; A498-L609 HydrophobicContact CB-CD1 4.21Å; Q601-L609 WeakPolarHBondContact CA-O 3.3Å; D602-L609 PolarHBondContact OD1-N 3.16Å; D602-L609 WeakPolarHBondContact OD2-CB 3.23Å; D602-L609 PolarHBondContact OD2-N 2.97Å
610	V	89.7	Confident	84.8	Confident	50 Å²	50	53.4 Å²	53.4	30%	0.303	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	100.5	-169.4	179.6	0	0	0	0	111	K599 C600 Q601 R612	K599-V610 HydrophobicContact CD-CG1 4.02Å; K599-V610 HydrophobicContact CG-CG1 3.41Å; K599-V610 VanDerWaalsContact CG-CG1 3.41Å; C600-V610 CarbonylContact O-C 3.57Å; C600-V610 WeakPolarHBondContact O-CA 3.44Å; Q601-V610 HydrophobicContact CB-CG2 4.31Å; V610-R612 HydrophobicContact CG1-CG 4.22Å
611	G	89.3	Confident	84.7	Confident	6 Å²	6	54.8 Å²	54.8	6%	0.062	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	134.9	165.5	0	0	0	0	0	111.6	P499 K599 C600	P499-G611 VanDerWaalsContact O-CA 3.27Å; P499-G611 WeakPolarHBondContact O-CA 3.31Å; K599-G611 WeakPolarHBondContact CA-O 3.26Å; C600-G611 PolarHBondContact N-O 2.78Å; C600-G611 PolarHBondContact O-N 3.01Å
612	R	92.1	Very high	84.7	Confident	135 Å²	135	57.3 Å²	57.3	51%	0.509	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.9	170.8	-72	-176.9	174.3	90.3	-7.5	110.6	E554 I597 V598 K599 V610	E554-R612 IonicContact OE1-CZ 2.7Å; E554-R612 IonicContact OE1-NE 3.18Å; E554-R612 PolarHBondContact OE1-NE 2.87Å; E554-R612 IonicContact OE1-NH2 3.18Å; E554-R612 PolarHBondContact OE1-NH2 3.24Å; E554-R612 WeakPolarHBondContact OE2-CD 3.5Å; E554-R612 IonicContact OE2-CZ 3.46Å; E554-R612 IonicContact OE2-NE 2.82Å; E554-R612 PolarHBondContact OE2-NE 3.13Å; E554-R612 IonicContact OE2-NH2 3.44Å; I597-R612 HydrophobicContact CG2-CB 4.29Å; I597-R612 HydrophobicContact CG2-CG 4.33Å; V598-R612 WeakPolarHBondContact O-CA 3.29Å; K599-R612 HydrophobicContact CG-CG 4.44Å; V610-R612 HydrophobicContact CG1-CG 4.22Å
613	N	91.5	Very high	84.9	Confident	32 Å²	32	58.1 Å²	58.1	17%	0.171	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	152	164.9	-157.2	-11.8	0	0	0	110.5	I501 F503 V598	I501-N613 HydrophobicContact CB-CB 3.86Å; I501-N613 HydrophobicContact CG2-CB 3.99Å; I501-N613 PolarHBondContact O-ND2 3.01Å; F503-N613 HydrophobicContact CE2-CB 3.83Å; F503-N613 HydrophobicContact CZ-CB 4.33Å; V598-N613 PolarHBondContact N-O 2.87Å; V598-N613 PolarHBondContact O-N 2.73Å
614	Q	91.3	Very high	85.5	Confident	88 Å²	88	61 Å²	61	41%	0.411	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.7	-172.8	-53	-162.8	-12.9	0	0	111.2	F503 T595 L596 I597	F503-Q614 WeakPolarHBondContact CE2-O 3.31Å; T595-Q614 HydrophobicContact CG2-CB 4.37Å; L596-Q614 CarbonylContact O-C 3.46Å; L596-Q614 WeakPolarHBondContact O-CA 3.17Å; I597-Q614 HydrophobicContact CG1-CG 4.1Å
615	L	91.5	Very high	86.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.9	172.6	178.3	69.3	0	0	0	109	F503 L510 A515 I517 L580 T595 L596 I617	F503-L615 HydrophobicContact CD1-CB 4.24Å; F503-L615 HydrophobicContact CD1-CD1 4.41Å; F503-L615 HydrophobicContact CD1-CD2 4.26Å; F503-L615 HydrophobicContact CD2-CB 4.48Å; F503-L615 HydrophobicContact CE1-CB 3.88Å; F503-L615 HydrophobicContact CE1-CD2 4.36Å; F503-L615 HydrophobicContact CE2-CB 4.13Å; F503-L615 HydrophobicContact CG-CD1 4.28Å; F503-L615 HydrophobicContact CZ-CB 3.82Å; L510-L615 HydrophobicContact CD1-CD1 3.71Å; A515-L615 HydrophobicContact CB-CD1 4.03Å; A515-L615 WeakPolarHBondContact O-CA 3.26Å; I517-L615 HydrophobicContact CD1-CD1 4.45Å; I517-L615 HydrophobicContact CD1-CD2 4.06Å; I517-L615 HydrophobicContact CG1-CD1 4.34Å; I517-L615 HydrophobicContact CG2-CD1 4.37Å; L580-L615 HydrophobicContact CD2-CD2 3.46Å; L580-L615 VanDerWaalsContact CD2-CD2 3.46Å; T595-L615 WeakPolarHBondContact CA-O 3.35Å; L596-L615 PolarHBondContact N-O 3.21Å; L596-L615 PolarHBondContact O-N 2.79Å; L615-I617 HydrophobicContact CD2-CD1 4.36Å; L615-I617 HydrophobicContact CD2-CG1 4.19Å; L615-I617 HydrophobicContact CG-CG1 4.22Å
616	H	91.2	Very high	87.6	Confident	36 Å²	36	55.4 Å²	55.4	17%	0.167	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	112.9	173.5	-62.6	-78.4	0	0	0	109.9	Y514 A515 Q516 I517 T595	Y514-H616 AromaticContact CD2-CD2 3.88Å; Y514-H616 AromaticContact CE2-CD2 3.41Å; Y514-H616 VanDerWaalsContact CE2-CD2 3.41Å; Y514-H616 WeakPolarHBondContact CE2-CD2 3.37Å; Y514-H616 AromaticContact CE2-NE2 3.65Å; Y514-H616 AromaticContact CZ-CD2 3.96Å; A515-H616 PolarHBondContact O-N 2.74Å; Q516-H616 CarbonylContact C-O 3.57Å; Q516-H616 VanDerWaalsContact CA-O 3.27Å; Q516-H616 WeakPolarHBondContact CA-O 3.01Å; Q516-H616 HydrophobicContact CB-CB 4.34Å; Q516-H616 HydrophobicContact CG-CB 4.07Å; Q516-H616 WeakPolarHBondContact CG-O 3.23Å; I517-H616 PolarHBondContact N-O 2.82Å; T595-H616 PolarHBondContact OG1-ND1 3.4Å
617	I	89.7	Confident	88.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	114.4	172.6	-53.1	-175.7	0	0	0	107.7	I517 I519 L534 F561 Q593 H594 L596 L615	I517-I617 HydrophobicContact CD1-CD1 4.32Å; I517-I617 HydrophobicContact CD1-CG1 4.02Å; I517-I617 HydrophobicContact CG1-CB 4.36Å; I517-I617 HydrophobicContact CG1-CG1 3.91Å; I517-I617 HydrophobicContact CG1-CG2 4.34Å; I519-I617 HydrophobicContact CD1-CG2 4.44Å; L534-I617 HydrophobicContact CD1-CD1 4Å; F561-I617 HydrophobicContact CD1-CD1 4.36Å; F561-I617 HydrophobicContact CE1-CD1 3.72Å; F561-I617 HydrophobicContact CZ-CD1 4.15Å; Q593-I617 CarbonylContact C-O 3.56Å; Q593-I617 VanDerWaalsContact CA-O 3.28Å; Q593-I617 WeakPolarHBondContact CA-O 3.36Å; H594-I617 HydrophobicContact CB-CB 4.35Å; H594-I617 PolarHBondContact N-O 2.56Å; H594-I617 PolarHBondContact O-N 2.78Å; L596-I617 HydrophobicContact CD1-CD1 3.57Å; L596-I617 HydrophobicContact CD1-CG1 4.45Å; L596-I617 HydrophobicContact CG-CD1 4.28Å; L615-I617 HydrophobicContact CD2-CD1 4.36Å; L615-I617 HydrophobicContact CD2-CG1 4.19Å; L615-I617 HydrophobicContact CG-CG1 4.22Å
618	I	90.8	Very high	89.8	Confident	59 Å²	59	49.1 Å²	49.1	30%	0.303	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124	168.8	-59.9	-178.9	0	0	0	108	Q516 I517 S518 I519	Q516-I618 HydrophobicContact CG-CD1 4.23Å; Q516-I618 HydrophobicContact CG-CG1 4.35Å; I517-I618 PolarHBondContact O-N 3.39Å; S518-I618 WeakPolarHBondContact CA-O 3.42Å; I519-I618 PolarHBondContact N-O 3.4Å; I519-I618 VanDerWaalsContact N-O 3.09Å
619	V	89.1	Confident	90.3	Very high	8 Å²	8	48.9 Å²	48.9	5%	0.048	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	126.7	173.5	-170	0	0	0	0	108	I519 E521 L586 R588 V591 P592	I519-V619 CarbonylContact O-C 3.51Å; I519-V619 WeakPolarHBondContact O-CA 3.41Å; E521-V619 HydrophobicContact CB-CG1 3.67Å; L586-V619 HydrophobicContact CB-CG1 4.47Å; R588-V619 HydrophobicContact CB-CB 4.27Å; R588-V619 HydrophobicContact CB-CG1 3.82Å; R588-V619 HydrophobicContact CG-CB 4.29Å; R588-V619 HydrophobicContact CG-CG1 4.31Å; V591-V619 WeakPolarHBondContact O-CG2 3.44Å; P592-V619 PolarHBondContact O-N 3.39Å
620	K	89	Confident	90.2	Very high	78 Å²	78	49.7 Å²	49.7	34%	0.339	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.8	176.8	-60	167.7	175	150.6	0	110.5	S518 I519 Y520 E521	S518-K620 VanDerWaalsContact O-CE 3.26Å; S518-K620 WeakPolarHBondContact O-CE 3.34Å; S518-K620 PolarHBondContact O-NZ 2.96Å; I519-K620 PolarHBondContact O-N 3.24Å; Y520-K620 WeakPolarHBondContact CA-O 3.22Å; Y520-K620 HydrophobicContact CD1-CB 3.43Å; Y520-K620 VanDerWaalsContact CD1-CB 3.43Å; Y520-K620 HydrophobicContact CD1-CD 3.91Å; Y520-K620 HydrophobicContact CD1-CG 4.38Å; Y520-K620 HydrophobicContact CD2-CD 4.04Å; Y520-K620 HydrophobicContact CE1-CB 3.8Å; Y520-K620 HydrophobicContact CE1-CD 3.75Å; Y520-K620 HydrophobicContact CE1-CG 4.46Å; Y520-K620 HydrophobicContact CE2-CD 3.91Å; Y520-K620 HydrophobicContact CG-CB 3.97Å; Y520-K620 HydrophobicContact CG-CD 4.05Å; E521-K620 PolarHBondContact N-O 2.93Å
621	D	89.9	Confident	89.9	Confident	29 Å²	29	48.2 Å²	48.2	16%	0.155	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-51.4	138.1	176.5	-174.2	94.5	0	0	0	114.9	E521 R588 I672 N675	E521-D621 VanDerWaalsContact OE1-C 3.3Å; E521-D621 WeakPolarHBondContact OE1-CA 3.36Å; R588-D621 IonicContact CZ-OD1 3.75Å; R588-D621 IonicContact NE-OD1 3.52Å; R588-D621 PolarHBondContact NE-OD1 2.81Å; R588-D621 IonicContact NH2-OD1 3.49Å; D621-I672 HydrophobicContact CB-CD1 4.03Å; D621-I672 HydrophobicContact CB-CG1 3.59Å; D621-I672 VanDerWaalsContact CG-CG1 3.5Å; D621-I672 WeakPolarHBondContact OD1-CG1 3.28Å; D621-I672 PolarHBondContact OD1-N 3.48Å; D621-N675 PolarHBondContact OD2-ND2 3.35Å
622	R	88.3	Confident	89.5	Confident	97 Å²	97	56.7 Å²	56.7	37%	0.366	27%	0.271	S	S	.	.			trans	-128	154.2	159.5	-69.2	-172.8	-175.4	-105.7	-6.4	109.4	Y520 E521 D624	Y520-R622 HydrophobicContact CD1-CG 4.44Å; E521-R622 HydrophobicContact CG-CB 4.01Å; E521-R622 HydrophobicContact CG-CG 4.02Å; E521-R622 WeakPolarHBondContact O-CD 3.27Å; E521-R622 PolarHBondContact O-NE 2.92Å; E521-R622 PolarHBondContact OE1-N 2.83Å; R622-D624 PolarHBondContact O-N 3.33Å
623	N	90.1	Very high	89.2	Confident	22 Å²	22	52 Å²	52	12%	0.118	26%	0.255	C	S	.	.	S	Bend	trans	-75.9	86.6	171.7	-146.8	92.9	0	0	0	109.6	D671 N675 D783 A785 K790 H792	N623-D671 VanDerWaalsContact CA-OD2 3.27Å; N623-D671 WeakPolarHBondContact CA-OD2 3.21Å; N623-N675 HydrophobicContact CB-CB 4.33Å; N623-N675 PolarHBondContact N-ND2 3.39Å; N623-N675 WeakPolarHBondContact OD1-CA 3.37Å; N623-N675 WeakPolarHBondContact OD1-CB 3.36Å; N623-N675 PolarHBondContact OD1-O 3.19Å; N623-D783 PolarHBondContact ND2-OD2 3.06Å; N623-A785 HydrophobicContact CB-CB 4.11Å; N623-A785 VanDerWaalsContact OD1-CB 3.22Å; N623-A785 WeakPolarHBondContact OD1-CB 3.07Å; N623-K790 PolarHBondContact ND2-O 3.37Å; N623-K790 VanDerWaalsContact ND2-O 3.14Å; N623-H792 PolarHBondContact ND2-ND1 2.98Å; N623-H792 PolarHBondContact O-CE1 3.09Å; N623-H792 VanDerWaalsContact O-CE1 3.22Å
624	D	88.7	Confident	89.1	Confident	70 Å²	70	50.6 Å²	50.6	37%	0.374	25%	0.247	S	C	.	.			trans	-128.6	-8.6	175.3	74.1	34.6	0	0	0	116	N522 R622 D671	N522-D624 PolarHBondContact ND2-OD2 2.78Å; R622-D624 PolarHBondContact O-N 3.33Å; D624-D671 PolarHBondContact N-OD2 3.31Å
625	N	89.5	Confident	88.9	Confident	42 Å²	42	49.4 Å²	49.4	23%	0.225	24%	0.243	C	C	.	.	S	Bend	trans	-86.7	179.5	157.1	-60	-89.3	0	0	0	111.1	E589 D669 L670 D671 H792	E589-N625 VanDerWaalsContact CD-ND2 3.32Å; E589-N625 WeakPolarHBondContact CG-ND2 3.38Å; E589-N625 PolarHBondContact OE2-ND2 2.95Å; N625-D669 WeakPolarHBondContact CB-OD1 3.3Å; N625-L670 HydrophobicContact CB-CB 4.14Å; N625-D671 WeakPolarHBondContact CB-OD1 3.33Å; N625-D671 PolarHBondContact N-OD1 2.77Å; N625-D671 PolarHBondContact ND2-OD1 2.85Å; N625-H792 PolarHBondContact O-ND1 3.24Å
626	A	90.9	Very high	88.8	Confident	39 Å²	39	49.4 Å²	49.4	32%	0.322	24%	0.243	S	C	.	.			trans	-147.3	151.6	-179.5	0	0	0	0	0	110.6	K628 D669 H792 T794	A626-K628 PolarHBondContact O-N 3.32Å; A626-D669 WeakPolarHBondContact CA-OD2 3.42Å; A626-D669 PolarHBondContact N-OD1 2.82Å; A626-H792 HydrophobicContact CB-CB 3.61Å; A626-T794 HydrophobicContact CB-CG2 4.31Å
627	P	94.3	Very high	88.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.			trans	-61.3	125.7	-171.6	-26.4	34.2	0	0	0	111.5	A667 D669 V678 A781 D783 T794	P627-A667 HydrophobicContact CB-CB 4.38Å; P627-D669 WeakPolarHBondContact CA-OD2 3.09Å; P627-D669 WeakPolarHBondContact CD-OD2 3.22Å; P627-D669 VanDerWaalsContact CG-OD2 3.25Å; P627-D669 WeakPolarHBondContact CG-OD2 3.47Å; P627-V678 HydrophobicContact CB-CG1 4.28Å; P627-V678 HydrophobicContact CB-CG2 3.9Å; P627-V678 HydrophobicContact CG-CG2 4.19Å; P627-A781 HydrophobicContact CB-CB 3.72Å; P627-D783 HydrophobicContact CG-CB 4.24Å; P627-T794 VanDerWaalsContact O-CB 3.32Å; P627-T794 WeakPolarHBondContact O-CB 3.42Å; P627-T794 WeakPolarHBondContact O-CG2 3.37Å; P627-T794 PolarHBondContact O-OG1 3.25Å
628	K	91.2	Very high	89	Confident	152 Å²	152	50 Å²	50	66%	0.661	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	115.8	-176	-174.2	179.9	178.4	-178.4	0	111.8	A626 A667 T668	A626-K628 PolarHBondContact O-N 3.32Å; K628-A667 CarbonylContact O-C 3.59Å; K628-A667 WeakPolarHBondContact O-CA 3.35Å; K628-T668 PolarHBondContact N-O 2.95Å; K628-T668 PolarHBondContact O-N 3.16Å; K628-T668 PolarHBondContact O-OG1 2.72Å
629	F	90.8	Very high	88.9	Confident	21 Å²	21	53 Å²	53	9%	0.092	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	148.3	174.9	-71.8	-78.8	0	0	0	112.9	Q631 Y634 I665 H666 A667 Y680 V779 A781 T794 A796	F629-Q631 VanDerWaalsContact C-N 3.32Å; F629-Q631 WeakPolarHBondContact CB-O 3.29Å; F629-Y634 HydrophobicContact CB-CE2 4.22Å; F629-Y634 AromaticContact CD1-CE2 3.88Å; F629-Y634 HydrophobicContact CD1-CE2 3.88Å; F629-Y634 HydrophobicContact CG-CE2 4.29Å; F629-I665 HydrophobicContact CD1-CG2 3.85Å; F629-I665 HydrophobicContact CE1-CG2 3.6Å; F629-H666 WeakPolarHBondContact CA-O 3.17Å; F629-A667 HydrophobicContact CD1-CB 3.83Å; F629-A667 HydrophobicContact CE1-CB 4.16Å; F629-A667 HydrophobicContact CG-CB 4.09Å; F629-Y680 HydrophobicContact CE1-CD1 4.16Å; F629-Y680 HydrophobicContact CE1-CE1 4.1Å; F629-V779 HydrophobicContact CE1-CG1 3.75Å; F629-V779 HydrophobicContact CE1-CG2 4.13Å; F629-V779 HydrophobicContact CZ-CB 4.36Å; F629-V779 HydrophobicContact CZ-CG1 3.73Å; F629-V779 HydrophobicContact CZ-CG2 4.06Å; F629-A781 HydrophobicContact CD2-CB 4.46Å; F629-A781 HydrophobicContact CE1-CB 3.98Å; F629-A781 HydrophobicContact CE2-CB 3.67Å; F629-A781 HydrophobicContact CZ-CB 3.4Å; F629-T794 WeakPolarHBondContact CD2-OG1 3.47Å; F629-A796 HydrophobicContact CB-CB 4.05Å; F629-A796 HydrophobicContact CD1-CB 4.09Å; F629-A796 HydrophobicContact CD2-CB 3.54Å; F629-A796 HydrophobicContact CE1-CB 4.41Å; F629-A796 HydrophobicContact CE2-CB 3.9Å; F629-A796 HydrophobicContact CG-CB 3.63Å; F629-A796 HydrophobicContact CZ-CB 4.31Å
630	T	86.2	Confident	89	Confident	78 Å²	78	52.8 Å²	52.8	48%	0.479	26%	0.256	S	S	.	.	S	Bend	trans	-72.4	-23.5	176.4	59.9	0	0	0	0	113.5	Y634 H666	T630-Y634 PolarHBondContact N-OH 2.86Å; T630-Y634 PolarHBondContact OG1-OH 3.15Å; T630-Y634 VanDerWaalsContact OG1-OH 3.09Å; T630-H666 HydrophobicContact CG2-CB 4.13Å; T630-H666 PolarHBondContact N-O 2.59Å
631	Q	82.3	Confident	88.9	Confident	20 Å²	20	52.8 Å²	52.8	9%	0.093	26%	0.259	C	S	.	.			trans	-131.3	142.8	171.2	-60.3	176.9	-74.1	0	0	109.8	F629 H633 Y634 I650 S652	F629-Q631 VanDerWaalsContact C-N 3.32Å; F629-Q631 WeakPolarHBondContact CB-O 3.29Å; Q631-H633 VanDerWaalsContact C-N 3.27Å; Q631-Y634 HydrophobicContact CB-CD1 4.31Å; Q631-Y634 HydrophobicContact CB-CD2 4.46Å; Q631-Y634 HydrophobicContact CB-CE1 4.04Å; Q631-Y634 HydrophobicContact CB-CE2 4.18Å; Q631-Y634 HydrophobicContact CG-CE1 4.25Å; Q631-Y634 PolarHBondContact N-OH 3.08Å; Q631-Y634 VanDerWaalsContact O-CE2 3.29Å; Q631-Y634 WeakPolarHBondContact O-CE2 3.23Å; Q631-I650 PolarHBondContact NE2-O 3.16Å; Q631-S652 VanDerWaalsContact NE2-N 3.12Å; Q631-S652 PolarHBondContact NE2-OG 2.95Å
632	E	81.7	Confident	88.6	Confident	183 Å²	183	53.1 Å²	53.1	86%	0.855	26%	0.263	S	S	*	.	S	Bend	trans	-71.4	-26.6	170.6	-63	-173.8	163.6	0	0	111.9	L797	E632-L797 PolarHBondContact O-N 3.12Å
633	H	85.5	Confident	88.3	Confident	38 Å²	38	50.4 Å²	50.4	18%	0.176	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	122.6	178.7	178.1	-152.3	0	0	0	110.1	Q631 F693 L797 T799	Q631-H633 VanDerWaalsContact C-N 3.27Å; H633-F693 AromaticContact CE1-CE2 3.39Å; H633-F693 WeakPolarHBondContact CE1-CE2 3.43Å; H633-F693 AromaticContact CE1-CZ 3.59Å; H633-F693 AromaticContact ND1-CE2 3.61Å; H633-L797 WeakPolarHBondContact CA-O 3.44Å; H633-L797 HydrophobicContact CB-CB 4.28Å; H633-T799 WeakPolarHBondContact NE2-CB 3.47Å; H633-T799 PolarHBondContact NE2-OG1 2.9Å
634	Y	88.7	Confident	88.2	Confident	1 Å²	1	53.5 Å²	53.5	0%	0.004	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.1	172.9	-65.6	-91.3	0	0	0	109.8	F629 T630 Q631 L649 I665 H666 A796 L797 V798 T799	F629-Y634 HydrophobicContact CB-CE2 4.22Å; F629-Y634 AromaticContact CD1-CE2 3.88Å; F629-Y634 HydrophobicContact CD1-CE2 3.88Å; F629-Y634 HydrophobicContact CG-CE2 4.29Å; T630-Y634 PolarHBondContact N-OH 2.86Å; T630-Y634 PolarHBondContact OG1-OH 3.15Å; T630-Y634 VanDerWaalsContact OG1-OH 3.09Å; Q631-Y634 HydrophobicContact CB-CD1 4.31Å; Q631-Y634 HydrophobicContact CB-CD2 4.46Å; Q631-Y634 HydrophobicContact CB-CE1 4.04Å; Q631-Y634 HydrophobicContact CB-CE2 4.18Å; Q631-Y634 HydrophobicContact CG-CE1 4.25Å; Q631-Y634 PolarHBondContact N-OH 3.08Å; Q631-Y634 VanDerWaalsContact O-CE2 3.29Å; Q631-Y634 WeakPolarHBondContact O-CE2 3.23Å; Y634-L649 HydrophobicContact CD1-CD1 4.19Å; Y634-I665 HydrophobicContact CD1-CG1 4.18Å; Y634-I665 HydrophobicContact CD2-CG2 4.21Å; Y634-I665 HydrophobicContact CE1-CB 4.44Å; Y634-I665 HydrophobicContact CE1-CG1 4.44Å; Y634-I665 HydrophobicContact CE1-CG2 4.21Å; Y634-I665 HydrophobicContact CE2-CG2 3.77Å; Y634-I665 HydrophobicContact CG-CD1 4.47Å; Y634-I665 HydrophobicContact CG-CG1 4.24Å; Y634-H666 PolarHBondContact OH-N 2.97Å; Y634-H666 PolarHBondContact OH-O 2.94Å; Y634-A796 HydrophobicContact CD2-CB 4.05Å; Y634-A796 HydrophobicContact CE2-CB 3.78Å; Y634-L797 PolarHBondContact N-O 3.08Å; Y634-V798 WeakPolarHBondContact O-CA 3.35Å; Y634-T799 PolarHBondContact O-N 2.69Å
635	I	88.6	Confident	88.2	Confident	64 Å²	64	52.7 Å²	52.7	33%	0.328	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.8	170.8	-60.2	174.6	0	0	0	107.6	I650 T799 I801	I635-I650 HydrophobicContact CG2-CD1 4.47Å; I635-I650 PolarHBondContact O-N 3.19Å; I635-T799 WeakPolarHBondContact CA-O 3.19Å; I635-I801 HydrophobicContact CG2-CD1 4.09Å
636	G	89.3	Confident	88.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148	-178.4	0	0	0	0	0	112.3	T648 T799 V800 I801	G636-T648 CarbonylContact C-O 3.58Å; G636-T648 WeakPolarHBondContact CA-O 2.99Å; G636-T799 PolarHBondContact N-O 3.25Å; G636-V800 CarbonylContact O-C 3.55Å; G636-V800 WeakPolarHBondContact O-CA 3.24Å; G636-I801 PolarHBondContact O-N 2.87Å
637	H	91.8	Very high	88.3	Confident	44 Å²	44	50.6 Å²	50.6	20%	0.204	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.8	175.5	-77.8	-105.5	0	0	0	110.8	T648 I650 I801 D803	H637-T648 PolarHBondContact N-O 3.32Å; H637-T648 WeakPolarHBondContact O-CB 3.01Å; H637-T648 PolarHBondContact O-N 3.11Å; H637-I650 VanDerWaalsContact CD2-CD1 3.47Å; H637-I650 WeakPolarHBondContact CD2-CD1 3.35Å; H637-I650 WeakPolarHBondContact NE2-CD1 3.38Å; H637-I801 WeakPolarHBondContact CA-O 3.47Å; H637-D803 IonicContact CE1-OD1 2.64Å; H637-D803 IonicContact CG-OD1 2.61Å; H637-D803 IonicContact ND1-OD1 3.99Å; H637-D803 PolarHBondContact ND1-OD1 2.81Å; H637-D803 IonicContact ND1-OD2 3.02Å
638	V	91.5	Very high	88.1	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144.6	171.7	68.9	0	0	0	0	109	T645 V647 T763 L767 V800 I801 V802 D803	V638-T645 HydrophobicContact CG2-CG2 3.96Å; V638-V647 HydrophobicContact CB-CG2 4.46Å; V638-T763 HydrophobicContact CB-CG2 4.45Å; V638-T763 HydrophobicContact CG1-CG2 4.05Å; V638-T763 HydrophobicContact CG2-CG2 3.85Å; V638-L767 HydrophobicContact CG1-CD1 3.89Å; V638-V800 HydrophobicContact CG1-CG1 3.7Å; V638-I801 PolarHBondContact N-O 2.89Å; V638-I801 VanDerWaalsContact N-O 3.12Å; V638-V802 CarbonylContact O-C 2.93Å; V638-V802 VanDerWaalsContact O-CA 3.32Å; V638-V802 WeakPolarHBondContact O-CA 3.26Å; V638-D803 PolarHBondContact O-N 3.27Å
639	K	89.8	Confident	87.9	Confident	122 Å²	122	47.4 Å²	47.4	53%	0.53	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	145.3	175.1	-65.1	-169.9	173.2	-159.8	0	110.7	T642 D803 V805	K639-T642 HydrophobicContact CB-CG2 4.17Å; K639-T642 PolarHBondContact O-OG1 2.84Å; K639-D803 HydrophobicContact CG-CB 4.14Å; K639-V805 HydrophobicContact CB-CG2 4.16Å; K639-V805 HydrophobicContact CD-CG2 4.24Å; K639-V805 HydrophobicContact CG-CG2 4.47Å
640	E	90.1	Very high	87.2	Confident	3 Å²	3	50.6 Å²	50.6	1%	0.014	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	166.8	165.8	70.3	-166.4	122.4	0	0	112.5	T642 L767 C769 V802 D803 D804 V805	E640-T642 PolarHBondContact O-N 3.31Å; E640-T642 VanDerWaalsContact O-N 3.14Å; E640-L767 CarbonylContact C-O 3.5Å; E640-L767 WeakPolarHBondContact CA-O 3.4Å; E640-L767 VanDerWaalsContact CB-O 3.29Å; E640-L767 WeakPolarHBondContact CB-O 3.35Å; E640-C769 VanDerWaalsContact OE1-CB 3.26Å; E640-C769 WeakPolarHBondContact OE1-CB 3.37Å; E640-C769 WeakPolarHBondContact OE2-CB 3.4Å; E640-C769 PolarHBondContact OE2-N 2.83Å; E640-V802 HydrophobicContact CB-CG1 3.58Å; E640-D803 PolarHBondContact N-O 3.35Å; E640-D804 VanDerWaalsContact OE1-CA 3.32Å; E640-D804 WeakPolarHBondContact OE1-CA 3.03Å; E640-V805 HydrophobicContact CG-CB 3.77Å; E640-V805 HydrophobicContact CG-CG2 3.95Å; E640-V805 PolarHBondContact OE1-N 2.78Å
641	N	87.2	Confident	86	Confident	78 Å²	78	49.1 Å²	49.1	42%	0.417	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	26.1	-174.8	-65.8	-58.2	0	0	0	113.8	L767 D807	N641-L767 PolarHBondContact N-O 3.27Å; N641-D807 PolarHBondContact ND2-OD2 2.77Å
642	T	83.3	Confident	84.7	Confident	37 Å²	37	52 Å²	52	23%	0.227	28%	0.281	C	S	.	.			trans	-124.4	99.1	176.8	70.2	0	0	0	0	114.4	K639 E640 T763	K639-T642 HydrophobicContact CB-CG2 4.17Å; K639-T642 PolarHBondContact O-OG1 2.84Å; E640-T642 PolarHBondContact O-N 3.31Å; E640-T642 VanDerWaalsContact O-N 3.14Å; T642-T763 PolarHBondContact O-OG1 3.36Å
643	A	83.3	Confident	83.2	Confident	39 Å²	39	48.1 Å²	48.1	32%	0.322	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	159.6	166.5	0	0	0	0	0	113	T645 T765 E766	A643-T645 PolarHBondContact O-N 2.75Å; A643-T645 PolarHBondContact O-OG1 2.8Å; A643-T765 WeakPolarHBondContact CA-O 3.16Å; A643-E766 HydrophobicContact CB-CG 3.79Å
644	N	88.6	Confident	81.3	Confident	88 Å²	88	50.8 Å²	50.8	47%	0.471	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	25.3	174.6	-164.3	3.3	0	0	0	114.3	Y753 R762 T763	N644-Y753 PolarHBondContact OD1-OH 3.5Å; N644-R762 PolarHBondContact O-NH1 3.2Å; N644-R762 PolarHBondContact OD1-NH1 2.94Å; N644-T763 WeakPolarHBondContact CA-O 3.35Å; N644-T763 PolarHBondContact N-O 2.82Å; N644-T763 VanDerWaalsContact N-O 3.1Å; N644-T763 PolarHBondContact N-OG1 2.68Å
645	T	88.8	Confident	79.4	Confident	52 Å²	52	59.8 Å²	59.8	32%	0.319	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-103.1	137.5	-169.1	-70.5	0	0	0	0	109.8	V638 A643 V647 R762 T763	V638-T645 HydrophobicContact CG2-CG2 3.96Å; A643-T645 PolarHBondContact O-N 2.75Å; A643-T645 PolarHBondContact O-OG1 2.8Å; T645-V647 PolarHBondContact O-N 2.93Å; T645-R762 VanDerWaalsContact O-CA 3.25Å; T645-R762 WeakPolarHBondContact O-CA 3.34Å; T645-T763 PolarHBondContact N-OG1 2.78Å; T645-T763 PolarHBondContact O-N 3.4Å
646	V	90.2	Very high	77.3	Confident	38 Å²	38	63 Å²	63	23%	0.23	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-70.5	126.2	-178.1	179.8	0	0	0	0	109.5	T648 N663 Q760 R762	V646-T648 PolarHBondContact O-N 3.15Å; V646-N663 HydrophobicContact CG1-CB 4.04Å; V646-Q760 HydrophobicContact CG1-CG 3.88Å; V646-Q760 HydrophobicContact CG2-CG 4.09Å; V646-R762 HydrophobicContact CG2-CG 4.03Å
647	V	91.5	Very high	75.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-70.7	126	175.6	-178.9	0	0	0	0	108.8	V638 T645 L649 F752 L761 V800	V638-V647 HydrophobicContact CB-CG2 4.46Å; T645-V647 PolarHBondContact O-N 2.93Å; V647-L649 HydrophobicContact CG1-CD2 4.15Å; V647-L649 PolarHBondContact O-N 2.95Å; V647-F752 HydrophobicContact CG2-CD1 4.15Å; V647-F752 HydrophobicContact CG2-CE1 3.93Å; V647-L761 HydrophobicContact CB-CB 4.37Å; V647-L761 HydrophobicContact CB-CD2 3.92Å; V647-L761 HydrophobicContact CB-CG 4.08Å; V647-L761 HydrophobicContact CG1-CD2 4.11Å; V647-L761 HydrophobicContact CG2-CD2 3.96Å; V647-L761 HydrophobicContact CG2-CG 3.87Å; V647-L761 PolarHBondContact N-O 2.97Å; V647-V800 HydrophobicContact CG1-CG1 3.94Å; V647-V800 HydrophobicContact CG1-CG2 4.13Å; V647-V800 HydrophobicContact CG2-CG1 4.3Å; V647-V800 HydrophobicContact CG2-CG2 4.47Å
648	T	89.7	Confident	73.1	Confident	73 Å²	73	67.9 Å²	67.9	45%	0.448	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	105.3	-176.9	-57.8	0	0	0	0	109.3	G636 H637 V646	G636-T648 CarbonylContact C-O 3.58Å; G636-T648 WeakPolarHBondContact CA-O 2.99Å; H637-T648 PolarHBondContact N-O 3.32Å; H637-T648 WeakPolarHBondContact O-CB 3.01Å; H637-T648 PolarHBondContact O-N 3.11Å; V646-T648 PolarHBondContact O-N 3.15Å
649	L	86.7	Confident	71.1	Confident	11 Å²	11	73.1 Å²	73.1	6%	0.058	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	135.2	-174.1	-58.4	-179.7	0	0	0	112	Y634 V647 N651 N663 V664 I665	Y634-L649 HydrophobicContact CD1-CD1 4.19Å; V647-L649 HydrophobicContact CG1-CD2 4.15Å; V647-L649 PolarHBondContact O-N 2.95Å; L649-N651 PolarHBondContact O-N 3.02Å; L649-N663 PolarHBondContact N-OD1 2.94Å; L649-V664 VanDerWaalsContact CD1-C 3.45Å; L649-I665 HydrophobicContact CD1-CG1 3.65Å
650	I	76.7	Confident	69.2	Low	88 Å²	88	71.2 Å²	71.2	45%	0.451	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	101.1	173.3	-59.3	-178.4	0	0	0	108.9	Q631 I635 H637 S652	Q631-I650 PolarHBondContact NE2-O 3.16Å; I635-I650 HydrophobicContact CG2-CD1 4.47Å; I635-I650 PolarHBondContact O-N 3.19Å; H637-I650 VanDerWaalsContact CD2-CD1 3.47Å; H637-I650 WeakPolarHBondContact CD2-CD1 3.35Å; H637-I650 WeakPolarHBondContact NE2-CD1 3.38Å; I650-S652 PolarHBondContact O-N 2.86Å; I650-S652 VanDerWaalsContact O-N 3.13Å
651	N	61.9	Low	67.5	Low	47 Å²	47	75.8 Å²	75.8	25%	0.251	44%	0.44	S	S	.	.			trans	-66.6	109.7	167.7	-71.5	11.5	0	0	0	108.9	L649 N653	L649-N651 PolarHBondContact O-N 3.02Å; N651-N653 PolarHBondContact O-N 3.07Å; N651-N653 VanDerWaalsContact O-N 3.17Å
652	S	53.9	Low	66.4	Low	82 Å²	82	80.3 Å²	80.3	57%	0.573	45%	0.451	S	S	*	.	S	Bend	trans	-62	-21.5	177	57.5	0	0	0	0	113.2	Q631 I650	Q631-S652 VanDerWaalsContact NE2-N 3.12Å; Q631-S652 PolarHBondContact NE2-OG 2.95Å; I650-S652 PolarHBondContact O-N 2.86Å; I650-S652 VanDerWaalsContact O-N 3.13Å
653	N	51.3	Low	66	Low	100 Å²	100	81 Å²	81	54%	0.535	45%	0.454	S	S	.	.			trans	-110	70.8	-173.9	-56.6	1.9	0	0	0	108.9	N651 E655	N651-N653 PolarHBondContact O-N 3.07Å; N651-N653 VanDerWaalsContact O-N 3.17Å; N653-E655 VanDerWaalsContact C-N 3.26Å; N653-E655 PolarHBondContact O-N 3.32Å; N653-E655 VanDerWaalsContact O-N 3.15Å
654	A	45.2	Very low	66.2	Low	94 Å²	94	80.3 Å²	80.3	78%	0.777	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	6.1	-164.9	0	0	0	0	0	116.3
655	E	47.7	Very low	66.4	Low	190 Å²	190	76.1 Å²	76.1	89%	0.888	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-18.2	-168.3	-63.9	-169.2	139.1	0	0	116	N653	N653-E655 VanDerWaalsContact C-N 3.26Å; N653-E655 PolarHBondContact O-N 3.32Å; N653-E655 VanDerWaalsContact O-N 3.15Å
656	T	44.9	Very low	66.4	Low	132 Å²	132	75.5 Å²	75.5	81%	0.81	42%	0.416	S	S	*	.	S	Bend	trans	-140.5	11.8	-170.5	52.4	0	0	0	0	116.5
657	V	46.4	Very low	66.5	Low	74 Å²	74	73.9 Å²	73.9	45%	0.448	41%	0.407	S	S	.	.			trans	-91.3	123	-179.7	-175.6	0	0	0	0	111.7
658	V	46.7	Very low	66.4	Low	73 Å²	73	77 Å²	77	44%	0.442	43%	0.426	S	S	.	.			trans	-54.5	137.6	175	-175.8	0	0	0	0	110.8	S660 Y661 I1418	V658-S660 PolarHBondContact O-N 3.4Å; V658-Y661 PolarHBondContact O-N 2.79Å; V658-I1418 HydrophobicContact CG2-CD1 3.55Å
659	N	49.2	Very low	66.6	Low	114 Å²	114	74.5 Å²	74.5	61%	0.61	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-57.2	-13.8	-173.3	-84.9	-38.4	0	0	0	115.7	Y661 R662	N659-Y661 VanDerWaalsContact C-N 3.29Å; N659-Y661 PolarHBondContact O-N 3.21Å; N659-R662 VanDerWaalsContact OD1-CZ 3.28Å; N659-R662 PolarHBondContact OD1-NE 2.6Å; N659-R662 PolarHBondContact OD1-NH2 3.38Å
660	S	50.2	Low	66.8	Low	82 Å²	82	79.1 Å²	79.1	57%	0.573	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-65.1	-24.1	177.9	48	0	0	0	0	114.7	V658	V658-S660 PolarHBondContact O-N 3.4Å
661	Y	54.8	Low	67.6	Low	100 Å²	100	75.2 Å²	75.2	39%	0.392	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-105	20.6	-172.2	-59.9	-80.4	0	0	0	114.5	V658 N659 H666	V658-Y661 PolarHBondContact O-N 2.79Å; N659-Y661 VanDerWaalsContact C-N 3.29Å; N659-Y661 PolarHBondContact O-N 3.21Å; Y661-H666 HydrophobicContact CD1-CB 4.41Å; Y661-H666 AromaticContact CD1-CD2 3.83Å; Y661-H666 AromaticContact CD1-CG 3.98Å; Y661-H666 AromaticContact CE1-CD2 3.64Å; Y661-H666 AromaticContact CE1-CE1 3.84Å; Y661-H666 AromaticContact CE1-CG 3.98Å; Y661-H666 AromaticContact CE1-NE2 3.54Å; Y661-H666 AromaticContact CZ-NE2 3.92Å
662	R	63.8	Low	69	Low	173 Å²	173	77.4 Å²	77.4	65%	0.653	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	136	174.4	-65.3	-174.3	-176.5	-138.9	1.3	110.6	N659 V664	N659-R662 VanDerWaalsContact OD1-CZ 3.28Å; N659-R662 PolarHBondContact OD1-NE 2.6Å; N659-R662 PolarHBondContact OD1-NH2 3.38Å; R662-V664 VanDerWaalsContact C-N 3.32Å; R662-V664 PolarHBondContact O-N 3.5Å
663	N	75.3	Confident	70.6	Confident	52 Å²	52	76.5 Å²	76.5	28%	0.278	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	34.8	177.5	-55.4	-8.3	0	0	0	114.7	V646 L649	V646-N663 HydrophobicContact CG1-CB 4.04Å; L649-N663 PolarHBondContact N-OD1 2.94Å
664	V	87.8	Confident	72.5	Confident	24 Å²	24	73.9 Å²	73.9	15%	0.145	42%	0.418	C	S	.	.			trans	-134.7	133.6	179.6	163.1	0	0	0	0	109.9	L649 R662 S758 Q760	L649-V664 VanDerWaalsContact CD1-C 3.45Å; R662-V664 VanDerWaalsContact C-N 3.32Å; R662-V664 PolarHBondContact O-N 3.5Å; V664-S758 WeakPolarHBondContact CG1-O 3.37Å; V664-Q760 HydrophobicContact CG2-CB 4.45Å
665	I	91	Very high	74.6	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	39%	0.385	C	S	.	.			trans	-77.5	127.9	167.9	-62.1	-173.4	0	0	0	107.6	F629 Y634 L649 I754 G759 L761 V779 V798	F629-I665 HydrophobicContact CD1-CG2 3.85Å; F629-I665 HydrophobicContact CE1-CG2 3.6Å; Y634-I665 HydrophobicContact CD1-CG1 4.18Å; Y634-I665 HydrophobicContact CD2-CG2 4.21Å; Y634-I665 HydrophobicContact CE1-CB 4.44Å; Y634-I665 HydrophobicContact CE1-CG1 4.44Å; Y634-I665 HydrophobicContact CE1-CG2 4.21Å; Y634-I665 HydrophobicContact CE2-CG2 3.77Å; Y634-I665 HydrophobicContact CG-CD1 4.47Å; Y634-I665 HydrophobicContact CG-CG1 4.24Å; L649-I665 HydrophobicContact CD1-CG1 3.65Å; I665-I754 HydrophobicContact CB-CD1 4.29Å; I665-I754 HydrophobicContact CD1-CD1 4.09Å; I665-G759 PolarHBondContact N-O 3.29Å; I665-G759 WeakPolarHBondContact O-CA 3.48Å; I665-L761 HydrophobicContact CD1-CB 4.46Å; I665-L761 HydrophobicContact CD1-CD2 4.35Å; I665-V779 HydrophobicContact CD1-CB 4.35Å; I665-V779 HydrophobicContact CD1-CG1 4.15Å; I665-V779 HydrophobicContact CD1-CG2 4.44Å; I665-V779 HydrophobicContact CG2-CG1 3.97Å; I665-V779 HydrophobicContact CG2-CG2 4.2Å; I665-V798 HydrophobicContact CD1-CG2 3.79Å
666	H	90.3	Very high	76.7	Confident	39 Å²	39	62.6 Å²	62.6	18%	0.181	35%	0.354	C	S	.	.			trans	-129.5	135.4	-174.4	-170.7	39.8	0	0	0	112.5	F629 T630 Y634 Y661 Y680	F629-H666 WeakPolarHBondContact CA-O 3.17Å; T630-H666 HydrophobicContact CG2-CB 4.13Å; T630-H666 PolarHBondContact N-O 2.59Å; Y634-H666 PolarHBondContact OH-N 2.97Å; Y634-H666 PolarHBondContact OH-O 2.94Å; Y661-H666 HydrophobicContact CD1-CB 4.41Å; Y661-H666 AromaticContact CD1-CD2 3.83Å; Y661-H666 AromaticContact CD1-CG 3.98Å; Y661-H666 AromaticContact CE1-CD2 3.64Å; Y661-H666 AromaticContact CE1-CE1 3.84Å; Y661-H666 AromaticContact CE1-CG 3.98Å; Y661-H666 AromaticContact CE1-NE2 3.54Å; Y661-H666 AromaticContact CZ-NE2 3.92Å; H666-Y680 PolarHBondContact ND1-OH 2.69Å
667	A	90.7	Very high	78.9	Confident	3 Å²	3	61.9 Å²	61.9	3%	0.025	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.8	165.6	0	0	0	0	0	110.8	P627 K628 F629 V678 Y680 A781	P627-A667 HydrophobicContact CB-CB 4.38Å; K628-A667 CarbonylContact O-C 3.59Å; K628-A667 WeakPolarHBondContact O-CA 3.35Å; F629-A667 HydrophobicContact CD1-CB 3.83Å; F629-A667 HydrophobicContact CE1-CB 4.16Å; F629-A667 HydrophobicContact CG-CB 4.09Å; A667-V678 HydrophobicContact CB-CG1 4.34Å; A667-Y680 HydrophobicContact CB-CE1 4.03Å; A667-Y680 PolarHBondContact N-OH 3.49Å; A667-Y680 PolarHBondContact O-OH 2.99Å; A667-A781 HydrophobicContact CB-CB 3.72Å
668	T	91.2	Very high	81.1	Confident	66 Å²	66	59.5 Å²	59.5	41%	0.405	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.2	176.6	55.1	0	0	0	0	109.4	K628	K628-T668 PolarHBondContact N-O 2.95Å; K628-T668 PolarHBondContact O-N 3.16Å; K628-T668 PolarHBondContact O-OG1 2.72Å
669	D	92.9	Very high	83.4	Confident	21 Å²	21	57.4 Å²	57.4	11%	0.112	32%	0.318	C	S	.	.			trans	-108.5	161.3	166.3	-145.6	-39.4	0	0	0	109.9	N625 A626 P627 A676 V678	N625-D669 WeakPolarHBondContact CB-OD1 3.3Å; A626-D669 WeakPolarHBondContact CA-OD2 3.42Å; A626-D669 PolarHBondContact N-OD1 2.82Å; P627-D669 WeakPolarHBondContact CA-OD2 3.09Å; P627-D669 WeakPolarHBondContact CD-OD2 3.22Å; P627-D669 VanDerWaalsContact CG-OD2 3.25Å; P627-D669 WeakPolarHBondContact CG-OD2 3.47Å; D669-A676 HydrophobicContact CB-CB 3.84Å; D669-V678 HydrophobicContact CB-CG2 4.31Å
670	L	91.5	Very high	85.6	Confident	108 Å²	108	52.7 Å²	52.7	57%	0.565	29%	0.291	S	S	*	.	S	Bend	trans	-102.6	-22	-173.7	-60	-179.8	0	0	0	113.7	R588 E589 N625	R588-L670 PolarHBondContact NH2-O 2.8Å; E589-L670 HydrophobicContact CB-CB 4.43Å; E589-L670 HydrophobicContact CG-CB 3.63Å; N625-L670 HydrophobicContact CB-CB 4.14Å
671	D	92.9	Very high	87.7	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.032	28%	0.278	C	S	.	.	S	Bend	trans	-62.1	-169.4	177.3	-61.3	-4.3	0	0	0	112.1	R588 N623 D624 N625 N675 A676	R588-D671 PolarHBondContact NH2-O 2.8Å; N623-D671 VanDerWaalsContact CA-OD2 3.27Å; N623-D671 WeakPolarHBondContact CA-OD2 3.21Å; D624-D671 PolarHBondContact N-OD2 3.31Å; N625-D671 WeakPolarHBondContact CB-OD1 3.33Å; N625-D671 PolarHBondContact N-OD1 2.77Å; N625-D671 PolarHBondContact ND2-OD1 2.85Å; D671-N675 HydrophobicContact CB-CB 3.59Å; D671-A676 VanDerWaalsContact C-CB 3.43Å; D671-A676 HydrophobicContact CB-CB 4.24Å; D671-A676 WeakPolarHBondContact O-CB 3.32Å
672	I	90.5	Very high	89.5	Confident	93 Å²	93	47.7 Å²	47.7	48%	0.477	27%	0.268	S	S	.	.			trans	-129.9	156.9	173.3	50.5	163.2	0	0	0	115.8	R588 D621 S674 N675	R588-I672 VanDerWaalsContact NH1-CG2 3.31Å; D621-I672 HydrophobicContact CB-CD1 4.03Å; D621-I672 HydrophobicContact CB-CG1 3.59Å; D621-I672 VanDerWaalsContact CG-CG1 3.5Å; D621-I672 WeakPolarHBondContact OD1-CG1 3.28Å; D621-I672 PolarHBondContact OD1-N 3.48Å; I672-S674 PolarHBondContact O-N 3.08Å; I672-N675 WeakPolarHBondContact O-CB 3.12Å; I672-N675 PolarHBondContact O-N 3.3Å; I672-N675 VanDerWaalsContact O-N 3.13Å
673	G	89.2	Confident	90.7	Very high	63 Å²	63	44.5 Å²	44.5	65%	0.649	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	-121.3	172.6	0	0	0	0	0	111.8	N675 Q677	G673-N675 PolarHBondContact O-N 3.46Å; G673-Q677 WeakPolarHBondContact O-CB 3.31Å; G673-Q677 PolarHBondContact O-N 2.71Å
674	S	89.9	Confident	91.1	Very high	44 Å²	44	44.2 Å²	44.2	31%	0.308	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.2	175.1	45.4	0	0	0	0	112.9	I672 Q677 Q784 A785	I672-S674 PolarHBondContact O-N 3.08Å; S674-Q677 PolarHBondContact O-N 2.96Å; S674-Q784 CarbonylContact O-C 3.48Å; S674-Q784 VanDerWaalsContact O-CA 3.3Å; S674-Q784 WeakPolarHBondContact O-CA 3.32Å; S674-Q784 PolarHBondContact O-N 3.45Å; S674-A785 PolarHBondContact O-N 3.43Å
675	N	90.6	Very high	90.5	Very high	18 Å²	18	43.9 Å²	43.9	10%	0.096	26%	0.259	C	S	.	.	S	Bend	trans	-79.8	-30.1	-168.7	-65.6	14.9	0	0	0	111.3	D621 N623 D671 I672 G673 D783	D621-N675 PolarHBondContact OD2-ND2 3.35Å; N623-N675 HydrophobicContact CB-CB 4.33Å; N623-N675 PolarHBondContact N-ND2 3.39Å; N623-N675 WeakPolarHBondContact OD1-CA 3.37Å; N623-N675 WeakPolarHBondContact OD1-CB 3.36Å; N623-N675 PolarHBondContact OD1-O 3.19Å; D671-N675 HydrophobicContact CB-CB 3.59Å; I672-N675 WeakPolarHBondContact O-CB 3.12Å; I672-N675 PolarHBondContact O-N 3.3Å; I672-N675 VanDerWaalsContact O-N 3.13Å; G673-N675 PolarHBondContact O-N 3.46Å; N675-D783 WeakPolarHBondContact O-CB 2.99Å
676	A	90.9	Very high	89.2	Confident	29 Å²	29	52.3 Å²	52.3	24%	0.24	29%	0.292	C	S	.	.	S	Bend	trans	-98.6	5.4	169.1	0	0	0	0	0	115.5	D669 D671 V678	D669-A676 HydrophobicContact CB-CB 3.84Å; D671-A676 VanDerWaalsContact C-CB 3.43Å; D671-A676 HydrophobicContact CB-CB 4.24Å; D671-A676 WeakPolarHBondContact O-CB 3.32Å; A676-V678 PolarHBondContact O-N 3.21Å; A676-V678 VanDerWaalsContact O-N 3.1Å
677	Q	92	Very high	87.6	Confident	117 Å²	117	56.2 Å²	56.2	55%	0.547	31%	0.313	S	S	.	.			trans	-79.1	97.1	176.3	-176.1	176.9	12.2	0	0	110.1	G673 S674 D783 Q784	G673-Q677 WeakPolarHBondContact O-CB 3.31Å; G673-Q677 PolarHBondContact O-N 2.71Å; S674-Q677 PolarHBondContact O-N 2.96Å; Q677-D783 CarbonylContact O-C 3.54Å; Q677-D783 WeakPolarHBondContact O-CA 3.25Å; Q677-Q784 HydrophobicContact CB-CB 4.14Å; Q677-Q784 HydrophobicContact CB-CG 4.2Å; Q677-Q784 HydrophobicContact CG-CB 4.39Å; Q677-Q784 HydrophobicContact CG-CG 3.96Å; Q677-Q784 WeakPolarHBondContact O-CG 3.39Å; Q677-Q784 PolarHBondContact O-N 3.01Å
678	V	92.6	Very high	86.1	Confident	25 Å²	25	59.1 Å²	59.1	15%	0.152	33%	0.332	C	S	.	.			trans	-74.7	140	177.6	-175.7	0	0	0	0	111.8	P627 A667 D669 A676 Y680 A781 I782	P627-V678 HydrophobicContact CB-CG1 4.28Å; P627-V678 HydrophobicContact CB-CG2 3.9Å; P627-V678 HydrophobicContact CG-CG2 4.19Å; A667-V678 HydrophobicContact CB-CG1 4.34Å; D669-V678 HydrophobicContact CB-CG2 4.31Å; A676-V678 PolarHBondContact O-N 3.21Å; A676-V678 VanDerWaalsContact O-N 3.1Å; V678-Y680 HydrophobicContact CG1-CD1 4.39Å; V678-Y680 HydrophobicContact CG1-CE1 3.95Å; V678-Y680 HydrophobicContact CG1-CE2 4.32Å; V678-A781 HydrophobicContact CG1-CB 3.69Å; V678-I782 CarbonylContact C-O 3.43Å
679	A	93.9	Very high	84.5	Confident	28 Å²	28	59.9 Å²	59.9	23%	0.231	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	142.3	162.5	0	0	0	0	0	111.4	P756 I782 Q784	A679-P756 CarbonylContact C-O 3.42Å; A679-P756 VanDerWaalsContact CA-O 3.24Å; A679-P756 WeakPolarHBondContact CA-O 3.47Å; A679-I782 PolarHBondContact N-O 3.18Å; A679-I782 PolarHBondContact O-N 2.98Å; A679-Q784 VanDerWaalsContact CB-NE2 3.35Å
680	Y	95.3	Very high	82.8	Confident	15 Å²	15	61.8 Å²	61.8	6%	0.059	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	148.4	-175.9	-54.3	-83.8	0	0	0	113.3	F629 H666 A667 V678 P756 I780 A781	F629-Y680 HydrophobicContact CE1-CD1 4.16Å; F629-Y680 HydrophobicContact CE1-CE1 4.1Å; H666-Y680 PolarHBondContact ND1-OH 2.69Å; A667-Y680 HydrophobicContact CB-CE1 4.03Å; A667-Y680 PolarHBondContact N-OH 3.49Å; A667-Y680 PolarHBondContact O-OH 2.99Å; V678-Y680 HydrophobicContact CG1-CD1 4.39Å; V678-Y680 HydrophobicContact CG1-CE1 3.95Å; V678-Y680 HydrophobicContact CG1-CE2 4.32Å; Y680-P756 PolarHBondContact N-O 2.9Å; Y680-P756 WeakPolarHBondContact O-CA 3.49Å; Y680-P756 WeakPolarHBondContact O-CB 3.33Å; Y680-I780 CarbonylContact C-O 3.22Å; Y680-I780 WeakPolarHBondContact CA-O 2.89Å; Y680-A781 HydrophobicContact CD1-CB 4.3Å; Y680-A781 HydrophobicContact CE1-CB 4.31Å
681	S	94.2	Very high	81.2	Confident	41 Å²	41	60.2 Å²	60.2	29%	0.287	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	158	171.9	57.5	0	0	0	0	112	V779 I780	S681-V779 CarbonylContact O-C 3.58Å; S681-V779 WeakPolarHBondContact O-CA 3.38Å; S681-I780 PolarHBondContact N-O 3.34Å; S681-I780 PolarHBondContact O-N 3.39Å
682	L	93.4	Very high	79.5	Confident	36 Å²	36	66.3 Å²	66.3	19%	0.188	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	147.9	175.3	-59.2	-174.5	0	0	0	111.3	V749 F752 I754 L761 F777 V779	L682-V749 HydrophobicContact CB-CG1 3.87Å; L682-F752 HydrophobicContact CD1-CB 3.9Å; L682-I754 HydrophobicContact CD2-CB 3.97Å; L682-I754 HydrophobicContact CD2-CD1 4.35Å; L682-I754 HydrophobicContact CD2-CG2 3.94Å; L682-I754 HydrophobicContact CG-CB 4.11Å; L682-I754 HydrophobicContact CG-CG2 3.85Å; L682-L761 HydrophobicContact CD1-CD1 4.23Å; L682-L761 HydrophobicContact CD2-CD1 4.24Å; L682-F777 HydrophobicContact CD1-CD2 4.44Å; L682-F777 HydrophobicContact CD1-CE2 4.2Å; L682-F777 HydrophobicContact CD2-CD2 3.96Å; L682-F777 HydrophobicContact CD2-CE2 3.84Å; L682-V779 HydrophobicContact CD2-CB 4.32Å; L682-V779 HydrophobicContact CD2-CG2 4.43Å
683	K	87.7	Confident	77.7	Confident	106 Å²	106	63.5 Å²	63.5	46%	0.461	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	141.6	-179.1	179.4	-176.4	168.9	-173.1	0	110.8	A778 I780	K683-A778 HydrophobicContact CB-CB 4.38Å; K683-A778 PolarHBondContact N-O 2.88Å; K683-A778 PolarHBondContact O-N 3.31Å; K683-I780 HydrophobicContact CB-CD1 3.97Å; K683-I780 HydrophobicContact CB-CG1 3.9Å; K683-I780 HydrophobicContact CD-CD1 3.84Å; K683-I780 HydrophobicContact CD-CG1 4.22Å; K683-I780 HydrophobicContact CG-CD1 4.4Å
684	S	85.6	Confident	76.1	Confident	47 Å²	47	62.7 Å²	62.7	33%	0.329	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-69.6	140.4	174.7	49.3	0	0	0	0	111.2	T745	S684-T745 WeakPolarHBondContact CA-O 3.48Å; S684-T745 WeakPolarHBondContact CB-O 3.43Å
685	L	74.8	Confident	74.3	Confident	17 Å²	17	67.1 Å²	67.1	9%	0.089	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-72.1	130.5	179.1	-72.7	162.9	0	0	0	110.6	T745 A778 L797	L685-T745 HydrophobicContact CB-CG2 4.05Å; L685-T745 PolarHBondContact O-OG1 3.34Å; L685-A778 HydrophobicContact CD2-CB 3.93Å; L685-L797 HydrophobicContact CD1-CD1 3.49Å; L685-L797 VanDerWaalsContact CD1-CD1 3.49Å; L685-L797 HydrophobicContact CD2-CD1 3.6Å; L685-L797 HydrophobicContact CG-CD1 4.14Å
686	Y	63.1	Low	72.2	Confident	177 Å²	177	72 Å²	72	69%	0.694	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-74.8	141.6	171.1	-156.9	-124.3	0	0	0	109.2	P688 D689 Y690	Y686-P688 VanDerWaalsContact C-N 3.32Å; Y686-P688 HydrophobicContact CD1-CG 3.86Å; Y686-P688 HydrophobicContact CE1-CG 4.14Å; Y686-P688 VanDerWaalsContact O-N 3.11Å; Y686-D689 PolarHBondContact O-N 2.81Å; Y686-Y690 PolarHBondContact O-N 3.3Å
687	L	56	Low	70.1	Confident	120 Å²	120	76.3 Å²	76.3	63%	0.628	38%	0.381	S	S	*	.	H	α-helix	trans	-51.4	-38.3	-169.8	-156.8	75.1	0	0	0	115	D689 I691	L687-D689 VanDerWaalsContact C-N 3.34Å; L687-D689 PolarHBondContact O-N 2.74Å; L687-I691 HydrophobicContact CD2-CD1 4.42Å; L687-I691 HydrophobicContact CG-CD1 4.11Å; L687-I691 WeakPolarHBondContact O-CD1 3.17Å; L687-I691 VanDerWaalsContact O-CG1 3.26Å; L687-I691 WeakPolarHBondContact O-CG1 3.33Å; L687-I691 PolarHBondContact O-N 3.42Å
688	P	59.3	Low	67.9	Low	65 Å²	65	73.4 Å²	73.4	42%	0.422	37%	0.371	S	S	.	.	H	α-helix	trans	-63.9	-32.1	176.2	-22.7	35.5	0	0	0	114.7	Y686 I691 K692	Y686-P688 VanDerWaalsContact C-N 3.32Å; Y686-P688 HydrophobicContact CD1-CG 3.86Å; Y686-P688 HydrophobicContact CE1-CG 4.14Å; Y686-P688 VanDerWaalsContact O-N 3.11Å; P688-I691 PolarHBondContact O-N 3.45Å; P688-K692 WeakPolarHBondContact O-CB 3.37Å; P688-K692 PolarHBondContact O-N 2.88Å
689	D	58.3	Low	65.5	Low	82 Å²	82	81 Å²	81	44%	0.439	40%	0.402	S	S	.	.	H	α-helix	trans	-76.2	-39.3	-178.7	-59.5	-45.8	0	0	0	110.6	Y686 L687 K692 F693	Y686-D689 PolarHBondContact O-N 2.81Å; L687-D689 VanDerWaalsContact C-N 3.34Å; L687-D689 PolarHBondContact O-N 2.74Å; D689-K692 PolarHBondContact O-N 2.81Å; D689-F693 WeakPolarHBondContact O-CB 3.41Å; D689-F693 PolarHBondContact O-N 3.4Å
690	Y	57	Low	62.9	Low	60 Å²	60	88.3 Å²	88.3	24%	0.235	43%	0.431	C	S	.	.	H	α-helix	trans	-58.6	-46.2	168.3	179.9	-97.5	0	0	0	111.5	Y686 F693 V694 H743 Y776	Y686-Y690 PolarHBondContact O-N 3.3Å; Y690-F693 PolarHBondContact O-N 2.8Å; Y690-V694 HydrophobicContact CD1-CG2 4.48Å; Y690-V694 HydrophobicContact CE1-CG2 4.2Å; Y690-V694 WeakPolarHBondContact O-CG2 3.42Å; Y690-V694 PolarHBondContact O-N 2.79Å; Y690-H743 AromaticContact CE2-CD2 3.53Å; Y690-H743 AromaticContact CZ-CD2 3.69Å; Y690-Y776 HydrophobicContact CE2-CD2 4.33Å; Y690-Y776 HydrophobicContact CE2-CG 4.33Å
691	I	58.6	Low	60.1	Low	76 Å²	76	93.1 Å²	93.1	39%	0.39	46%	0.458	S	S	.	.	H	α-helix	trans	-62.2	-45.2	177	-70.2	165	0	0	0	111.5	L687 P688 F693 V694 Q695	L687-I691 HydrophobicContact CD2-CD1 4.42Å; L687-I691 HydrophobicContact CG-CD1 4.11Å; L687-I691 WeakPolarHBondContact O-CD1 3.17Å; L687-I691 VanDerWaalsContact O-CG1 3.26Å; L687-I691 WeakPolarHBondContact O-CG1 3.33Å; L687-I691 PolarHBondContact O-N 3.42Å; P688-I691 PolarHBondContact O-N 3.45Å; I691-F693 VanDerWaalsContact C-N 3.35Å; I691-F693 PolarHBondContact O-N 3.37Å; I691-V694 PolarHBondContact O-N 3.32Å; I691-Q695 HydrophobicContact CG2-CG 4.41Å; I691-Q695 WeakPolarHBondContact O-CB 3.25Å; I691-Q695 VanDerWaalsContact O-CG 3.25Å; I691-Q695 WeakPolarHBondContact O-CG 3.26Å; I691-Q695 PolarHBondContact O-N 2.94Å
692	K	56.7	Low	57.4	Low	134 Å²	134	98.2 Å²	98.2	58%	0.583	48%	0.478	S	S	*	.	H	α-helix	trans	-58.3	-44.3	174.3	-93.2	179.7	172.9	175.8	0	112.4	P688 D689 Q695 N696	P688-K692 WeakPolarHBondContact O-CB 3.37Å; P688-K692 PolarHBondContact O-N 2.88Å; D689-K692 PolarHBondContact O-N 2.81Å; K692-Q695 PolarHBondContact O-N 2.78Å; K692-N696 PolarHBondContact O-N 2.93Å; K692-N696 VanDerWaalsContact O-N 3.14Å
693	F	52.6	Low	54.9	Low	34 Å²	34	105 Å²	105	15%	0.149	51%	0.508	C	S	.	.	H	α-helix	trans	-61.3	-50.2	179.7	170.9	-103	0	0	0	111.4	H633 D689 Y690 I691 Q695 N696 H697 Y776 L797	H633-F693 AromaticContact CE1-CE2 3.39Å; H633-F693 WeakPolarHBondContact CE1-CE2 3.43Å; H633-F693 AromaticContact CE1-CZ 3.59Å; H633-F693 AromaticContact ND1-CE2 3.61Å; D689-F693 WeakPolarHBondContact O-CB 3.41Å; D689-F693 PolarHBondContact O-N 3.4Å; Y690-F693 PolarHBondContact O-N 2.8Å; I691-F693 VanDerWaalsContact C-N 3.35Å; I691-F693 PolarHBondContact O-N 3.37Å; F693-Q695 VanDerWaalsContact C-N 3.31Å; F693-Q695 PolarHBondContact O-N 3.29Å; F693-N696 PolarHBondContact O-N 3.02Å; F693-H697 AromaticContact CD2-CE1 3.57Å; F693-H697 AromaticContact CD2-ND1 3.22Å; F693-H697 WeakPolarHBondContact CD2-ND1 3.34Å; F693-H697 HydrophobicContact CE2-CB 4.29Å; F693-H697 AromaticContact CE2-CE1 3.55Å; F693-H697 AromaticContact CE2-CG 3.66Å; F693-H697 AromaticContact CE2-ND1 3.2Å; F693-H697 WeakPolarHBondContact CE2-ND1 3.3Å; F693-H697 HydrophobicContact CZ-CB 4.35Å; F693-H697 PolarHBondContact O-N 2.82Å; F693-H697 PolarHBondContact O-ND1 2.99Å; F693-H697 VanDerWaalsContact O-ND1 3.08Å; F693-Y776 HydrophobicContact CD1-CE1 4.36Å; F693-Y776 HydrophobicContact CE1-CD1 4.18Å; F693-Y776 AromaticContact CE1-CE1 3.69Å; F693-Y776 HydrophobicContact CE1-CE1 3.69Å; F693-Y776 HydrophobicContact CZ-CE1 4.47Å; F693-L797 HydrophobicContact CB-CD2 4.05Å; F693-L797 HydrophobicContact CD1-CD2 4.18Å; F693-L797 HydrophobicContact CD2-CD2 3.09Å; F693-L797 HydrophobicContact CE2-CD2 3.5Å; F693-L797 VanDerWaalsContact CE2-CD2 3.5Å; F693-L797 HydrophobicContact CG-CD2 3.48Å; F693-L797 VanDerWaalsContact CG-CD2 3.48Å; F693-L797 HydrophobicContact CZ-CD2 4.2Å
694	V	55	Low	52.7	Low	45 Å²	45	104 Å²	104	27%	0.273	52%	0.515	S	S	.	.	H	α-helix	trans	-61.1	-38.7	177.9	173.3	0	0	0	0	111.4	Y690 I691 N696 T698	Y690-V694 HydrophobicContact CD1-CG2 4.48Å; Y690-V694 HydrophobicContact CE1-CG2 4.2Å; Y690-V694 WeakPolarHBondContact O-CG2 3.42Å; Y690-V694 PolarHBondContact O-N 2.79Å; I691-V694 PolarHBondContact O-N 3.32Å; V694-N696 VanDerWaalsContact C-N 3.33Å; V694-N696 PolarHBondContact O-N 2.9Å; V694-T698 HydrophobicContact CG1-CG2 4.1Å; V694-T698 WeakPolarHBondContact O-CB 3.26Å; V694-T698 WeakPolarHBondContact O-CG2 3.35Å; V694-T698 PolarHBondContact O-OG1 2.93Å
695	Q	52.2	Low	50.5	Low	138 Å²	138	104.9 Å²	104.9	65%	0.645	52%	0.516	S	S	*	.	H	α-helix	trans	-67.5	-28.4	177.4	-75.7	174.3	-6.2	0	0	114	I691 K692 F693	I691-Q695 HydrophobicContact CG2-CG 4.41Å; I691-Q695 WeakPolarHBondContact O-CB 3.25Å; I691-Q695 VanDerWaalsContact O-CG 3.25Å; I691-Q695 WeakPolarHBondContact O-CG 3.26Å; I691-Q695 PolarHBondContact O-N 2.94Å; K692-Q695 PolarHBondContact O-N 2.78Å; F693-Q695 VanDerWaalsContact C-N 3.31Å; F693-Q695 PolarHBondContact O-N 3.29Å
696	N	46.3	Very low	48.8	Very low	121 Å²	121	108.2 Å²	108.2	65%	0.647	53%	0.533	S	S	*	.	H	α-helix	trans	-88.4	-31.4	-178	-81.2	-14.2	0	0	0	114.2	K692 F693 V694	K692-N696 PolarHBondContact O-N 2.93Å; K692-N696 VanDerWaalsContact O-N 3.14Å; F693-N696 PolarHBondContact O-N 3.02Å; V694-N696 VanDerWaalsContact C-N 3.33Å; V694-N696 PolarHBondContact O-N 2.9Å
697	H	47.9	Very low	47.7	Very low	118 Å²	118	105 Å²	105	55%	0.546	53%	0.527	S	S	.	.	H	α-helix	trans	-102.9	-3.2	-168.3	-66.4	89.9	0	0	0	115.7	F693 K699	F693-H697 AromaticContact CD2-CE1 3.57Å; F693-H697 AromaticContact CD2-ND1 3.22Å; F693-H697 WeakPolarHBondContact CD2-ND1 3.34Å; F693-H697 HydrophobicContact CE2-CB 4.29Å; F693-H697 AromaticContact CE2-CE1 3.55Å; F693-H697 AromaticContact CE2-CG 3.66Å; F693-H697 AromaticContact CE2-ND1 3.2Å; F693-H697 WeakPolarHBondContact CE2-ND1 3.3Å; F693-H697 HydrophobicContact CZ-CB 4.35Å; F693-H697 PolarHBondContact O-N 2.82Å; F693-H697 PolarHBondContact O-ND1 2.99Å; F693-H697 VanDerWaalsContact O-ND1 3.08Å; H697-K699 VanDerWaalsContact C-N 3.34Å; H697-K699 PolarHBondContact O-N 2.84Å
698	T	45.2	Very low	46.9	Very low	57 Å²	57	104.9 Å²	104.9	35%	0.35	52%	0.522	S	S	.	.			trans	-89.5	20.3	-171.3	47.4	0	0	0	0	115.8	V694 E700 L705	V694-T698 HydrophobicContact CG1-CG2 4.1Å; V694-T698 WeakPolarHBondContact O-CB 3.26Å; V694-T698 WeakPolarHBondContact O-CG2 3.35Å; V694-T698 PolarHBondContact O-OG1 2.93Å; T698-E700 PolarHBondContact O-N 3.35Å; T698-E700 VanDerWaalsContact O-N 3.13Å; T698-L705 HydrophobicContact CG2-CD1 3.51Å
699	K	41.7	Very low	46	Very low	185 Å²	185	106.2 Å²	106.2	80%	0.804	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-6.4	-173.3	-82.5	-174.7	175.8	174.6	0	116.8	H697	H697-K699 VanDerWaalsContact C-N 3.34Å; H697-K699 PolarHBondContact O-N 2.84Å
700	E	40.5	Very low	45.2	Very low	180 Å²	180	109 Å²	109	84%	0.841	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.5	5.1	-169.8	-59.9	-164.8	142.3	0	0	115.4	T698	T698-E700 PolarHBondContact O-N 3.35Å; T698-E700 VanDerWaalsContact O-N 3.13Å
701	N	36.2	Very low	44.4	Very low	116 Å²	116	112.3 Å²	112.3	62%	0.62	56%	0.555	S	S	*	*			trans	-147.7	62.7	176.5	-92.5	-63.3	0	0	0	113.8	Q703	N701-Q703 VanDerWaalsContact C-N 3.26Å; N701-Q703 PolarHBondContact O-N 3.36Å; N701-Q703 VanDerWaalsContact O-N 3.1Å
702	E	38.1	Very low	43.6	Very low	149 Å²	149	113.4 Å²	113.4	70%	0.696	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-8.8	-174	-79	-162.2	133.6	0	0	116.6	L706	E702-L706 WeakPolarHBondContact O-CB 3.4Å; E702-L706 WeakPolarHBondContact O-CD1 3.46Å
703	Q	41	Very low	42.5	Very low	177 Å²	177	112.1 Å²	112.1	83%	0.827	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-28.8	-176.7	-68	-170.2	-7.6	0	0	114.9	N701	N701-Q703 VanDerWaalsContact C-N 3.26Å; N701-Q703 PolarHBondContact O-N 3.36Å; N701-Q703 VanDerWaalsContact O-N 3.1Å
704	S	40.6	Very low	41.5	Very low	87 Å²	87	119.5 Å²	119.5	61%	0.608	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-45.9	-177.9	-53.3	0	0	0	0	112.5	L707 F708	S704-L707 PolarHBondContact O-N 3.36Å; S704-F708 PolarHBondContact O-N 3.13Å
705	L	39.8	Very low	40.3	Very low	65 Å²	65	121.9 Å²	121.9	34%	0.34	62%	0.616	S	S	.	*	H	α-helix	trans	-68.4	-35.2	-179.3	-84.3	154.1	0	0	0	112.8	T698 L707 F708 L709	T698-L705 HydrophobicContact CG2-CD1 3.51Å; L705-L707 VanDerWaalsContact C-N 3.26Å; L705-L707 PolarHBondContact O-N 2.98Å; L705-F708 PolarHBondContact O-N 3.45Å; L705-L709 WeakPolarHBondContact O-CB 3.5Å; L705-L709 WeakPolarHBondContact O-CG 3.4Å; L705-L709 PolarHBondContact O-N 3.18Å
706	L	39.5	Very low	39.4	Very low	86 Å²	86	123.1 Å²	123.1	45%	0.45	63%	0.625	S	S	.	*	H	α-helix	trans	-70	-20.8	178.4	-108.2	161.9	0	0	0	113.6	E702 K710	E702-L706 WeakPolarHBondContact O-CB 3.4Å; E702-L706 WeakPolarHBondContact O-CD1 3.46Å; L706-K710 WeakPolarHBondContact O-CB 3.49Å; L706-K710 WeakPolarHBondContact O-CD 3.39Å; L706-K710 WeakPolarHBondContact O-CG 2.79Å
707	L	39.7	Very low	38.5	Very low	111 Å²	111	123.7 Å²	123.7	58%	0.581	63%	0.633	S	S	*	*	H	α-helix	trans	-84.7	-40.9	171.6	-170.2	62.9	0	0	0	111.2	S704 L705 K710 N711	S704-L707 PolarHBondContact O-N 3.36Å; L705-L707 VanDerWaalsContact C-N 3.26Å; L705-L707 PolarHBondContact O-N 2.98Å; L707-K710 PolarHBondContact O-N 2.71Å; L707-N711 PolarHBondContact O-N 3.14Å; L707-N711 VanDerWaalsContact O-N 3.15Å
708	F	37.8	Very low	37.6	Very low	117 Å²	117	125.7 Å²	125.7	51%	0.513	65%	0.646	S	S	.	*	H	α-helix	trans	-60.5	-49.1	175.5	-171.4	-97.3	0	0	0	112	S704 L705 N711 Q712	S704-F708 PolarHBondContact O-N 3.13Å; L705-F708 PolarHBondContact O-N 3.45Å; F708-N711 PolarHBondContact O-N 3.47Å; F708-Q712 PolarHBondContact O-N 2.69Å
709	L	42.1	Very low	36.9	Very low	92 Å²	92	127.9 Å²	127.9	48%	0.482	66%	0.664	S	S	.	*	H	α-helix	trans	-62.9	-44	178.1	-71.3	166.6	0	0	0	111.9	L705 N711 Q712 T713	L705-L709 WeakPolarHBondContact O-CB 3.5Å; L705-L709 WeakPolarHBondContact O-CG 3.4Å; L705-L709 PolarHBondContact O-N 3.18Å; L709-N711 VanDerWaalsContact C-N 3.27Å; L709-N711 PolarHBondContact O-N 2.85Å; L709-Q712 PolarHBondContact O-N 2.86Å; L709-Q712 VanDerWaalsContact O-N 3.09Å; L709-T713 WeakPolarHBondContact O-CG2 3.46Å; L709-T713 PolarHBondContact O-N 2.82Å; L709-T713 PolarHBondContact O-OG1 2.82Å
710	K	40.3	Very low	36.2	Very low	142 Å²	142	125.6 Å²	125.6	62%	0.617	66%	0.66	S	S	*	*	H	α-helix	trans	-61.8	-31.7	177.9	-80.6	178	-177.8	175.4	0	113.7	L706 L707 Q712	L706-K710 WeakPolarHBondContact O-CB 3.49Å; L706-K710 WeakPolarHBondContact O-CD 3.39Å; L706-K710 WeakPolarHBondContact O-CG 2.79Å; L707-K710 PolarHBondContact O-N 2.71Å; K710-Q712 VanDerWaalsContact C-N 3.35Å
711	N	41.4	Very low	35.9	Very low	129 Å²	129	124.9 Å²	124.9	69%	0.69	66%	0.662	S	S	*	*	H	α-helix	trans	-81.2	-10.2	177.5	-76.6	-3	0	0	0	113.8	L707 F708 L709	L707-N711 PolarHBondContact O-N 3.14Å; L707-N711 VanDerWaalsContact O-N 3.15Å; F708-N711 PolarHBondContact O-N 3.47Å; L709-N711 VanDerWaalsContact C-N 3.27Å; L709-N711 PolarHBondContact O-N 2.85Å
712	Q	41.8	Very low	35.8	Very low	99 Å²	99	127.2 Å²	127.2	46%	0.463	67%	0.669	S	S	.	*	H	α-helix	trans	-106.1	-20.6	175.3	-67.1	-162.6	-9.9	0	0	114	F708 L709 K710 Q714	F708-Q712 PolarHBondContact O-N 2.69Å; L709-Q712 PolarHBondContact O-N 2.86Å; L709-Q712 VanDerWaalsContact O-N 3.09Å; K710-Q712 VanDerWaalsContact C-N 3.35Å; Q712-Q714 PolarHBondContact O-N 3.08Å
713	T	31.9	Very low	35.5	Very low	107 Å²	107	126.3 Å²	126.3	66%	0.656	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	34.6	179.9	54.8	0	0	0	0	114.8	L709	L709-T713 WeakPolarHBondContact O-CG2 3.46Å; L709-T713 PolarHBondContact O-N 2.82Å; L709-T713 PolarHBondContact O-OG1 2.82Å
714	Q	32.4	Very low	35.2	Very low	188 Å²	188	126.3 Å²	126.3	88%	0.879	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	9.2	178.3	-140	176.5	34.9	0	0	114.6	Q712	Q712-Q714 PolarHBondContact O-N 3.08Å
715	S	30.2	Very low	34.7	Very low	96 Å²	96	129.9 Å²	129.9	67%	0.671	68%	0.683	S	S	*	*	S	Bend	trans	-154.2	108	162.8	61	0	0	0	0	111.9
716	I	33	Very low	34.5	Very low	164 Å²	164	135.7 Å²	135.7	84%	0.841	71%	0.708	S	S	*	*			trans	171.2	106.3	145.7	-88.9	152.2	0	0	0	106.1
717	T	28.5	Very low	34.1	Very low	133 Å²	133	139 Å²	139	82%	0.816	73%	0.726	S	S	*	*			trans	-75.9	135.3	169.3	7.4	0	0	0	0	109.2	S719	T717-S719 PolarHBondContact O-N 2.89Å
718	I	28.2	Very low	33.9	Very low	159 Å²	159	139.5 Å²	139.5	82%	0.815	74%	0.739	S	S	*	*			trans	-76.6	109.1	172.2	-58.8	169.6	0	0	0	108.1
719	S	29.4	Very low	33.6	Very low	104 Å²	104	141 Å²	141	73%	0.727	76%	0.758	S	S	*	*			trans	-126.9	113.1	167.9	57	0	0	0	0	109.3	T717	T717-S719 PolarHBondContact O-N 2.89Å
720	N	28.3	Very low	33.1	Very low	137 Å²	137	140.6 Å²	140.6	73%	0.733	78%	0.775	S	S	*	*			trans	-72.8	135.1	166	-47.7	-35.1	0	0	0	107.9
721	D	34.5	Very low	32.6	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	79%	0.788	S	S	*	*				177	171.8	126.4	-90.8	-17.3	0	0	0	111.8
722	H	32.5	Very low	32.2	Very low	164 Å²	164	144.3 Å²	144.3	76%	0.759	80%	0.795	S	S	*	*			trans	-80	157.5	-172.2	-103.2	-87.9	0	0	0	114.6
723	D	33.1	Very low	31.8	Very low	131 Å²	131	145.2 Å²	145.2	70%	0.701	81%	0.806	S	S	*	*			trans	44.3	120.6	147.9	-51.3	-8.5	0	0	0	120.2
724	L	35.3	Very low	31.6	Very low	177 Å²	177	147.8 Å²	147.8	93%	0.927	81%	0.811	S	S	*	*				-178.8	165.6	116.6	-97.8	161.5	0	0	0	113.2
725	M	28.8	Very low	31.5	Very low	162 Å²	162	146 Å²	146	80%	0.798	80%	0.802	S	S	*	*			trans	-108.3	150.9	-178.2	-46.2	-175.2	82.7	0	0	111.8
726	H	35.8	Very low	31.5	Very low	186 Å²	186	149.5 Å²	149.5	86%	0.861	81%	0.808	S	S	*	*				-175.5	155.4	113	-113.4	-89.5	0	0	0	113.8
727	N	30	Very low	31.3	Very low	155 Å²	155	147.5 Å²	147.5	83%	0.829	80%	0.804	S	S	*	*			trans	-82.8	145.5	176.5	-64.5	-23	0	0	0	112.8
728	S	36.5	Very low	31.2	Very low	123 Å²	123	151.1 Å²	151.1	86%	0.86	81%	0.808	S	S	*	*			trans	-154.7	145.8	137.5	52.8	0	0	0	0	112.5
729	T	30.9	Very low	31.4	Very low	149 Å²	149	154.7 Å²	154.7	91%	0.914	81%	0.811	S	S	*	*			trans	-70.6	143.1	-170.5	47.5	0	0	0	0	114.8
730	G	31.4	Very low	31.5	Very low	82 Å²	82	154.4 Å²	154.4	85%	0.845	81%	0.809	S	S	*	*			trans	-168.2	106.3	166.3	0	0	0	0	0	112
731	E	30.1	Very low	31.9	Very low	189 Å²	189	154.7 Å²	154.7	88%	0.883	81%	0.809	S	S	*	*			trans	-109.5	126.6	-176	175.6	178.2	-133.7	0	0	110.2
732	I	34.6	Very low	32.4	Very low	161 Å²	161	151.1 Å²	151.1	83%	0.826	80%	0.797	S	S	*	*			trans	-165.6	127.3	165.5	-107.3	151	0	0	0	112.1
733	V	32.2	Very low	33.5	Very low	117 Å²	117	146.2 Å²	146.2	71%	0.709	78%	0.775	S	S	*	*			trans	41.4	96.7	149	-166.6	0	0	0	0	119.9
734	E	27.6	Very low	35.2	Very low	162 Å²	162	142.8 Å²	142.8	76%	0.757	76%	0.756	S	S	*	*				51	145.8	106.9	-136.8	166.1	-160.2	0	0	123.1
735	H	30.4	Very low	37.1	Very low	150 Å²	150	135.5 Å²	135.5	69%	0.694	72%	0.719	S	S	*	*			trans	85.9	118.2	165.6	-67.3	-62.4	0	0	0	122.5
736	Q	29.6	Very low	39.5	Very low	169 Å²	169	133.2 Å²	133.2	79%	0.79	71%	0.706	S	S	*	*			trans	75.5	78.5	145.3	-65.4	-176.8	-10.9	0	0	120.2
737	T	28.8	Very low	41.7	Very low	123 Å²	123	130 Å²	130	76%	0.755	69%	0.69	S	S	*	*				62.9	76.2	126.8	50.2	0	0	0	0	119.1	R739	T737-R739 PolarHBondContact O-N 2.82Å
738	K	27.3	Very low	44.5	Very low	208 Å²	208	122.7 Å²	122.7	90%	0.904	65%	0.651	S	S	*	*			trans	-72.7	110.1	138.8	-69.9	178.4	179.2	176.3	0	109
739	R	31.7	Very low	47	Very low	235 Å²	235	118 Å²	118	89%	0.887	62%	0.617	S	S	*	*			trans	-107	84	161.9	-93.3	-171.4	172.7	-176.1	-2.1	109.3	T737	T737-R739 PolarHBondContact O-N 2.82Å
740	S	33.1	Very low	49.8	Very low	97 Å²	97	115.7 Å²	115.7	68%	0.678	60%	0.596	S	S	*	*			trans	-67.5	129.2	160.9	46.6	0	0	0	0	108.8	S742	S740-S742 PolarHBondContact O-N 3.01Å
741	I	35.6	Very low	52.7	Low	143 Å²	143	113.6 Å²	113.6	73%	0.733	57%	0.565	S	S	*	*			trans	-79.5	73.1	179.8	-54.5	173.4	0	0	0	108.9
742	S	45	Very low	55.7	Low	91 Å²	91	104.6 Å²	104.6	64%	0.636	52%	0.523	S	S	*	.			trans	-81.2	113.5	162.5	53.1	0	0	0	0	108.1	S740 D744	S740-S742 PolarHBondContact O-N 3.01Å; S742-D744 PolarHBondContact O-N 3.2Å
743	H	55.1	Low	58.5	Low	61 Å²	61	100.8 Å²	100.8	28%	0.282	50%	0.499	S	S	.	.			trans	-63.9	119.2	175.3	-176	61.1	0	0	0	109.5	Y690 T745 D748 Q772 Y776	Y690-H743 AromaticContact CE2-CD2 3.53Å; Y690-H743 AromaticContact CZ-CD2 3.69Å; H743-T745 PolarHBondContact O-N 3.44Å; H743-D748 IonicContact CE1-OD2 3.01Å; H743-D748 PolarHBondContact CE1-OD2 2.99Å; H743-D748 IonicContact NE2-OD2 3.07Å; H743-Q772 PolarHBondContact CE1-NE2 3.15Å; H743-Y776 AromaticContact NE2-CD2 3.24Å; H743-Y776 WeakPolarHBondContact NE2-CD2 3.41Å; H743-Y776 AromaticContact NE2-CE2 3.85Å
744	D	70.3	Confident	61.5	Low	58 Å²	58	96 Å²	96	31%	0.31	47%	0.469	S	S	.	.			trans	-98.8	86.4	-163.6	-170	-22	0	0	0	110.8	S742 Q746 K747 D748	S742-D744 PolarHBondContact O-N 3.2Å; D744-Q746 PolarHBondContact O-N 2.94Å; D744-Q746 WeakPolarHBondContact OD1-CB 3.43Å; D744-Q746 PolarHBondContact OD1-N 2.86Å; D744-Q746 VanDerWaalsContact OD1-N 3.16Å; D744-K747 HydrophobicContact CB-CB 4.3Å; D744-K747 HydrophobicContact CB-CD 4.41Å; D744-K747 HydrophobicContact CB-CG 4.27Å; D744-K747 PolarHBondContact O-N 2.8Å; D744-K747 PolarHBondContact OD1-N 2.87Å; D744-K747 IonicContact OD2-NZ 2.69Å; D744-K747 PolarHBondContact OD2-NZ 3.4Å; D744-D748 PolarHBondContact O-N 2.81Å; D744-D748 VanDerWaalsContact O-N 3.1Å
745	T	75.2	Confident	64.6	Low	24 Å²	24	91.1 Å²	91.1	15%	0.147	45%	0.448	C	S	.	.	H	α-helix	trans	-64.1	-6.4	-177.8	63.4	0	0	0	0	113.7	S684 L685 H743 V749	S684-T745 WeakPolarHBondContact CA-O 3.48Å; S684-T745 WeakPolarHBondContact CB-O 3.43Å; L685-T745 HydrophobicContact CB-CG2 4.05Å; L685-T745 PolarHBondContact O-OG1 3.34Å; H743-T745 PolarHBondContact O-N 3.44Å; T745-V749 WeakPolarHBondContact O-CG2 3.46Å
746	Q	78.7	Confident	67.6	Low	114 Å²	114	87.1 Å²	87.1	53%	0.533	44%	0.436	S	S	.	.	H	α-helix	trans	-81.4	-46.8	168	-165.9	-171.2	-57.3	0	0	111	D744 D748 V749 E750	D744-Q746 PolarHBondContact O-N 2.94Å; D744-Q746 WeakPolarHBondContact OD1-CB 3.43Å; D744-Q746 PolarHBondContact OD1-N 2.86Å; D744-Q746 VanDerWaalsContact OD1-N 3.16Å; Q746-D748 VanDerWaalsContact C-N 3.26Å; Q746-D748 PolarHBondContact O-N 3.11Å; Q746-V749 PolarHBondContact O-N 2.79Å; Q746-V749 VanDerWaalsContact O-N 3.15Å; Q746-E750 PolarHBondContact NE2-OE1 2.95Å; Q746-E750 WeakPolarHBondContact O-CG 3.35Å; Q746-E750 PolarHBondContact O-N 3.36Å; Q746-E750 VanDerWaalsContact O-N 3.16Å
747	K	82.8	Confident	70.5	Confident	119 Å²	119	86.2 Å²	86.2	52%	0.517	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-36.1	173.6	-69.6	-170	-177.7	77.2	0	112.2	D744 V749 E750 N751	D744-K747 HydrophobicContact CB-CB 4.3Å; D744-K747 HydrophobicContact CB-CD 4.41Å; D744-K747 HydrophobicContact CB-CG 4.27Å; D744-K747 PolarHBondContact O-N 2.8Å; D744-K747 PolarHBondContact OD1-N 2.87Å; D744-K747 IonicContact OD2-NZ 2.69Å; D744-K747 PolarHBondContact OD2-NZ 3.4Å; K747-V749 VanDerWaalsContact C-N 3.29Å; K747-V749 PolarHBondContact O-N 2.9Å; K747-E750 PolarHBondContact O-N 3.37Å; K747-E750 VanDerWaalsContact O-N 3.16Å; K747-N751 PolarHBondContact O-N 3.21Å; K747-N751 PolarHBondContact O-ND2 3.5Å
748	D	88	Confident	73.4	Confident	1 Å²	1	82.8 Å²	82.8	1%	0.005	42%	0.416	C	S	.	.	H	α-helix	trans	-56.4	-43.9	174.2	-79.4	22.7	0	0	0	111.6	H743 D744 Q746 F752 Q772 Y775 Y776	H743-D748 IonicContact CE1-OD2 3.01Å; H743-D748 PolarHBondContact CE1-OD2 2.99Å; H743-D748 IonicContact NE2-OD2 3.07Å; D744-D748 PolarHBondContact O-N 2.81Å; D744-D748 VanDerWaalsContact O-N 3.1Å; Q746-D748 VanDerWaalsContact C-N 3.26Å; Q746-D748 PolarHBondContact O-N 3.11Å; D748-F752 VanDerWaalsContact O-CD2 3.26Å; D748-F752 WeakPolarHBondContact O-CD2 3.32Å; D748-Q772 PolarHBondContact OD1-NE2 3.35Å; D748-Q772 PolarHBondContact OD2-NE2 3.23Å; D748-Y775 HydrophobicContact CB-CD1 4.21Å; D748-Y775 VanDerWaalsContact OD2-CA 3.3Å; D748-Y775 WeakPolarHBondContact OD2-CA 3.11Å; D748-Y776 PolarHBondContact OD2-N 2.79Å
749	V	88.5	Confident	76.4	Confident	26 Å²	26	72.9 Å²	72.9	16%	0.158	37%	0.373	C	S	.	.	H	α-helix	trans	-66.4	-39.1	176.3	172.5	0	0	0	0	112.3	L682 T745 Q746 K747 N751 F752 F777	L682-V749 HydrophobicContact CB-CG1 3.87Å; T745-V749 WeakPolarHBondContact O-CG2 3.46Å; Q746-V749 PolarHBondContact O-N 2.79Å; Q746-V749 VanDerWaalsContact O-N 3.15Å; K747-V749 VanDerWaalsContact C-N 3.29Å; K747-V749 PolarHBondContact O-N 2.9Å; V749-N751 PolarHBondContact O-N 3.18Å; V749-F752 PolarHBondContact O-N 3.44Å; V749-F777 HydrophobicContact CG2-CB 3.48Å; V749-F777 VanDerWaalsContact CG2-CB 3.48Å; V749-F777 HydrophobicContact CG2-CG 4.28Å
750	E	90.2	Very high	79.3	Confident	99 Å²	99	64.1 Å²	64.1	46%	0.463	34%	0.342	S	S	.	.	H	α-helix	trans	-60.7	-30.2	-176.8	-71.7	167.6	-167	0	0	111.9	Q746 K747 F752 R764	Q746-E750 PolarHBondContact NE2-OE1 2.95Å; Q746-E750 WeakPolarHBondContact O-CG 3.35Å; Q746-E750 PolarHBondContact O-N 3.36Å; Q746-E750 VanDerWaalsContact O-N 3.16Å; K747-E750 PolarHBondContact O-N 3.37Å; K747-E750 VanDerWaalsContact O-N 3.16Å; E750-F752 VanDerWaalsContact C-N 3.27Å; E750-F752 PolarHBondContact O-N 3.22Å; E750-R764 VanDerWaalsContact O-CD 3.25Å; E750-R764 WeakPolarHBondContact O-CD 3.3Å; E750-R764 PolarHBondContact O-NE 2.83Å
751	N	91.8	Very high	82.2	Confident	38 Å²	38	59.5 Å²	59.5	20%	0.203	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-8.3	175.8	-72.7	-48.5	0	0	0	115.4	K747 V749 R764 T765 L767 Y775	K747-N751 PolarHBondContact O-N 3.21Å; K747-N751 PolarHBondContact O-ND2 3.5Å; V749-N751 PolarHBondContact O-N 3.18Å; N751-R764 WeakPolarHBondContact O-CB 3.42Å; N751-R764 PolarHBondContact O-N 3.45Å; N751-T765 PolarHBondContact OD1-OG1 3.38Å; N751-L767 HydrophobicContact CB-CD2 4.05Å; N751-Y775 WeakPolarHBondContact ND2-CE1 3.11Å
752	F	93.9	Very high	84.9	Confident	1 Å²	1	56 Å²	56	0%	0.004	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	169.6	-177.7	-64.2	-91.3	0	0	0	112.8	V647 L682 D748 V749 E750 L761 R762 T763 R764 L767 Y775 F777 V800	V647-F752 HydrophobicContact CG2-CD1 4.15Å; V647-F752 HydrophobicContact CG2-CE1 3.93Å; L682-F752 HydrophobicContact CD1-CB 3.9Å; D748-F752 VanDerWaalsContact O-CD2 3.26Å; D748-F752 WeakPolarHBondContact O-CD2 3.32Å; V749-F752 PolarHBondContact O-N 3.44Å; E750-F752 VanDerWaalsContact C-N 3.27Å; E750-F752 PolarHBondContact O-N 3.22Å; F752-L761 HydrophobicContact CB-CD1 4.25Å; F752-L761 HydrophobicContact CD1-CD1 4.48Å; F752-R762 CarbonylContact C-O 3.58Å; F752-R762 VanDerWaalsContact CA-O 3.32Å; F752-R762 WeakPolarHBondContact CA-O 3.47Å; F752-R762 WeakPolarHBondContact CD1-O 3.45Å; F752-T763 HydrophobicContact CD1-CG2 4.28Å; F752-T763 HydrophobicContact CE1-CG2 3.81Å; F752-R764 PolarHBondContact O-NH2 2.91Å; F752-L767 HydrophobicContact CE1-CD1 4.16Å; F752-L767 HydrophobicContact CZ-CD1 3.69Å; F752-Y775 HydrophobicContact CE2-CD1 4.17Å; F752-Y775 AromaticContact CE2-CD2 3.99Å; F752-Y775 HydrophobicContact CE2-CD2 3.99Å; F752-Y775 AromaticContact CE2-CG 3.69Å; F752-Y775 HydrophobicContact CE2-CG 3.69Å; F752-Y775 AromaticContact CZ-CD2 3.96Å; F752-Y775 HydrophobicContact CZ-CD2 3.96Å; F752-Y775 HydrophobicContact CZ-CG 4.12Å; F752-F777 HydrophobicContact CB-CE1 4.42Å; F752-F777 HydrophobicContact CB-CZ 4.13Å; F752-F777 HydrophobicContact CD1-CE1 4.44Å; F752-F777 HydrophobicContact CD1-CZ 4.21Å; F752-F777 HydrophobicContact CD2-CD1 4.23Å; F752-F777 AromaticContact CD2-CE1 3.41Å; F752-F777 HydrophobicContact CD2-CE1 3.41Å; F752-F777 VanDerWaalsContact CD2-CE1 3.41Å; F752-F777 AromaticContact CD2-CZ 3.88Å; F752-F777 HydrophobicContact CD2-CZ 3.88Å; F752-F777 AromaticContact CE2-CE1 3.7Å; F752-F777 HydrophobicContact CE2-CE1 3.7Å; F752-F777 HydrophobicContact CE2-CZ 4.4Å; F752-F777 AromaticContact CG-CE1 3.84Å; F752-F777 HydrophobicContact CG-CE1 3.84Å; F752-F777 AromaticContact CG-CZ 3.8Å; F752-F777 HydrophobicContact CG-CZ 3.8Å; F752-F777 HydrophobicContact CZ-CE1 4.33Å; F752-V800 HydrophobicContact CD1-CG2 4.45Å; F752-V800 HydrophobicContact CE1-CB 4.11Å; F752-V800 HydrophobicContact CE1-CG1 3.85Å; F752-V800 HydrophobicContact CE1-CG2 3.84Å; F752-V800 HydrophobicContact CZ-CB 3.82Å; F752-V800 HydrophobicContact CZ-CG1 3.81Å; F752-V800 HydrophobicContact CZ-CG2 3.91Å
753	Y	93.7	Very high	87.2	Confident	80 Å²	80	51.6 Å²	51.6	31%	0.314	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	158.7	160.9	73.7	-84.2	0	0	0	111.2	N644 R762	N644-Y753 PolarHBondContact OD1-OH 3.5Å; Y753-R762 HydrophobicContact CD1-CB 3.99Å; Y753-R762 HydrophobicContact CE1-CB 3.6Å; Y753-R762 HydrophobicContact CE1-CG 4.5Å; Y753-R762 HydrophobicContact CE2-CB 4.37Å; Y753-R762 VanDerWaalsContact CZ-CD 3.44Å; Y753-R762 PolarHBondContact N-O 2.86Å; Y753-R762 PolarHBondContact O-N 3Å; Y753-R762 WeakPolarHBondContact OH-CD 3.34Å
754	I	95.1	Very high	88.9	Confident	17 Å²	17	55.6 Å²	55.6	9%	0.087	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143	174.6	-162	167.5	0	0	0	109.5	I665 L682 Q760 V779	I665-I754 HydrophobicContact CB-CD1 4.29Å; I665-I754 HydrophobicContact CD1-CD1 4.09Å; L682-I754 HydrophobicContact CD2-CB 3.97Å; L682-I754 HydrophobicContact CD2-CD1 4.35Å; L682-I754 HydrophobicContact CD2-CG2 3.94Å; L682-I754 HydrophobicContact CG-CB 4.11Å; L682-I754 HydrophobicContact CG-CG2 3.85Å; I754-Q760 WeakPolarHBondContact CA-O 3.36Å; I754-V779 HydrophobicContact CD1-CG2 3.69Å
755	D	92	Very high	89.8	Confident	59 Å²	59	55.4 Å²	55.4	32%	0.316	27%	0.27	S	S	.	.			trans	-70.3	120.2	166.9	178.5	-22.9	0	0	0	109.2	I757 S758 G759 Q760	D755-I757 PolarHBondContact O-N 3.11Å; D755-I757 PolarHBondContact OD1-N 3.13Å; D755-S758 VanDerWaalsContact CB-OG 3.25Å; D755-S758 WeakPolarHBondContact CB-OG 3.33Å; D755-S758 PolarHBondContact OD1-N 3.08Å; D755-S758 VanDerWaalsContact OD2-CB 3.29Å; D755-S758 WeakPolarHBondContact OD2-CB 3.43Å; D755-S758 PolarHBondContact OD2-OG 2.99Å; D755-G759 WeakPolarHBondContact O-CA 3.43Å; D755-G759 PolarHBondContact O-N 2.87Å; D755-Q760 HydrophobicContact CB-CB 4.4Å; D755-Q760 PolarHBondContact N-O 2.78Å
756	P	92.6	Very high	90.5	Very high	67 Å²	67	60.8 Å²	60.8	44%	0.435	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15	-175.5	29.8	-36.2	0	0	0	113.7	A679 Y680	A679-P756 CarbonylContact C-O 3.42Å; A679-P756 VanDerWaalsContact CA-O 3.24Å; A679-P756 WeakPolarHBondContact CA-O 3.47Å; Y680-P756 PolarHBondContact N-O 2.9Å; Y680-P756 WeakPolarHBondContact O-CA 3.49Å; Y680-P756 WeakPolarHBondContact O-CB 3.33Å
757	I	90.4	Very high	91	Very high	149 Å²	149	55.6 Å²	55.6	76%	0.764	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-50.7	177.7	-57.9	175.9	0	0	0	110.4	D755	D755-I757 PolarHBondContact O-N 3.11Å; D755-I757 PolarHBondContact OD1-N 3.13Å
758	S	89.8	Confident	91.4	Very high	52 Å²	52	52.3 Å²	52.3	36%	0.364	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-17.9	-174.4	77	0	0	0	0	114.7	V664 D755 Q760	V664-S758 WeakPolarHBondContact CG1-O 3.37Å; D755-S758 VanDerWaalsContact CB-OG 3.25Å; D755-S758 WeakPolarHBondContact CB-OG 3.33Å; D755-S758 PolarHBondContact OD1-N 3.08Å; D755-S758 VanDerWaalsContact OD2-CB 3.29Å; D755-S758 WeakPolarHBondContact OD2-CB 3.43Å; D755-S758 PolarHBondContact OD2-OG 2.99Å; S758-Q760 PolarHBondContact O-N 3.07Å; S758-Q760 PolarHBondContact OG-N 3.1Å
759	G	91	Very high	91.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.258	C	S	.	.			trans	73.2	9.1	-176	0	0	0	0	0	114.5	I665 D755 L761	I665-G759 PolarHBondContact N-O 3.29Å; I665-G759 WeakPolarHBondContact O-CA 3.48Å; D755-G759 WeakPolarHBondContact O-CA 3.43Å; D755-G759 PolarHBondContact O-N 2.87Å; G759-L761 PolarHBondContact O-N 2.79Å
760	Q	91.9	Very high	91.5	Very high	50 Å²	50	54.4 Å²	54.4	23%	0.234	27%	0.266	C	S	.	.			trans	-70.7	121.7	176.2	-176.7	170.3	100	0	0	111.3	V646 V664 I754 D755 S758 R762	V646-Q760 HydrophobicContact CG1-CG 3.88Å; V646-Q760 HydrophobicContact CG2-CG 4.09Å; V664-Q760 HydrophobicContact CG2-CB 4.45Å; I754-Q760 WeakPolarHBondContact CA-O 3.36Å; D755-Q760 HydrophobicContact CB-CB 4.4Å; D755-Q760 PolarHBondContact N-O 2.78Å; S758-Q760 PolarHBondContact O-N 3.07Å; S758-Q760 PolarHBondContact OG-N 3.1Å; Q760-R762 HydrophobicContact CG-CG 4.48Å; Q760-R762 VanDerWaalsContact OE1-CZ 3.31Å
761	L	94.1	Very high	91.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	135.9	177.6	-179.1	67.9	0	0	0	111.1	V647 I665 L682 F752 G759 F777 V798 V800	V647-L761 HydrophobicContact CB-CB 4.37Å; V647-L761 HydrophobicContact CB-CD2 3.92Å; V647-L761 HydrophobicContact CB-CG 4.08Å; V647-L761 HydrophobicContact CG1-CD2 4.11Å; V647-L761 HydrophobicContact CG2-CD2 3.96Å; V647-L761 HydrophobicContact CG2-CG 3.87Å; V647-L761 PolarHBondContact N-O 2.97Å; I665-L761 HydrophobicContact CD1-CB 4.46Å; I665-L761 HydrophobicContact CD1-CD2 4.35Å; L682-L761 HydrophobicContact CD1-CD1 4.23Å; L682-L761 HydrophobicContact CD2-CD1 4.24Å; F752-L761 HydrophobicContact CB-CD1 4.25Å; F752-L761 HydrophobicContact CD1-CD1 4.48Å; G759-L761 PolarHBondContact O-N 2.79Å; L761-F777 HydrophobicContact CD1-CE2 3.86Å; L761-F777 HydrophobicContact CD1-CZ 3.94Å; L761-F777 HydrophobicContact CD2-CE2 4.26Å; L761-F777 HydrophobicContact CD2-CZ 4.03Å; L761-V798 HydrophobicContact CD2-CG1 3.82Å; L761-V800 HydrophobicContact CD2-CG2 4.08Å
762	R	93.4	Very high	91.1	Very high	69 Å²	69	58 Å²	58	26%	0.26	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.7	-178.8	-72.9	175.6	176.4	-126.3	-0.9	113.4	N644 T645 V646 F752 Y753 Q760	N644-R762 PolarHBondContact O-NH1 3.2Å; N644-R762 PolarHBondContact OD1-NH1 2.94Å; T645-R762 VanDerWaalsContact O-CA 3.25Å; T645-R762 WeakPolarHBondContact O-CA 3.34Å; V646-R762 HydrophobicContact CG2-CG 4.03Å; F752-R762 CarbonylContact C-O 3.58Å; F752-R762 VanDerWaalsContact CA-O 3.32Å; F752-R762 WeakPolarHBondContact CA-O 3.47Å; F752-R762 WeakPolarHBondContact CD1-O 3.45Å; Y753-R762 HydrophobicContact CD1-CB 3.99Å; Y753-R762 HydrophobicContact CE1-CB 3.6Å; Y753-R762 HydrophobicContact CE1-CG 4.5Å; Y753-R762 HydrophobicContact CE2-CB 4.37Å; Y753-R762 VanDerWaalsContact CZ-CD 3.44Å; Y753-R762 PolarHBondContact N-O 2.86Å; Y753-R762 PolarHBondContact O-N 3Å; Y753-R762 WeakPolarHBondContact OH-CD 3.34Å; Q760-R762 HydrophobicContact CG-CG 4.48Å; Q760-R762 VanDerWaalsContact OE1-CZ 3.31Å
763	T	93.2	Very high	90.7	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	141	164.7	56.6	0	0	0	0	110.7	V638 T642 N644 T645 F752 L767	V638-T763 HydrophobicContact CB-CG2 4.45Å; V638-T763 HydrophobicContact CG1-CG2 4.05Å; V638-T763 HydrophobicContact CG2-CG2 3.85Å; T642-T763 PolarHBondContact O-OG1 3.36Å; N644-T763 WeakPolarHBondContact CA-O 3.35Å; N644-T763 PolarHBondContact N-O 2.82Å; N644-T763 VanDerWaalsContact N-O 3.1Å; N644-T763 PolarHBondContact N-OG1 2.68Å; T645-T763 PolarHBondContact N-OG1 2.78Å; T645-T763 PolarHBondContact O-N 3.4Å; F752-T763 HydrophobicContact CD1-CG2 4.28Å; F752-T763 HydrophobicContact CE1-CG2 3.81Å; T763-L767 HydrophobicContact CG2-CD1 3.69Å; T763-L767 HydrophobicContact CG2-CG 4.15Å
764	R	90.3	Very high	90.5	Very high	144 Å²	144	57.8 Å²	57.8	54%	0.543	29%	0.287	S	S	.	.	S	Bend	trans	-91.7	-40.8	170.8	-174.4	-171.1	-55.5	-83.1	-6.2	110.9	E750 N751 F752	E750-R764 VanDerWaalsContact O-CD 3.25Å; E750-R764 WeakPolarHBondContact O-CD 3.3Å; E750-R764 PolarHBondContact O-NE 2.83Å; N751-R764 WeakPolarHBondContact O-CB 3.42Å; N751-R764 PolarHBondContact O-N 3.45Å; F752-R764 PolarHBondContact O-NH2 2.91Å
765	T	88.9	Confident	90.2	Very high	54 Å²	54	57.6 Å²	57.6	33%	0.331	29%	0.285	S	S	.	.	S	Bend	trans	-111.6	166.2	-175.1	34.5	0	0	0	0	110.5	A643 N751	A643-T765 WeakPolarHBondContact CA-O 3.16Å; N751-T765 PolarHBondContact OD1-OG1 3.38Å
766	E	89.4	Confident	90	Very high	138 Å²	138	57 Å²	57	65%	0.645	28%	0.279	S	S	*	.			trans	-71.4	135.5	160.7	-69	164.4	173.8	0	0	107.5	A643	A643-E766 HydrophobicContact CB-CG 3.79Å
767	L	91	Very high	89.9	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.021	26%	0.258	C	S	.	.			trans	-106.8	158.9	178.9	-50.8	-178.3	0	0	0	109	V638 E640 N641 N751 F752 T763 Y775 V802	V638-L767 HydrophobicContact CG1-CD1 3.89Å; E640-L767 CarbonylContact C-O 3.5Å; E640-L767 WeakPolarHBondContact CA-O 3.4Å; E640-L767 VanDerWaalsContact CB-O 3.29Å; E640-L767 WeakPolarHBondContact CB-O 3.35Å; N641-L767 PolarHBondContact N-O 3.27Å; N751-L767 HydrophobicContact CB-CD2 4.05Å; F752-L767 HydrophobicContact CE1-CD1 4.16Å; F752-L767 HydrophobicContact CZ-CD1 3.69Å; T763-L767 HydrophobicContact CG2-CD1 3.69Å; T763-L767 HydrophobicContact CG2-CG 4.15Å; L767-Y775 HydrophobicContact CB-CE2 4.38Å; L767-Y775 HydrophobicContact CD1-CD2 4.26Å; L767-Y775 HydrophobicContact CD1-CE2 3.79Å; L767-Y775 HydrophobicContact CD2-CE2 4.14Å; L767-Y775 HydrophobicContact CG-CE2 4.32Å; L767-V802 HydrophobicContact CB-CG2 4.34Å; L767-V802 HydrophobicContact CD1-CG2 4.23Å
768	D	90.4	Very high	89.8	Confident	51 Å²	51	47.1 Å²	47.1	27%	0.273	23%	0.225	S	C	.	.			trans	-136.7	122.8	-170.1	169.3	-43.8	0	0	0	107.7	E770 Q771 Q772	D768-E770 PolarHBondContact OD1-N 3.12Å; D768-Q771 HydrophobicContact CB-CB 4.2Å; D768-Q771 HydrophobicContact CB-CG 4.41Å; D768-Q771 VanDerWaalsContact OD1-CB 3.3Å; D768-Q771 WeakPolarHBondContact OD1-CB 3.45Å; D768-Q771 WeakPolarHBondContact OD1-CG 3.19Å; D768-Q771 PolarHBondContact OD1-N 3.05Å; D768-Q771 PolarHBondContact OD2-NE2 3.35Å; D768-Q772 CarbonylContact O-C 3.26Å; D768-Q772 PolarHBondContact O-N 3Å
769	C	89.2	Confident	90	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.014	21%	0.208	C	C	.	.	H	α-helix	trans	-71.9	-39.1	-171.9	-168.1	0	0	0	0	111.8	E640 N773 V802 D804 R841	E640-C769 VanDerWaalsContact OE1-CB 3.26Å; E640-C769 WeakPolarHBondContact OE1-CB 3.37Å; E640-C769 WeakPolarHBondContact OE2-CB 3.4Å; E640-C769 PolarHBondContact OE2-N 2.83Å; C769-N773 WeakPolarHBondContact O-CB 3.39Å; C769-N773 PolarHBondContact O-N 2.97Å; C769-V802 HydrophobicContact CB-CG1 4.19Å; C769-D804 PolarHBondContact SG-OD1 3.42Å; C769-R841 VanDerWaalsContact SG-CB 3.54Å; C769-R841 PolarHBondContact SG-NH1 3.23Å
770	E	88.8	Confident	90.1	Very high	68 Å²	68	46 Å²	46	32%	0.318	22%	0.215	S	C	.	.	H	α-helix	trans	-67.7	-34.1	179.9	-79.2	50.9	-108.4	0	0	112.1	D768 N808 A839 D840 R841	D768-E770 PolarHBondContact OD1-N 3.12Å; E770-N808 PolarHBondContact OE2-ND2 3.3Å; E770-A839 HydrophobicContact CG-CB 4.47Å; E770-D840 VanDerWaalsContact OE1-C 3.26Å; E770-D840 WeakPolarHBondContact OE1-CA 3.34Å; E770-R841 WeakPolarHBondContact OE1-CA 3.01Å; E770-R841 WeakPolarHBondContact OE1-CB 3.42Å; E770-R841 PolarHBondContact OE1-N 3.18Å
771	Q	86.7	Confident	90.2	Very high	162 Å²	162	43.7 Å²	43.7	76%	0.757	20%	0.204	S	C	*	.	H	α-helix	trans	-79.1	-52.4	174.9	-72.5	-173	65.3	0	0	112.4	D768	D768-Q771 HydrophobicContact CB-CB 4.2Å; D768-Q771 HydrophobicContact CB-CG 4.41Å; D768-Q771 VanDerWaalsContact OD1-CB 3.3Å; D768-Q771 WeakPolarHBondContact OD1-CB 3.45Å; D768-Q771 WeakPolarHBondContact OD1-CG 3.19Å; D768-Q771 PolarHBondContact OD1-N 3.05Å; D768-Q771 PolarHBondContact OD2-NE2 3.35Å
772	Q	86.8	Confident	90.2	Very high	52 Å²	52	46.2 Å²	46.2	24%	0.243	22%	0.217	C	C	.	.	H	α-helix	trans	-153.9	89.7	-178.1	-174.2	167.6	-16.7	0	0	113.1	H743 D748 D768 V774 Y775	H743-Q772 PolarHBondContact CE1-NE2 3.15Å; D748-Q772 PolarHBondContact OD1-NE2 3.35Å; D748-Q772 PolarHBondContact OD2-NE2 3.23Å; D768-Q772 CarbonylContact O-C 3.26Å; D768-Q772 PolarHBondContact O-N 3Å; Q772-V774 VanDerWaalsContact C-N 3.26Å; Q772-V774 VanDerWaalsContact CG-O 3.26Å; Q772-V774 WeakPolarHBondContact CG-O 3.45Å; Q772-V774 PolarHBondContact NE2-O 3.26Å; Q772-V774 PolarHBondContact O-N 2.99Å; Q772-Y775 HydrophobicContact CB-CE1 4.19Å; Q772-Y775 HydrophobicContact CG-CD1 4.17Å; Q772-Y775 HydrophobicContact CG-CE1 3.78Å; Q772-Y775 HydrophobicContact CG-CE2 4.27Å; Q772-Y775 VanDerWaalsContact O-CE2 3.24Å; Q772-Y775 WeakPolarHBondContact O-CE2 3.32Å
773	N	86.7	Confident	90.3	Very high	52 Å²	52	42.9 Å²	42.9	28%	0.278	20%	0.204	S	C	.	.	S	Bend	trans	-71.2	-6.9	-179.9	78.6	-70.6	0	0	0	116.3	C769 V802 R841	C769-N773 WeakPolarHBondContact O-CB 3.39Å; C769-N773 PolarHBondContact O-N 2.97Å; N773-V802 PolarHBondContact O-N 2.75Å; N773-R841 PolarHBondContact ND2-NE 3.33Å; N773-R841 PolarHBondContact ND2-NH2 3.35Å
774	V	88.7	Confident	90.3	Very high	23 Å²	23	45.2 Å²	45.2	14%	0.139	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	136.7	176	-158.8	0	0	0	0	111.9	Q772 Y776 T799 V800 I801	Q772-V774 VanDerWaalsContact C-N 3.26Å; Q772-V774 VanDerWaalsContact CG-O 3.26Å; Q772-V774 WeakPolarHBondContact CG-O 3.45Å; Q772-V774 PolarHBondContact NE2-O 3.26Å; Q772-V774 PolarHBondContact O-N 2.99Å; V774-Y776 HydrophobicContact CB-CE2 3.78Å; V774-Y776 HydrophobicContact CG1-CD2 4.17Å; V774-Y776 HydrophobicContact CG1-CE1 4.14Å; V774-Y776 HydrophobicContact CG1-CE2 3.5Å; V774-Y776 VanDerWaalsContact CG1-CZ 3.49Å; V774-T799 HydrophobicContact CG1-CG2 3.42Å; V774-T799 VanDerWaalsContact CG1-CG2 3.42Å; V774-V800 CarbonylContact C-O 3.15Å; V774-V800 WeakPolarHBondContact CA-O 3.08Å; V774-V800 WeakPolarHBondContact CG1-O 3.42Å; V774-I801 HydrophobicContact CG1-CG1 4.41Å
775	Y	89.7	Confident	90.2	Very high	13 Å²	13	38.4 Å²	38.4	5%	0.051	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.4	173.4	-60.4	-89.7	0	0	0	111.3	D748 N751 F752 L767 Q772 T799 V800 V802	D748-Y775 HydrophobicContact CB-CD1 4.21Å; D748-Y775 VanDerWaalsContact OD2-CA 3.3Å; D748-Y775 WeakPolarHBondContact OD2-CA 3.11Å; N751-Y775 WeakPolarHBondContact ND2-CE1 3.11Å; F752-Y775 HydrophobicContact CE2-CD1 4.17Å; F752-Y775 AromaticContact CE2-CD2 3.99Å; F752-Y775 HydrophobicContact CE2-CD2 3.99Å; F752-Y775 AromaticContact CE2-CG 3.69Å; F752-Y775 HydrophobicContact CE2-CG 3.69Å; F752-Y775 AromaticContact CZ-CD2 3.96Å; F752-Y775 HydrophobicContact CZ-CD2 3.96Å; F752-Y775 HydrophobicContact CZ-CG 4.12Å; L767-Y775 HydrophobicContact CB-CE2 4.38Å; L767-Y775 HydrophobicContact CD1-CD2 4.26Å; L767-Y775 HydrophobicContact CD1-CE2 3.79Å; L767-Y775 HydrophobicContact CD2-CE2 4.14Å; L767-Y775 HydrophobicContact CG-CE2 4.32Å; Q772-Y775 HydrophobicContact CB-CE1 4.19Å; Q772-Y775 HydrophobicContact CG-CD1 4.17Å; Q772-Y775 HydrophobicContact CG-CE1 3.78Å; Q772-Y775 HydrophobicContact CG-CE2 4.27Å; Q772-Y775 VanDerWaalsContact O-CE2 3.24Å; Q772-Y775 WeakPolarHBondContact O-CE2 3.32Å; Y775-T799 WeakPolarHBondContact O-CA 3.46Å; Y775-V800 PolarHBondContact N-O 3.24Å; Y775-V800 PolarHBondContact O-N 2.82Å; Y775-V802 HydrophobicContact CD2-CG2 4.12Å; Y775-V802 HydrophobicContact CE2-CG2 3.7Å
776	Y	86.4	Confident	90	Very high	47 Å²	47	41.4 Å²	41.4	18%	0.184	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	120.9	-176.7	-58	-98.2	0	0	0	111.7	Y690 F693 H743 D748 V774 T799	Y690-Y776 HydrophobicContact CE2-CD2 4.33Å; Y690-Y776 HydrophobicContact CE2-CG 4.33Å; F693-Y776 HydrophobicContact CD1-CE1 4.36Å; F693-Y776 HydrophobicContact CE1-CD1 4.18Å; F693-Y776 AromaticContact CE1-CE1 3.69Å; F693-Y776 HydrophobicContact CE1-CE1 3.69Å; F693-Y776 HydrophobicContact CZ-CE1 4.47Å; H743-Y776 AromaticContact NE2-CD2 3.24Å; H743-Y776 WeakPolarHBondContact NE2-CD2 3.41Å; H743-Y776 AromaticContact NE2-CE2 3.85Å; D748-Y776 PolarHBondContact OD2-N 2.79Å; V774-Y776 HydrophobicContact CB-CE2 3.78Å; V774-Y776 HydrophobicContact CG1-CD2 4.17Å; V774-Y776 HydrophobicContact CG1-CE1 4.14Å; V774-Y776 HydrophobicContact CG1-CE2 3.5Å; V774-Y776 VanDerWaalsContact CG1-CZ 3.49Å; Y776-T799 HydrophobicContact CD1-CG2 4.11Å; Y776-T799 WeakPolarHBondContact CD1-OG1 3.04Å; Y776-T799 HydrophobicContact CE1-CG2 3.77Å
777	F	90.5	Very high	89.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	171.6	176.5	48	-90.4	0	0	0	111.6	L682 V749 F752 L761 V798 V800	L682-F777 HydrophobicContact CD1-CD2 4.44Å; L682-F777 HydrophobicContact CD1-CE2 4.2Å; L682-F777 HydrophobicContact CD2-CD2 3.96Å; L682-F777 HydrophobicContact CD2-CE2 3.84Å; V749-F777 HydrophobicContact CG2-CB 3.48Å; V749-F777 VanDerWaalsContact CG2-CB 3.48Å; V749-F777 HydrophobicContact CG2-CG 4.28Å; F752-F777 HydrophobicContact CB-CE1 4.42Å; F752-F777 HydrophobicContact CB-CZ 4.13Å; F752-F777 HydrophobicContact CD1-CE1 4.44Å; F752-F777 HydrophobicContact CD1-CZ 4.21Å; F752-F777 HydrophobicContact CD2-CD1 4.23Å; F752-F777 AromaticContact CD2-CE1 3.41Å; F752-F777 HydrophobicContact CD2-CE1 3.41Å; F752-F777 VanDerWaalsContact CD2-CE1 3.41Å; F752-F777 AromaticContact CD2-CZ 3.88Å; F752-F777 HydrophobicContact CD2-CZ 3.88Å; F752-F777 AromaticContact CE2-CE1 3.7Å; F752-F777 HydrophobicContact CE2-CE1 3.7Å; F752-F777 HydrophobicContact CE2-CZ 4.4Å; F752-F777 AromaticContact CG-CE1 3.84Å; F752-F777 HydrophobicContact CG-CE1 3.84Å; F752-F777 AromaticContact CG-CZ 3.8Å; F752-F777 HydrophobicContact CG-CZ 3.8Å; F752-F777 HydrophobicContact CZ-CE1 4.33Å; L761-F777 HydrophobicContact CD1-CE2 3.86Å; L761-F777 HydrophobicContact CD1-CZ 3.94Å; L761-F777 HydrophobicContact CD2-CE2 4.26Å; L761-F777 HydrophobicContact CD2-CZ 4.03Å; F777-V798 HydrophobicContact CD2-CB 3.79Å; F777-V798 HydrophobicContact CD2-CG1 4.27Å; F777-V798 HydrophobicContact CD2-CG2 4.15Å; F777-V798 HydrophobicContact CE2-CB 3.63Å; F777-V798 HydrophobicContact CE2-CG1 3.6Å; F777-V798 HydrophobicContact CE2-CG2 4.01Å; F777-V798 HydrophobicContact CG-CB 4.48Å; F777-V798 HydrophobicContact CZ-CB 4.19Å; F777-V798 HydrophobicContact CZ-CG1 3.75Å; F777-V798 PolarHBondContact N-O 3.24Å; F777-V798 VanDerWaalsContact N-O 3.1Å; F777-V798 PolarHBondContact O-N 3.37Å; F777-V798 VanDerWaalsContact O-O 3.13Å; F777-V800 HydrophobicContact CE1-CG2 3.83Å; F777-V800 HydrophobicContact CZ-CG2 3.71Å
778	A	90	Very high	89.7	Confident	9 Å²	9	42.3 Å²	42.3	7%	0.074	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	152.1	171.6	0	0	0	0	0	110.9	K683 L685 A796	K683-A778 HydrophobicContact CB-CB 4.38Å; K683-A778 PolarHBondContact N-O 2.88Å; K683-A778 PolarHBondContact O-N 3.31Å; L685-A778 HydrophobicContact CD2-CB 3.93Å; A778-A796 WeakPolarHBondContact CA-O 3.26Å
779	V	92.6	Very high	89.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.8	165.3	58.2	0	0	0	0	108.5	F629 I665 S681 L682 I754 T795 A796 V798	F629-V779 HydrophobicContact CE1-CG1 3.75Å; F629-V779 HydrophobicContact CE1-CG2 4.13Å; F629-V779 HydrophobicContact CZ-CB 4.36Å; F629-V779 HydrophobicContact CZ-CG1 3.73Å; F629-V779 HydrophobicContact CZ-CG2 4.06Å; I665-V779 HydrophobicContact CD1-CB 4.35Å; I665-V779 HydrophobicContact CD1-CG1 4.15Å; I665-V779 HydrophobicContact CD1-CG2 4.44Å; I665-V779 HydrophobicContact CG2-CG1 3.97Å; I665-V779 HydrophobicContact CG2-CG2 4.2Å; S681-V779 CarbonylContact O-C 3.58Å; S681-V779 WeakPolarHBondContact O-CA 3.38Å; L682-V779 HydrophobicContact CD2-CB 4.32Å; L682-V779 HydrophobicContact CD2-CG2 4.43Å; I754-V779 HydrophobicContact CD1-CG2 3.69Å; V779-T795 CarbonylContact O-C 3.54Å; V779-T795 VanDerWaalsContact O-CA 3.25Å; V779-T795 WeakPolarHBondContact O-CA 3.41Å; V779-A796 HydrophobicContact CG1-CB 3.93Å; V779-A796 PolarHBondContact N-O 3.22Å; V779-A796 PolarHBondContact O-N 2.76Å; V779-V798 HydrophobicContact CB-CG2 4.05Å; V779-V798 HydrophobicContact CG1-CG2 3.76Å
780	I	93.8	Very high	89.4	Confident	29 Å²	29	54.5 Å²	54.5	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	134.8	172.9	-33.5	-179.4	0	0	0	108.7	Y680 S681 K683 I782 T794 T795	Y680-I780 CarbonylContact C-O 3.22Å; Y680-I780 WeakPolarHBondContact CA-O 2.89Å; S681-I780 PolarHBondContact N-O 3.34Å; S681-I780 PolarHBondContact O-N 3.39Å; K683-I780 HydrophobicContact CB-CD1 3.97Å; K683-I780 HydrophobicContact CB-CG1 3.9Å; K683-I780 HydrophobicContact CD-CD1 3.84Å; K683-I780 HydrophobicContact CD-CG1 4.22Å; K683-I780 HydrophobicContact CG-CD1 4.4Å; I780-I782 HydrophobicContact CB-CG1 4.36Å; I780-I782 HydrophobicContact CG2-CD1 4.09Å; I780-I782 HydrophobicContact CG2-CG1 3.67Å; I780-T794 WeakPolarHBondContact CA-O 3.45Å; I780-T794 VanDerWaalsContact CG2-O 3.23Å; I780-T794 WeakPolarHBondContact CG2-O 3.22Å; I780-T795 HydrophobicContact CB-CG2 4.44Å; I780-T795 HydrophobicContact CG1-CG2 4.21Å; I780-T795 HydrophobicContact CG2-CG2 4.12Å
781	A	94.4	Very high	89.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.8	163.5	0	0	0	0	0	108.1	P627 F629 A667 V678 Y680 S793 T794	P627-A781 HydrophobicContact CB-CB 3.72Å; F629-A781 HydrophobicContact CD2-CB 4.46Å; F629-A781 HydrophobicContact CE1-CB 3.98Å; F629-A781 HydrophobicContact CE2-CB 3.67Å; F629-A781 HydrophobicContact CZ-CB 3.4Å; A667-A781 HydrophobicContact CB-CB 3.72Å; V678-A781 HydrophobicContact CG1-CB 3.69Å; Y680-A781 HydrophobicContact CD1-CB 4.3Å; Y680-A781 HydrophobicContact CE1-CB 4.31Å; A781-S793 CarbonylContact O-C 3.53Å; A781-S793 WeakPolarHBondContact O-CA 3.33Å; A781-S793 WeakPolarHBondContact O-CB 3.23Å; A781-T794 PolarHBondContact N-O 3.49Å; A781-T794 PolarHBondContact O-N 3.35Å
782	I	94.2	Very high	89.8	Confident	53 Å²	53	51 Å²	51	27%	0.272	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	132.2	-176.9	-44.5	-178.3	0	0	0	108.5	V678 A679 I780 R791 H792	V678-I782 CarbonylContact C-O 3.43Å; A679-I782 PolarHBondContact N-O 3.18Å; A679-I782 PolarHBondContact O-N 2.98Å; I780-I782 HydrophobicContact CB-CG1 4.36Å; I780-I782 HydrophobicContact CG2-CD1 4.09Å; I780-I782 HydrophobicContact CG2-CG1 3.67Å; I782-R791 HydrophobicContact CG2-CB 4.31Å; I782-H792 WeakPolarHBondContact CA-O 3.44Å; I782-H792 WeakPolarHBondContact CG2-O 3.46Å
783	D	94	Very high	90.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.273	C	S	.	.			trans	-69.4	174.2	173.4	69.3	54.9	0	0	0	112.8	N623 P627 N675 Q677 A785 R791 H792	N623-D783 PolarHBondContact ND2-OD2 3.06Å; P627-D783 HydrophobicContact CG-CB 4.24Å; N675-D783 WeakPolarHBondContact O-CB 2.99Å; Q677-D783 CarbonylContact O-C 3.54Å; Q677-D783 WeakPolarHBondContact O-CA 3.25Å; D783-A785 WeakPolarHBondContact OD1-CB 3.45Å; D783-A785 PolarHBondContact OD1-N 3.29Å; D783-R791 VanDerWaalsContact OD1-CA 3.27Å; D783-R791 WeakPolarHBondContact OD1-CA 3.37Å; D783-R791 VanDerWaalsContact OD1-CB 3.31Å; D783-R791 WeakPolarHBondContact OD1-CB 3.41Å; D783-R791 VanDerWaalsContact OD1-CG 3.24Å; D783-R791 WeakPolarHBondContact OD1-CG 3.25Å; D783-H792 PolarHBondContact N-O 3.12Å; D783-H792 WeakPolarHBondContact OD2-CA 3.3Å; D783-H792 PolarHBondContact OD2-N 3.25Å
784	Q	93	Very high	90.3	Very high	49 Å²	49	51.6 Å²	51.6	23%	0.229	27%	0.273	C	S	.	.			trans	-107.1	24.2	175.8	-62.6	-47.5	-64.6	0	0	114.5	S674 Q677 A679 R791	S674-Q784 CarbonylContact O-C 3.48Å; S674-Q784 VanDerWaalsContact O-CA 3.3Å; S674-Q784 WeakPolarHBondContact O-CA 3.32Å; S674-Q784 PolarHBondContact O-N 3.45Å; Q677-Q784 HydrophobicContact CB-CB 4.14Å; Q677-Q784 HydrophobicContact CB-CG 4.2Å; Q677-Q784 HydrophobicContact CG-CB 4.39Å; Q677-Q784 HydrophobicContact CG-CG 3.96Å; Q677-Q784 WeakPolarHBondContact O-CG 3.39Å; Q677-Q784 PolarHBondContact O-N 3.01Å; A679-Q784 VanDerWaalsContact CB-NE2 3.35Å; Q784-R791 VanDerWaalsContact C-NH2 3.26Å; Q784-R791 VanDerWaalsContact CA-NH2 3.31Å; Q784-R791 PolarHBondContact O-NH2 3.21Å; Q784-R791 VanDerWaalsContact OE1-CZ 3.26Å
785	A	88.9	Confident	90.4	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.008	29%	0.291	C	S	.	.			trans	-46.9	149.1	-178.3	0	0	0	0	0	114.5	N623 S674 D783 P787 K790 R791	N623-A785 HydrophobicContact CB-CB 4.11Å; N623-A785 VanDerWaalsContact OD1-CB 3.22Å; N623-A785 WeakPolarHBondContact OD1-CB 3.07Å; S674-A785 PolarHBondContact O-N 3.43Å; D783-A785 WeakPolarHBondContact OD1-CB 3.45Å; D783-A785 PolarHBondContact OD1-N 3.29Å; A785-P787 CarbonylContact O-C 3.55Å; A785-K790 HydrophobicContact CB-CB 4.31Å; A785-R791 HydrophobicContact CB-CG 3.78Å; A785-R791 PolarHBondContact O-NE 3.41Å
786	V	85.2	Confident	90.4	Very high	116 Å²	116	54.2 Å²	54.2	70%	0.703	29%	0.291	S	S	*	.	S	Bend	trans	-127.6	120.2	-177.6	-176.4	0	0	0	0	109.3
787	P	86.9	Confident	90.5	Very high	77 Å²	77	53.1 Å²	53.1	50%	0.5	29%	0.288	S	S	.	.	S	Bend	cis	-70.4	158.7	1.4	31.4	-36.8	0	0	0	113.1	A785 E789 K790	A785-P787 CarbonylContact O-C 3.55Å; P787-E789 PolarHBondContact O-N 3.24Å; P787-K790 HydrophobicContact CG-CG 4.31Å; P787-K790 WeakPolarHBondContact O-CB 3.19Å; P787-K790 PolarHBondContact O-N 2.95Å
788	S	86.7	Confident	90.5	Very high	85 Å²	85	53.1 Å²	53.1	59%	0.594	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-62.3	-15.6	-175.9	51.7	0	0	0	0	115.1	K790 R791	S788-K790 PolarHBondContact O-N 2.85Å; S788-R791 WeakPolarHBondContact O-CG 3.09Å; S788-R791 PolarHBondContact O-N 2.93Å
789	E	87.6	Confident	90.4	Very high	179 Å²	179	53.1 Å²	53.1	84%	0.836	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-69.1	-11.3	172	-64.2	169.3	-159.2	0	0	113.5	P787	P787-E789 PolarHBondContact O-N 3.24Å
790	K	86.5	Confident	90.3	Very high	130 Å²	130	53.1 Å²	53.1	57%	0.565	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-98.2	0.2	178.1	-70.4	-57.6	-166.7	177	0	114.8	N623 A785 P787 S788	N623-K790 PolarHBondContact ND2-O 3.37Å; N623-K790 VanDerWaalsContact ND2-O 3.14Å; A785-K790 HydrophobicContact CB-CB 4.31Å; P787-K790 HydrophobicContact CG-CG 4.31Å; P787-K790 WeakPolarHBondContact O-CB 3.19Å; P787-K790 PolarHBondContact O-N 2.95Å; S788-K790 PolarHBondContact O-N 2.85Å
791	R	91.7	Very high	90.1	Very high	85 Å²	85	54 Å²	54	32%	0.321	29%	0.292	S	S	.	.			trans	-72.8	132.5	-175.8	-60.9	179	171	-149.1	-11.9	111.7	I782 D783 Q784 A785 S788	I782-R791 HydrophobicContact CG2-CB 4.31Å; D783-R791 VanDerWaalsContact OD1-CA 3.27Å; D783-R791 WeakPolarHBondContact OD1-CA 3.37Å; D783-R791 VanDerWaalsContact OD1-CB 3.31Å; D783-R791 WeakPolarHBondContact OD1-CB 3.41Å; D783-R791 VanDerWaalsContact OD1-CG 3.24Å; D783-R791 WeakPolarHBondContact OD1-CG 3.25Å; Q784-R791 VanDerWaalsContact C-NH2 3.26Å; Q784-R791 VanDerWaalsContact CA-NH2 3.31Å; Q784-R791 PolarHBondContact O-NH2 3.21Å; Q784-R791 VanDerWaalsContact OE1-CZ 3.26Å; A785-R791 HydrophobicContact CB-CG 3.78Å; A785-R791 PolarHBondContact O-NE 3.41Å; S788-R791 WeakPolarHBondContact O-CG 3.09Å; S788-R791 PolarHBondContact O-N 2.93Å
792	H	91.3	Very high	90	Very high	70 Å²	70	54 Å²	54	32%	0.324	29%	0.292	S	S	.	.			trans	-96.9	160	170.3	-61.4	150.2	0	0	0	110.9	N623 N625 A626 I782 D783	N623-H792 PolarHBondContact ND2-ND1 2.98Å; N623-H792 PolarHBondContact O-CE1 3.09Å; N623-H792 VanDerWaalsContact O-CE1 3.22Å; N625-H792 PolarHBondContact O-ND1 3.24Å; A626-H792 HydrophobicContact CB-CB 3.61Å; I782-H792 WeakPolarHBondContact CA-O 3.44Å; I782-H792 WeakPolarHBondContact CG2-O 3.46Å; D783-H792 PolarHBondContact N-O 3.12Å; D783-H792 WeakPolarHBondContact OD2-CA 3.3Å; D783-H792 PolarHBondContact OD2-N 3.25Å
793	S	92.7	Very high	89.7	Confident	71 Å²	71	54.2 Å²	54.2	50%	0.497	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	149.7	179.6	62.1	0	0	0	0	111.4	A781	A781-S793 CarbonylContact O-C 3.53Å; A781-S793 WeakPolarHBondContact O-CA 3.33Å; A781-S793 WeakPolarHBondContact O-CB 3.23Å
794	T	91.6	Very high	89.4	Confident	46 Å²	46	55.3 Å²	55.3	28%	0.282	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	167.7	170.5	71	0	0	0	0	110.6	A626 P627 F629 I780 A781	A626-T794 HydrophobicContact CB-CG2 4.31Å; P627-T794 VanDerWaalsContact O-CB 3.32Å; P627-T794 WeakPolarHBondContact O-CB 3.42Å; P627-T794 WeakPolarHBondContact O-CG2 3.37Å; P627-T794 PolarHBondContact O-OG1 3.25Å; F629-T794 WeakPolarHBondContact CD2-OG1 3.47Å; I780-T794 WeakPolarHBondContact CA-O 3.45Å; I780-T794 VanDerWaalsContact CG2-O 3.23Å; I780-T794 WeakPolarHBondContact CG2-O 3.22Å; A781-T794 PolarHBondContact N-O 3.49Å; A781-T794 PolarHBondContact O-N 3.35Å
795	T	91.1	Very high	89.1	Confident	86 Å²	86	55.3 Å²	55.3	53%	0.528	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.9	-178	54.4	0	0	0	0	111.2	V779 I780	V779-T795 CarbonylContact O-C 3.54Å; V779-T795 VanDerWaalsContact O-CA 3.25Å; V779-T795 WeakPolarHBondContact O-CA 3.41Å; I780-T795 HydrophobicContact CB-CG2 4.44Å; I780-T795 HydrophobicContact CG1-CG2 4.21Å; I780-T795 HydrophobicContact CG2-CG2 4.12Å
796	A	88.7	Confident	88.9	Confident	5 Å²	5	56.5 Å²	56.5	4%	0.041	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	155.1	167.6	0	0	0	0	0	110.8	F629 Y634 A778 V779	F629-A796 HydrophobicContact CB-CB 4.05Å; F629-A796 HydrophobicContact CD1-CB 4.09Å; F629-A796 HydrophobicContact CD2-CB 3.54Å; F629-A796 HydrophobicContact CE1-CB 4.41Å; F629-A796 HydrophobicContact CE2-CB 3.9Å; F629-A796 HydrophobicContact CG-CB 3.63Å; F629-A796 HydrophobicContact CZ-CB 4.31Å; Y634-A796 HydrophobicContact CD2-CB 4.05Å; Y634-A796 HydrophobicContact CE2-CB 3.78Å; A778-A796 WeakPolarHBondContact CA-O 3.26Å; V779-A796 HydrophobicContact CG1-CB 3.93Å; V779-A796 PolarHBondContact N-O 3.22Å; V779-A796 PolarHBondContact O-N 2.76Å
797	L	88.9	Confident	88.9	Confident	24 Å²	24	53.8 Å²	53.8	13%	0.126	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	145.7	175	-177.8	65.7	0	0	0	110.3	E632 H633 Y634 L685 F693	E632-L797 PolarHBondContact O-N 3.12Å; H633-L797 WeakPolarHBondContact CA-O 3.44Å; H633-L797 HydrophobicContact CB-CB 4.28Å; Y634-L797 PolarHBondContact N-O 3.08Å; L685-L797 HydrophobicContact CD1-CD1 3.49Å; L685-L797 VanDerWaalsContact CD1-CD1 3.49Å; L685-L797 HydrophobicContact CD2-CD1 3.6Å; L685-L797 HydrophobicContact CG-CD1 4.14Å; F693-L797 HydrophobicContact CB-CD2 4.05Å; F693-L797 HydrophobicContact CD1-CD2 4.18Å; F693-L797 HydrophobicContact CD2-CD2 3.09Å; F693-L797 HydrophobicContact CE2-CD2 3.5Å; F693-L797 VanDerWaalsContact CE2-CD2 3.5Å; F693-L797 HydrophobicContact CG-CD2 3.48Å; F693-L797 VanDerWaalsContact CG-CD2 3.48Å; F693-L797 HydrophobicContact CZ-CD2 4.2Å
798	V	89.9	Confident	88.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	130.2	170.1	-172.2	0	0	0	0	109.1	Y634 I665 L761 F777 V779 V800	Y634-V798 WeakPolarHBondContact O-CA 3.35Å; I665-V798 HydrophobicContact CD1-CG2 3.79Å; L761-V798 HydrophobicContact CD2-CG1 3.82Å; F777-V798 HydrophobicContact CD2-CB 3.79Å; F777-V798 HydrophobicContact CD2-CG1 4.27Å; F777-V798 HydrophobicContact CD2-CG2 4.15Å; F777-V798 HydrophobicContact CE2-CB 3.63Å; F777-V798 HydrophobicContact CE2-CG1 3.6Å; F777-V798 HydrophobicContact CE2-CG2 4.01Å; F777-V798 HydrophobicContact CG-CB 4.48Å; F777-V798 HydrophobicContact CZ-CB 4.19Å; F777-V798 HydrophobicContact CZ-CG1 3.75Å; F777-V798 PolarHBondContact N-O 3.24Å; F777-V798 VanDerWaalsContact N-O 3.1Å; F777-V798 PolarHBondContact O-N 3.37Å; F777-V798 VanDerWaalsContact O-O 3.13Å; V779-V798 HydrophobicContact CB-CG2 4.05Å; V779-V798 HydrophobicContact CG1-CG2 3.76Å; V798-V800 HydrophobicContact CG1-CG2 4.1Å
799	T	89.4	Confident	88.8	Confident	9 Å²	9	50.7 Å²	50.7	6%	0.055	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	120.9	167	-63.4	0	0	0	0	108.5	H633 Y634 I635 G636 V774 Y775 Y776 I801	H633-T799 WeakPolarHBondContact NE2-CB 3.47Å; H633-T799 PolarHBondContact NE2-OG1 2.9Å; Y634-T799 PolarHBondContact O-N 2.69Å; I635-T799 WeakPolarHBondContact CA-O 3.19Å; G636-T799 PolarHBondContact N-O 3.25Å; V774-T799 HydrophobicContact CG1-CG2 3.42Å; V774-T799 VanDerWaalsContact CG1-CG2 3.42Å; Y775-T799 WeakPolarHBondContact O-CA 3.46Å; Y776-T799 HydrophobicContact CD1-CG2 4.11Å; Y776-T799 WeakPolarHBondContact CD1-OG1 3.04Å; Y776-T799 HydrophobicContact CE1-CG2 3.77Å; T799-I801 HydrophobicContact CG2-CG1 4.36Å
800	V	90.3	Very high	88.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.7	171.5	-173.5	0	0	0	0	108.8	G636 V638 V647 F752 L761 V774 Y775 F777 V798	G636-V800 CarbonylContact O-C 3.55Å; G636-V800 WeakPolarHBondContact O-CA 3.24Å; V638-V800 HydrophobicContact CG1-CG1 3.7Å; V647-V800 HydrophobicContact CG1-CG1 3.94Å; V647-V800 HydrophobicContact CG1-CG2 4.13Å; V647-V800 HydrophobicContact CG2-CG1 4.3Å; V647-V800 HydrophobicContact CG2-CG2 4.47Å; F752-V800 HydrophobicContact CD1-CG2 4.45Å; F752-V800 HydrophobicContact CE1-CB 4.11Å; F752-V800 HydrophobicContact CE1-CG1 3.85Å; F752-V800 HydrophobicContact CE1-CG2 3.84Å; F752-V800 HydrophobicContact CZ-CB 3.82Å; F752-V800 HydrophobicContact CZ-CG1 3.81Å; F752-V800 HydrophobicContact CZ-CG2 3.91Å; L761-V800 HydrophobicContact CD2-CG2 4.08Å; V774-V800 CarbonylContact C-O 3.15Å; V774-V800 WeakPolarHBondContact CA-O 3.08Å; V774-V800 WeakPolarHBondContact CG1-O 3.42Å; Y775-V800 PolarHBondContact N-O 3.24Å; Y775-V800 PolarHBondContact O-N 2.82Å; F777-V800 HydrophobicContact CE1-CG2 3.83Å; F777-V800 HydrophobicContact CZ-CG2 3.71Å; V798-V800 HydrophobicContact CG1-CG2 4.1Å
801	I	90	Very high	89.1	Confident	47 Å²	47	39.5 Å²	39.5	24%	0.241	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.2	171.9	-62.4	172	0	0	0	107.6	I635 G636 H637 V638 V774 T799	I635-I801 HydrophobicContact CG2-CD1 4.09Å; G636-I801 PolarHBondContact O-N 2.87Å; H637-I801 WeakPolarHBondContact CA-O 3.47Å; V638-I801 PolarHBondContact N-O 2.89Å; V638-I801 VanDerWaalsContact N-O 3.12Å; V774-I801 HydrophobicContact CG1-CG1 4.41Å; T799-I801 HydrophobicContact CG2-CG1 4.36Å
802	V	90.9	Very high	89.1	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126	170.1	-171.4	0	0	0	0	108.8	V638 E640 L767 C769 N773 Y775	V638-V802 CarbonylContact O-C 2.93Å; V638-V802 VanDerWaalsContact O-CA 3.32Å; V638-V802 WeakPolarHBondContact O-CA 3.26Å; E640-V802 HydrophobicContact CB-CG1 3.58Å; L767-V802 HydrophobicContact CB-CG2 4.34Å; L767-V802 HydrophobicContact CD1-CG2 4.23Å; C769-V802 HydrophobicContact CB-CG1 4.19Å; N773-V802 PolarHBondContact O-N 2.75Å; Y775-V802 HydrophobicContact CD2-CG2 4.12Å; Y775-V802 HydrophobicContact CE2-CG2 3.7Å
803	D	88.7	Confident	89	Confident	57 Å²	57	38.1 Å²	38.1	31%	0.305	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	130.9	174.4	-69.1	-27.1	0	0	0	110.3	H637 V638 K639 E640	H637-D803 IonicContact CE1-OD1 2.64Å; H637-D803 IonicContact CG-OD1 2.61Å; H637-D803 IonicContact ND1-OD1 3.99Å; H637-D803 PolarHBondContact ND1-OD1 2.81Å; H637-D803 IonicContact ND1-OD2 3.02Å; V638-D803 PolarHBondContact O-N 3.27Å; K639-D803 HydrophobicContact CG-CB 4.14Å; E640-D803 PolarHBondContact N-O 3.35Å
804	D	88.3	Confident	88.8	Confident	24 Å²	24	39.7 Å²	39.7	13%	0.128	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-65.4	136.7	-175.3	-148.6	72.6	0	0	0	113.4	E640 C769 R841 D842 N845	E640-D804 VanDerWaalsContact OE1-CA 3.32Å; E640-D804 WeakPolarHBondContact OE1-CA 3.03Å; C769-D804 PolarHBondContact SG-OD1 3.42Å; D804-R841 VanDerWaalsContact OD1-CA 3.25Å; D804-R841 WeakPolarHBondContact OD1-CA 2.92Å; D804-R841 WeakPolarHBondContact OD1-CB 3.5Å; D804-R841 PolarHBondContact OD1-N 2.87Å; D804-R841 PolarHBondContact OD2-N 3.16Å; D804-D842 HydrophobicContact CB-CB 4.02Å; D804-D842 VanDerWaalsContact CG-N 3.31Å; D804-D842 PolarHBondContact OD1-N 2.97Å; D804-D842 WeakPolarHBondContact OD2-CB 3.41Å; D804-D842 PolarHBondContact OD2-N 3.43Å; D804-N845 PolarHBondContact OD2-ND2 2.75Å
805	V	85.7	Confident	88.6	Confident	49 Å²	49	44.2 Å²	44.2	30%	0.297	24%	0.235	S	C	.	.			trans	-135	115.6	175.6	179.2	0	0	0	0	108.5	K639 E640 D807	K639-V805 HydrophobicContact CB-CG2 4.16Å; K639-V805 HydrophobicContact CD-CG2 4.24Å; K639-V805 HydrophobicContact CG-CG2 4.47Å; E640-V805 HydrophobicContact CG-CB 3.77Å; E640-V805 HydrophobicContact CG-CG2 3.95Å; E640-V805 PolarHBondContact OE1-N 2.78Å; V805-D807 PolarHBondContact O-N 3.14Å
806	N	85.2	Confident	88.6	Confident	25 Å²	25	44.2 Å²	44.2	13%	0.134	23%	0.229	C	C	.	.			trans	-53.5	101.3	175.6	-175.5	-103.7	0	0	0	112	D840 N845 N895 T910 F912	N806-D840 WeakPolarHBondContact CA-OD2 3.19Å; N806-D840 PolarHBondContact ND2-OD2 3.48Å; N806-N845 HydrophobicContact CB-CB 4.06Å; N806-N845 PolarHBondContact N-ND2 3.47Å; N806-N895 PolarHBondContact ND2-ND2 2.81Å; N806-T910 PolarHBondContact OD1-O 3.33Å; N806-F912 WeakPolarHBondContact O-CE2 3.43Å; N806-F912 VanDerWaalsContact OD1-CD2 3.31Å; N806-F912 WeakPolarHBondContact OD1-CD2 3.1Å
807	D	85.5	Confident	88.8	Confident	59 Å²	59	44.4 Å²	44.4	32%	0.316	23%	0.229	S	C	.	.			trans	-134.8	-16.4	176.4	80.4	-12.4	0	0	0	113.1	N641 V805 D840 F912	N641-D807 PolarHBondContact ND2-OD2 2.77Å; V805-D807 PolarHBondContact O-N 3.14Å; D807-D840 PolarHBondContact N-OD1 2.9Å; D807-F912 WeakPolarHBondContact O-CZ 3.26Å
808	N	85.8	Confident	89.1	Confident	43 Å²	43	47.7 Å²	47.7	23%	0.23	25%	0.245	C	C	.	.	S	Bend	trans	-82.7	133.6	170.6	-59.1	-88.5	0	0	0	110.6	E770 A839 D840 N895	E770-N808 PolarHBondContact OE2-ND2 3.3Å; N808-A839 HydrophobicContact CB-CB 3.82Å; N808-D840 WeakPolarHBondContact CB-OD1 3.33Å; N808-D840 PolarHBondContact N-OD1 2.7Å; N808-D840 PolarHBondContact ND2-OD1 3.39Å; N808-N895 PolarHBondContact O-ND2 3.33Å
809	P	85.5	Confident	89.3	Confident	55 Å²	55	49.3 Å²	49.3	36%	0.357	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-78.6	152.9	172	31.6	-34.4	0	0	0	112.2	V811 F912	P809-V811 PolarHBondContact O-N 3.34Å; P809-F912 HydrophobicContact CB-CB 3.88Å; P809-F912 HydrophobicContact CB-CD1 4.08Å; P809-F912 HydrophobicContact CB-CG 4.31Å
810	P	89.4	Confident	89.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-69.8	125.7	165.6	30.7	-33.4	0	0	0	109.2	D838 I848 A893 N895 D914	P810-D838 HydrophobicContact CB-CB 4.16Å; P810-I848 HydrophobicContact CB-CD1 3.92Å; P810-I848 HydrophobicContact CB-CG1 4.04Å; P810-I848 HydrophobicContact CB-CG2 3.99Å; P810-A893 HydrophobicContact CB-CB 4.46Å; P810-N895 HydrophobicContact CG-CB 4.27Å; P810-D914 WeakPolarHBondContact O-CB 3.46Å
811	V	90	Very high	89.5	Confident	73 Å²	73	54.8 Å²	54.8	44%	0.442	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	127.5	-176.6	-178	0	0	0	0	110.4	P809 S836 T837	P809-V811 PolarHBondContact O-N 3.34Å; V811-S836 CarbonylContact O-C 3.6Å; V811-S836 WeakPolarHBondContact O-CA 3.23Å; V811-S836 WeakPolarHBondContact O-CB 3.17Å; V811-T837 PolarHBondContact N-O 2.99Å; V811-T837 PolarHBondContact O-N 2.95Å
812	L	91.3	Very high	89.5	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	146.5	176.8	-71.3	156.8	0	0	0	112.1	Q814 I834 Y850 I891 A893 D914 A916	L812-Q814 PolarHBondContact O-N 2.73Å; L812-I834 HydrophobicContact CD2-CG2 3.56Å; L812-Y850 HydrophobicContact CD2-CE1 4.36Å; L812-I891 HydrophobicContact CD1-CG2 4.3Å; L812-I891 HydrophobicContact CD2-CG2 4.44Å; L812-A893 HydrophobicContact CD1-CB 4.45Å; L812-A893 HydrophobicContact CD2-CB 3.94Å; L812-A893 HydrophobicContact CG-CB 4.08Å; L812-D914 WeakPolarHBondContact CB-OD2 3.21Å; L812-D914 HydrophobicContact CD1-CB 4.1Å; L812-D914 HydrophobicContact CG-CB 4.34Å; L812-D914 PolarHBondContact N-OD2 3.08Å; L812-A916 HydrophobicContact CD1-CB 3.72Å
813	E	89.4	Confident	89.4	Confident	119 Å²	119	55.7 Å²	55.7	56%	0.556	29%	0.29	S	S	*	.	S	Bend	trans	-62	-25	177.9	-75	-174.5	177	0	0	112.9	Y817 K835	E813-Y817 PolarHBondContact N-OH 2.62Å; E813-K835 HydrophobicContact CG-CB 3.9Å; E813-K835 PolarHBondContact N-O 2.87Å; E813-K835 WeakPolarHBondContact OE1-CD 3.44Å; E813-K835 IonicContact OE1-NZ 3.64Å; E813-K835 WeakPolarHBondContact OE2-CD 3.2Å
814	Q	89.9	Confident	89.3	Confident	104 Å²	104	55.7 Å²	55.7	49%	0.486	30%	0.303	S	S	.	.			trans	-149.4	144.3	-179.6	-55.4	-179.9	-1.3	0	0	110.8	L812 H816 Y817 A916	L812-Q814 PolarHBondContact O-N 2.73Å; Q814-H816 VanDerWaalsContact C-N 3.35Å; Q814-H816 PolarHBondContact OE1-O 3.05Å; Q814-Y817 HydrophobicContact CB-CD1 4.21Å; Q814-Y817 HydrophobicContact CB-CD2 4.42Å; Q814-Y817 HydrophobicContact CB-CE1 3.85Å; Q814-Y817 HydrophobicContact CB-CE2 4.08Å; Q814-Y817 HydrophobicContact CB-CG 4.48Å; Q814-Y817 HydrophobicContact CG-CD1 4.47Å; Q814-Y817 HydrophobicContact CG-CE1 4.01Å; Q814-Y817 PolarHBondContact N-OH 2.86Å; Q814-Y817 WeakPolarHBondContact O-CE2 3.23Å; Q814-A916 VanDerWaalsContact O-CB 3.28Å; Q814-A916 WeakPolarHBondContact O-CB 3.34Å
815	H	87.3	Confident	89.3	Confident	140 Å²	140	57.9 Å²	57.9	65%	0.648	31%	0.314	S	S	*	.	S	Bend	trans	-80.9	-14.3	173.1	-55.6	-57.2	0	0	0	113.8	A916 S917	H815-A916 WeakPolarHBondContact O-CA 3.25Å; H815-A916 WeakPolarHBondContact O-CB 3.3Å; H815-S917 PolarHBondContact O-N 3.21Å; H815-S917 PolarHBondContact O-OG 2.61Å
816	H	91.2	Very high	89.6	Confident	87 Å²	87	59.4 Å²	59.4	40%	0.403	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	122.8	176.1	-174.2	62.3	0	0	0	109.9	Q814 I818 S917	Q814-H816 VanDerWaalsContact C-N 3.35Å; Q814-H816 PolarHBondContact OE1-O 3.05Å; H816-I818 VanDerWaalsContact NE2-CG1 3.32Å; H816-I818 WeakPolarHBondContact NE2-CG1 3.36Å; H816-S917 CarbonylContact C-O 3.58Å; H816-S917 VanDerWaalsContact CA-O 3.31Å; H816-S917 WeakPolarHBondContact CA-O 3.48Å; H816-S917 PolarHBondContact ND1-O 2.82Å; H816-S917 PolarHBondContact ND1-OG 2.91Å
817	Y	93	Very high	89.8	Confident	9 Å²	9	65.5 Å²	65.5	4%	0.035	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.1	176.2	-64.6	-91.5	0	0	0	110.2	E813 Q814 F819 I834 K835 A916 S917 V918 T919	E813-Y817 PolarHBondContact N-OH 2.62Å; Q814-Y817 HydrophobicContact CB-CD1 4.21Å; Q814-Y817 HydrophobicContact CB-CD2 4.42Å; Q814-Y817 HydrophobicContact CB-CE1 3.85Å; Q814-Y817 HydrophobicContact CB-CE2 4.08Å; Q814-Y817 HydrophobicContact CB-CG 4.48Å; Q814-Y817 HydrophobicContact CG-CD1 4.47Å; Q814-Y817 HydrophobicContact CG-CE1 4.01Å; Q814-Y817 PolarHBondContact N-OH 2.86Å; Q814-Y817 WeakPolarHBondContact O-CE2 3.23Å; Y817-F819 HydrophobicContact CD1-CZ 4.24Å; Y817-F819 HydrophobicContact CG-CE2 4.44Å; Y817-I834 HydrophobicContact CD2-CG1 4.34Å; Y817-I834 HydrophobicContact CE2-CG1 4.4Å; Y817-I834 HydrophobicContact CE2-CG2 3.88Å; Y817-I834 HydrophobicContact CG-CG1 4.42Å; Y817-K835 PolarHBondContact OH-O 3.28Å; Y817-A916 HydrophobicContact CD2-CB 3.92Å; Y817-A916 HydrophobicContact CE2-CB 3.78Å; Y817-S917 PolarHBondContact N-O 3.29Å; Y817-V918 HydrophobicContact CD2-CG2 4.21Å; Y817-V918 WeakPolarHBondContact O-CA 3.33Å; Y817-T919 PolarHBondContact O-N 2.97Å
818	I	93.6	Very high	90.2	Very high	92 Å²	92	67.1 Å²	67.1	47%	0.472	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.9	173.3	-58.2	175.7	0	0	0	108.5	H816 T919 N921	H816-I818 VanDerWaalsContact NE2-CG1 3.32Å; H816-I818 WeakPolarHBondContact NE2-CG1 3.36Å; I818-T919 WeakPolarHBondContact CA-O 3.2Å; I818-N921 VanDerWaalsContact CG2-ND2 3.31Å; I818-N921 WeakPolarHBondContact CG2-ND2 3.31Å
819	F	94.3	Very high	90.5	Very high	35 Å²	35	66.3 Å²	66.3	15%	0.154	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	115.2	174.5	-60.9	-74.4	0	0	0	109.8	Y817 I831 I834 I873 V918 T919 I920 N921	Y817-F819 HydrophobicContact CD1-CZ 4.24Å; Y817-F819 HydrophobicContact CG-CE2 4.44Å; F819-I831 HydrophobicContact CB-CG2 3.88Å; F819-I831 HydrophobicContact CG-CG2 4.38Å; F819-I834 HydrophobicContact CE2-CG1 4.46Å; F819-I834 HydrophobicContact CZ-CG1 4.5Å; F819-I873 HydrophobicContact CD2-CD1 3.69Å; F819-I873 HydrophobicContact CE2-CD1 3.29Å; F819-I873 HydrophobicContact CZ-CD1 3.88Å; F819-V918 HydrophobicContact CD2-CG1 3.76Å; F819-V918 HydrophobicContact CE2-CG1 3.72Å; F819-T919 PolarHBondContact N-O 2.9Å; F819-I920 HydrophobicContact CB-CG1 4.36Å; F819-I920 CarbonylContact O-C 3.58Å; F819-I920 VanDerWaalsContact O-CA 3.24Å; F819-I920 WeakPolarHBondContact O-CA 3.08Å; F819-N921 PolarHBondContact O-N 2.77Å
820	D	93.2	Very high	90.9	Very high	110 Å²	110	69.1 Å²	69.1	59%	0.588	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	128.8	177.1	-53.8	-40.4	0	0	0	109.8	N921 I923	D820-N921 WeakPolarHBondContact OD1-CB 3.01Å; D820-N921 PolarHBondContact OD1-ND2 3.46Å; D820-I923 HydrophobicContact CB-CD1 4Å; D820-I923 HydrophobicContact CB-CG1 4.33Å
821	I	92.1	Very high	91.1	Very high	13 Å²	13	70.1 Å²	70.1	7%	0.067	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	135.3	-176.4	-170.1	163.6	0	0	0	111.4	L825 I831 L879 I920 N921 I922 I923	I821-L825 HydrophobicContact CD1-CD1 3.92Å; I821-L825 HydrophobicContact CG1-CD1 3.58Å; I821-I831 HydrophobicContact CD1-CB 4.47Å; I821-I831 HydrophobicContact CD1-CD1 4.48Å; I821-I831 HydrophobicContact CD1-CG1 3.82Å; I821-L879 HydrophobicContact CG2-CD1 4.2Å; I821-I920 HydrophobicContact CG2-CG2 3.48Å; I821-I920 VanDerWaalsContact CG2-CG2 3.48Å; I821-N921 PolarHBondContact N-O 2.87Å; I821-I922 HydrophobicContact CG2-CG1 4.18Å; I821-I922 CarbonylContact O-C 3.43Å; I821-I922 WeakPolarHBondContact O-CA 3.4Å; I821-I923 PolarHBondContact O-N 2.9Å
822	S	89.2	Confident	91.2	Very high	47 Å²	47	67.2 Å²	67.2	33%	0.329	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	143.9	172.4	-56.5	0	0	0	0	111.5	L825	S822-L825 WeakPolarHBondContact O-CD1 3.49Å; S822-L825 WeakPolarHBondContact O-CG 3.34Å
823	E	89.4	Confident	91.3	Very high	21 Å²	21	71.1 Å²	71.1	10%	0.098	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	174.6	169.5	68.4	-165.7	122.3	0	0	113.4	L825 L879 R881 I922 I923 D924 Q925	E823-L825 PolarHBondContact O-N 3.16Å; E823-L879 WeakPolarHBondContact CB-O 3.45Å; E823-R881 WeakPolarHBondContact OE1-CB 3.37Å; E823-R881 WeakPolarHBondContact OE2-CB 3.13Å; E823-R881 PolarHBondContact OE2-N 2.86Å; E823-I922 HydrophobicContact CB-CG2 3.76Å; E823-I923 PolarHBondContact N-O 2.92Å; E823-D924 VanDerWaalsContact OE1-CA 3.25Å; E823-D924 WeakPolarHBondContact OE1-CA 3.27Å; E823-Q925 HydrophobicContact CG-CB 4.1Å; E823-Q925 HydrophobicContact CG-CG 3.89Å; E823-Q925 PolarHBondContact OE1-N 2.95Å
824	G	85.7	Confident	91.5	Very high	56 Å²	56	65.5 Å²	65.5	58%	0.577	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	-5.5	-177.8	0	0	0	0	0	114.9	L879	G824-L879 PolarHBondContact N-O 2.91Å
825	L	89.3	Confident	91.5	Very high	71 Å²	71	64.7 Å²	64.7	37%	0.372	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-64.4	147.2	179.8	-75.1	-179.7	0	0	0	112.6	I821 S822 E823	I821-L825 HydrophobicContact CD1-CD1 3.92Å; I821-L825 HydrophobicContact CG1-CD1 3.58Å; S822-L825 WeakPolarHBondContact O-CD1 3.49Å; S822-L825 WeakPolarHBondContact O-CG 3.34Å; E823-L825 PolarHBondContact O-N 3.16Å
826	P	91.5	Very high	91.6	Very high	81 Å²	81	58.8 Å²	58.8	53%	0.526	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-56.5	157.2	-178.9	-27.3	35.7	0	0	0	114.9	S829 S875	P826-S829 WeakPolarHBondContact O-CB 3.48Å; P826-S829 PolarHBondContact O-N 2.91Å; P826-S829 PolarHBondContact O-OG 2.71Å; P826-S829 VanDerWaalsContact O-OG 3.13Å; P826-S875 PolarHBondContact O-OG 2.82Å
827	R	89.9	Confident	91.6	Very high	153 Å²	153	59.3 Å²	59.3	58%	0.577	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	140.1	167.7	-166.4	-172.2	-172.5	-146	-4.2	110.4	S829 R876	R827-S829 VanDerWaalsContact C-N 3.3Å; R827-R876 WeakPolarHBondContact CG-O 3.33Å; R827-R876 PolarHBondContact NE-O 2.8Å
828	H	92.4	Very high	91.4	Very high	92 Å²	92	59.7 Å²	59.7	43%	0.426	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	21.6	-174.8	-51.6	-80.5	0	0	0	114.6	Y865 S875	H828-Y865 AromaticContact CE1-CE1 3.98Å; H828-Y865 AromaticContact ND1-CE1 3.43Å; H828-Y865 WeakPolarHBondContact ND1-CE1 3.41Å; H828-Y865 AromaticContact ND1-CZ 3.56Å; H828-Y865 PolarHBondContact ND1-OH 3Å; H828-S875 VanDerWaalsContact CA-O 3.25Å; H828-S875 WeakPolarHBondContact CA-O 3.16Å; H828-S875 PolarHBondContact N-O 2.91Å; H828-S875 PolarHBondContact N-OG 2.89Å
829	S	92.8	Very high	91.2	Very high	27 Å²	27	57.8 Å²	57.8	19%	0.189	32%	0.323	C	S	.	.			trans	-64.1	140.4	166.3	-81.3	0	0	0	0	111.1	P826 R827 Y874 S875	P826-S829 WeakPolarHBondContact O-CB 3.48Å; P826-S829 PolarHBondContact O-N 2.91Å; P826-S829 PolarHBondContact O-OG 2.71Å; P826-S829 VanDerWaalsContact O-OG 3.13Å; R827-S829 VanDerWaalsContact C-N 3.3Å; S829-Y874 CarbonylContact O-C 3.57Å; S829-Y874 WeakPolarHBondContact O-CA 3.39Å; S829-S875 PolarHBondContact N-OG 3.01Å; S829-S875 PolarHBondContact O-N 2.84Å
830	L	94.2	Very high	90.9	Very high	114 Å²	114	56.1 Å²	56.1	60%	0.597	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	130.7	171.6	173.9	63.6	0	0	0	109.8	I872 Y874	L830-I872 HydrophobicContact CD1-CG2 3.35Å; L830-Y874 HydrophobicContact CB-CE1 4.35Å; L830-Y874 HydrophobicContact CD1-CE1 4.33Å
831	I	93.8	Very high	90.5	Very high	20 Å²	20	55.5 Å²	55.5	10%	0.103	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-41	178.2	-55	-175.8	0	0	0	110.7	F819 I821 I864 I873 I920	F819-I831 HydrophobicContact CB-CG2 3.88Å; F819-I831 HydrophobicContact CG-CG2 4.38Å; I821-I831 HydrophobicContact CD1-CB 4.47Å; I821-I831 HydrophobicContact CD1-CD1 4.48Å; I821-I831 HydrophobicContact CD1-CG1 3.82Å; I831-I864 HydrophobicContact CD1-CB 4.46Å; I831-I864 HydrophobicContact CD1-CG2 3.46Å; I831-I864 VanDerWaalsContact CD1-CG2 3.46Å; I831-I873 HydrophobicContact CB-CB 4.15Å; I831-I873 HydrophobicContact CB-CG2 4.11Å; I831-I873 HydrophobicContact CD1-CG2 4.26Å; I831-I873 HydrophobicContact CG2-CG2 4.48Å; I831-I873 PolarHBondContact N-O 3.25Å; I831-I920 HydrophobicContact CD1-CD1 4.01Å; I831-I920 HydrophobicContact CG2-CD1 3.91Å; I831-I920 HydrophobicContact CG2-CG1 3.91Å; I831-I920 HydrophobicContact CG2-CG2 4.02Å
832	G	92	Very high	90.1	Very high	13 Å²	13	58.6 Å²	58.6	13%	0.134	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.2	-174.7	-177.4	0	0	0	0	0	112.9	I873	G832-I873 PolarHBondContact O-N 3.29Å
833	Q	93.4	Very high	89.8	Confident	90 Å²	90	64.8 Å²	64.8	42%	0.421	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	136.3	172.6	-175.8	-179.9	23.7	0	0	109.9	K835 T870 I872	Q833-K835 HydrophobicContact CG-CG 4.36Å; Q833-T870 WeakPolarHBondContact CG-O 3.29Å; Q833-T870 PolarHBondContact NE2-O 2.75Å; Q833-I872 HydrophobicContact CB-CG1 4.18Å; Q833-I872 HydrophobicContact CG-CG1 3.8Å
834	I	92.9	Very high	89.3	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.358	C	S	.	.			trans	-102.1	145.9	171.5	-64	156.9	0	0	0	108.1	L812 Y817 F819 Y850 G871 I873 F889 I891 V918	L812-I834 HydrophobicContact CD2-CG2 3.56Å; Y817-I834 HydrophobicContact CD2-CG1 4.34Å; Y817-I834 HydrophobicContact CE2-CG1 4.4Å; Y817-I834 HydrophobicContact CE2-CG2 3.88Å; Y817-I834 HydrophobicContact CG-CG1 4.42Å; F819-I834 HydrophobicContact CE2-CG1 4.46Å; F819-I834 HydrophobicContact CZ-CG1 4.5Å; I834-Y850 HydrophobicContact CG2-CD1 4.28Å; I834-Y850 HydrophobicContact CG2-CE1 4.07Å; I834-G871 PolarHBondContact N-O 2.82Å; I834-I873 HydrophobicContact CD1-CD1 3.8Å; I834-I873 HydrophobicContact CD1-CG1 4.07Å; I834-I873 HydrophobicContact CG1-CD1 4.12Å; I834-F889 HydrophobicContact CD1-CE2 4.43Å; I834-F889 HydrophobicContact CD1-CZ 4.45Å; I834-I891 HydrophobicContact CD1-CB 3.81Å; I834-I891 HydrophobicContact CD1-CD1 3.89Å; I834-I891 HydrophobicContact CD1-CG1 3.68Å; I834-I891 HydrophobicContact CD1-CG2 3.99Å; I834-I891 HydrophobicContact CG2-CG1 4.21Å; I834-I891 HydrophobicContact CG2-CG2 4.02Å; I834-V918 HydrophobicContact CD1-CG2 3.83Å
835	K	90.6	Very high	89.2	Confident	87 Å²	87	66.2 Å²	66.2	38%	0.378	34%	0.335	S	S	.	.			trans	-138.7	151.3	-176.5	-68.4	174.4	-174.7	167.1	0	111.2	E813 Y817 Q833 Y850	E813-K835 HydrophobicContact CG-CB 3.9Å; E813-K835 PolarHBondContact N-O 2.87Å; E813-K835 WeakPolarHBondContact OE1-CD 3.44Å; E813-K835 IonicContact OE1-NZ 3.64Å; E813-K835 WeakPolarHBondContact OE2-CD 3.2Å; Y817-K835 PolarHBondContact OH-O 3.28Å; Q833-K835 HydrophobicContact CG-CG 4.36Å; K835-Y850 WeakPolarHBondContact CA-OH 3.39Å
836	S	90	Very high	89	Confident	17 Å²	17	67.3 Å²	67.3	12%	0.119	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	159.4	174.9	44.1	0	0	0	0	111	V811 I848 Y850	V811-S836 CarbonylContact O-C 3.6Å; V811-S836 WeakPolarHBondContact O-CA 3.23Å; V811-S836 WeakPolarHBondContact O-CB 3.17Å; S836-I848 WeakPolarHBondContact O-CD1 3.44Å; S836-I848 WeakPolarHBondContact OG-CD1 3.15Å; S836-I848 WeakPolarHBondContact OG-CG2 3.38Å; S836-Y850 PolarHBondContact N-OH 2.98Å; S836-Y850 WeakPolarHBondContact OG-CE1 3.37Å; S836-Y850 PolarHBondContact OG-OH 3.31Å
837	T	89.9	Confident	88.7	Confident	98 Å²	98	67 Å²	67	60%	0.601	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.7	176	51.6	0	0	0	0	109.6	V811	V811-T837 PolarHBondContact N-O 2.99Å; V811-T837 PolarHBondContact O-N 2.95Å
838	D	89.7	Confident	88.6	Confident	16 Å²	16	61 Å²	61	9%	0.086	30%	0.302	C	S	.	.			trans	-113.9	143.9	174.7	-171.6	-49	0	0	0	107.2	P810 D840 R846 I848 N895	P810-D838 HydrophobicContact CB-CB 4.16Å; D838-D840 PolarHBondContact OD1-N 2.75Å; D838-R846 HydrophobicContact CB-CB 3.98Å; D838-R846 HydrophobicContact CB-CG 3.9Å; D838-R846 WeakPolarHBondContact O-CD 3.5Å; D838-R846 WeakPolarHBondContact O-CG 3.47Å; D838-I848 HydrophobicContact CB-CD1 3.89Å; D838-I848 HydrophobicContact CB-CG1 4.02Å; D838-N895 VanDerWaalsContact OD2-CB 3.27Å; D838-N895 WeakPolarHBondContact OD2-CB 3.38Å; D838-N895 PolarHBondContact OD2-ND2 2.72Å
839	A	88.7	Confident	88.5	Confident	53 Å²	53	58 Å²	58	44%	0.438	29%	0.29	S	S	.	.			trans	-94.9	-27.4	-168.3	0	0	0	0	0	114.3	E770 N808	E770-A839 HydrophobicContact CG-CB 4.47Å; N808-A839 HydrophobicContact CB-CB 3.82Å
840	D	88.9	Confident	88.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.285	C	S	.	.			trans	-46	147.7	-175.1	-65.4	-26.6	0	0	0	112.7	E770 N806 D807 N808 D838 D842 N845 R846	E770-D840 VanDerWaalsContact OE1-C 3.26Å; E770-D840 WeakPolarHBondContact OE1-CA 3.34Å; N806-D840 WeakPolarHBondContact CA-OD2 3.19Å; N806-D840 PolarHBondContact ND2-OD2 3.48Å; D807-D840 PolarHBondContact N-OD1 2.9Å; N808-D840 WeakPolarHBondContact CB-OD1 3.33Å; N808-D840 PolarHBondContact N-OD1 2.7Å; N808-D840 PolarHBondContact ND2-OD1 3.39Å; D838-D840 PolarHBondContact OD1-N 2.75Å; D840-D842 PolarHBondContact O-N 2.76Å; D840-N845 HydrophobicContact CB-CB 3.7Å; D840-N845 VanDerWaalsContact OD2-CB 3.32Å; D840-N845 WeakPolarHBondContact OD2-CB 3.44Å; D840-R846 HydrophobicContact CB-CG 4.09Å; D840-R846 WeakPolarHBondContact O-CD 3.32Å; D840-R846 WeakPolarHBondContact O-CG 3.46Å; D840-R846 PolarHBondContact O-NE 3.47Å; D840-R846 PolarHBondContact O-NH1 3.42Å
841	R	85.2	Confident	88.2	Confident	96 Å²	96	56 Å²	56	36%	0.362	27%	0.274	S	S	.	.	S	Bend	trans	-75.7	-29.8	-172.4	-155.6	172.9	119.8	-96.8	-3.8	113.2	C769 E770 N773 D804 R846	C769-R841 VanDerWaalsContact SG-CB 3.54Å; C769-R841 PolarHBondContact SG-NH1 3.23Å; E770-R841 WeakPolarHBondContact OE1-CA 3.01Å; E770-R841 WeakPolarHBondContact OE1-CB 3.42Å; E770-R841 PolarHBondContact OE1-N 3.18Å; N773-R841 PolarHBondContact ND2-NE 3.33Å; N773-R841 PolarHBondContact ND2-NH2 3.35Å; D804-R841 VanDerWaalsContact OD1-CA 3.25Å; D804-R841 WeakPolarHBondContact OD1-CA 2.92Å; D804-R841 WeakPolarHBondContact OD1-CB 3.5Å; D804-R841 PolarHBondContact OD1-N 2.87Å; D804-R841 PolarHBondContact OD2-N 3.16Å; R841-R846 VanDerWaalsContact O-CZ 3.25Å; R841-R846 PolarHBondContact O-NH1 3.32Å; R841-R846 VanDerWaalsContact O-NH1 3.15Å; R841-R846 PolarHBondContact O-NH2 3.21Å
842	D	82.1	Confident	88.1	Confident	78 Å²	78	56.8 Å²	56.8	42%	0.417	28%	0.278	S	S	.	.	S	Bend	trans	-83.4	146.5	-178.2	-98.2	-11.1	0	0	0	114.6	D804 D840 E844 N845 R846	D804-D842 HydrophobicContact CB-CB 4.02Å; D804-D842 VanDerWaalsContact CG-N 3.31Å; D804-D842 PolarHBondContact OD1-N 2.97Å; D804-D842 WeakPolarHBondContact OD2-CB 3.41Å; D804-D842 PolarHBondContact OD2-N 3.43Å; D840-D842 PolarHBondContact O-N 2.76Å; D842-E844 PolarHBondContact O-N 2.86Å; D842-N845 PolarHBondContact O-N 3.03Å; D842-R846 PolarHBondContact O-N 3.23Å; D842-R846 VanDerWaalsContact O-N 3.09Å
843	K	82.7	Confident	88	Confident	177 Å²	177	60.3 Å²	60.3	77%	0.77	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-17.9	175.1	-64.1	-178	-177.7	176.8	0	113.5
844	E	80.6	Confident	87.8	Confident	91 Å²	91	58.8 Å²	58.8	43%	0.425	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-30.3	177.9	-49.8	-147.9	137.4	0	0	112.4	D842 K897	D842-E844 PolarHBondContact O-N 2.86Å; E844-K897 HydrophobicContact CB-CD 4.33Å; E844-K897 VanDerWaalsContact CD-CE 3.43Å; E844-K897 WeakPolarHBondContact OE1-CE 3.46Å; E844-K897 IonicContact OE1-NZ 2.89Å; E844-K897 PolarHBondContact OE1-NZ 2.81Å; E844-K897 WeakPolarHBondContact OE2-CE 3.19Å; E844-K897 IonicContact OE2-NZ 2.83Å; E844-K897 PolarHBondContact OE2-NZ 3.37Å
845	N	82.4	Confident	87.3	Confident	16 Å²	16	61 Å²	61	9%	0.086	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-48.3	-176.4	-66.8	-12.5	0	0	0	109	D804 N806 D840 D842 Y847 N895	D804-N845 PolarHBondContact OD2-ND2 2.75Å; N806-N845 HydrophobicContact CB-CB 4.06Å; N806-N845 PolarHBondContact N-ND2 3.47Å; D840-N845 HydrophobicContact CB-CB 3.7Å; D840-N845 VanDerWaalsContact OD2-CB 3.32Å; D840-N845 WeakPolarHBondContact OD2-CB 3.44Å; D842-N845 PolarHBondContact O-N 3.03Å; N845-Y847 PolarHBondContact O-N 2.96Å; N845-N895 WeakPolarHBondContact O-CB 3.11Å
846	R	86.1	Confident	86.4	Confident	94 Å²	94	62.7 Å²	62.7	36%	0.355	31%	0.313	S	S	.	.	S	Bend	trans	-67.9	18.3	169.4	-61	-172.7	-62.4	-105.7	-23.7	116.7	D838 D840 R841 D842 I848	D838-R846 HydrophobicContact CB-CB 3.98Å; D838-R846 HydrophobicContact CB-CG 3.9Å; D838-R846 WeakPolarHBondContact O-CD 3.5Å; D838-R846 WeakPolarHBondContact O-CG 3.47Å; D840-R846 HydrophobicContact CB-CG 4.09Å; D840-R846 WeakPolarHBondContact O-CD 3.32Å; D840-R846 WeakPolarHBondContact O-CG 3.46Å; D840-R846 PolarHBondContact O-NE 3.47Å; D840-R846 PolarHBondContact O-NH1 3.42Å; R841-R846 VanDerWaalsContact O-CZ 3.25Å; R841-R846 PolarHBondContact O-NH1 3.32Å; R841-R846 VanDerWaalsContact O-NH1 3.15Å; R841-R846 PolarHBondContact O-NH2 3.21Å; D842-R846 PolarHBondContact O-N 3.23Å; D842-R846 VanDerWaalsContact O-N 3.09Å; R846-I848 PolarHBondContact O-N 2.83Å; R846-I848 VanDerWaalsContact O-N 3.1Å
847	Y	85.2	Confident	85.7	Confident	75 Å²	75	69.4 Å²	69.4	29%	0.294	35%	0.347	S	S	.	.			trans	-82.3	91.2	179.8	-168.9	-86.3	0	0	0	110.9	N845 T849 N869 N895 P898	N845-Y847 PolarHBondContact O-N 2.96Å; Y847-T849 HydrophobicContact CD1-CG2 4Å; Y847-T849 HydrophobicContact CE1-CG2 3.59Å; Y847-N869 PolarHBondContact OH-ND2 3.06Å; Y847-N869 PolarHBondContact OH-OD1 2.87Å; Y847-N895 CarbonylContact O-C 3.36Å; Y847-N895 WeakPolarHBondContact O-CA 3.29Å; Y847-P898 HydrophobicContact CE1-CG 4.12Å
848	I	87.4	Confident	85.2	Confident	26 Å²	26	67 Å²	67	13%	0.133	33%	0.33	C	S	.	.			trans	-82.9	137.8	-177.3	-39.9	178.3	0	0	0	112	P810 S836 D838 R846 A893 R894	P810-I848 HydrophobicContact CB-CD1 3.92Å; P810-I848 HydrophobicContact CB-CG1 4.04Å; P810-I848 HydrophobicContact CB-CG2 3.99Å; S836-I848 WeakPolarHBondContact O-CD1 3.44Å; S836-I848 WeakPolarHBondContact OG-CD1 3.15Å; S836-I848 WeakPolarHBondContact OG-CG2 3.38Å; D838-I848 HydrophobicContact CB-CD1 3.89Å; D838-I848 HydrophobicContact CB-CG1 4.02Å; R846-I848 PolarHBondContact O-N 2.83Å; R846-I848 VanDerWaalsContact O-N 3.1Å; I848-A893 HydrophobicContact CG2-CB 3.84Å; I848-R894 CarbonylContact C-O 3.49Å; I848-R894 WeakPolarHBondContact CA-O 3.44Å
849	T	89.6	Confident	85	Confident	30 Å²	30	70.4 Å²	70.4	18%	0.184	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.5	172.6	54.4	0	0	0	0	111	Y847 Q868 A893 R894	Y847-T849 HydrophobicContact CD1-CG2 4Å; Y847-T849 HydrophobicContact CE1-CG2 3.59Å; T849-Q868 CarbonylContact C-O 3.54Å; T849-Q868 WeakPolarHBondContact CA-O 3.45Å; T849-A893 CarbonylContact O-C 3.58Å; T849-A893 WeakPolarHBondContact O-CA 3.1Å; T849-R894 PolarHBondContact N-O 2.86Å; T849-R894 PolarHBondContact O-N 3.14Å; T849-R894 PolarHBondContact OG1-O 3.26Å
850	Y	91.5	Very high	85	Confident	19 Å²	19	67.9 Å²	67.9	8%	0.075	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.9	-178.7	-60.6	-85.5	0	0	0	111.5	L812 I834 K835 S836 Q868 I891 I892 A893	L812-Y850 HydrophobicContact CD2-CE1 4.36Å; I834-Y850 HydrophobicContact CG2-CD1 4.28Å; I834-Y850 HydrophobicContact CG2-CE1 4.07Å; K835-Y850 WeakPolarHBondContact CA-OH 3.39Å; S836-Y850 PolarHBondContact N-OH 2.98Å; S836-Y850 WeakPolarHBondContact OG-CE1 3.37Å; S836-Y850 PolarHBondContact OG-OH 3.31Å; Y850-Q868 PolarHBondContact N-O 3.19Å; Y850-I891 HydrophobicContact CD1-CG1 4.35Å; Y850-I892 CarbonylContact C-O 3.59Å; Y850-I892 WeakPolarHBondContact CA-O 3.47Å; Y850-A893 HydrophobicContact CD1-CB 4.4Å; Y850-A893 HydrophobicContact CE1-CB 4.28Å
851	E	90	Very high	85	Confident	80 Å²	80	69.3 Å²	69.3	37%	0.374	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.9	175.5	-175	177.9	104.5	0	0	111.1	I891 I892 R894	E851-I891 WeakPolarHBondContact O-CD1 3.5Å; E851-I892 HydrophobicContact CB-CB 4.43Å; E851-I892 PolarHBondContact N-O 2.91Å; E851-I892 PolarHBondContact O-N 3.46Å; E851-R894 VanDerWaalsContact CD-NH1 3.29Å; E851-R894 VanDerWaalsContact CD-NH2 3.31Å; E851-R894 IonicContact OE1-CZ 2.68Å; E851-R894 IonicContact OE1-NH1 3.15Å; E851-R894 PolarHBondContact OE1-NH1 2.82Å; E851-R894 IonicContact OE1-NH2 2.78Å; E851-R894 PolarHBondContact OE1-NH2 2.84Å; E851-R894 IonicContact OE2-CZ 3.38Å; E851-R894 IonicContact OE2-NH1 3.15Å; E851-R894 PolarHBondContact OE2-NH1 2.88Å; E851-R894 IonicContact OE2-NH2 2.7Å
852	L	92.2	Very high	85.2	Confident	37 Å²	37	69.2 Å²	69.2	19%	0.194	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.1	170.4	175.4	152.6	0	0	0	109.8	D854 I864 V866 F889	L852-D854 WeakPolarHBondContact CD2-OD1 3.43Å; L852-I864 HydrophobicContact CD1-CD1 3.47Å; L852-I864 VanDerWaalsContact CD1-CD1 3.47Å; L852-I864 HydrophobicContact CD1-CG1 3.87Å; L852-V866 HydrophobicContact CB-CG2 4.15Å; L852-V866 HydrophobicContact CD1-CG2 3.96Å; L852-F889 HydrophobicContact CB-CD2 4.43Å; L852-F889 HydrophobicContact CD1-CB 4.45Å; L852-F889 HydrophobicContact CD1-CD2 3.67Å; L852-F889 HydrophobicContact CD1-CE2 3.93Å; L852-F889 HydrophobicContact CD1-CG 4.03Å; L852-F889 HydrophobicContact CD1-CZ 4.49Å; L852-F889 HydrophobicContact CG-CB 4.36Å; L852-F889 HydrophobicContact CG-CD2 3.72Å; L852-F889 HydrophobicContact CG-CE2 4.28Å; L852-F889 HydrophobicContact CG-CG 4.26Å
853	R	90	Very high	85.7	Confident	87 Å²	87	66.6 Å²	66.6	33%	0.328	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	118.9	170.6	-178.7	-161.7	-64.3	157.7	3.6	108.5	I890 I892 E915	R853-I890 HydrophobicContact CB-CB 4.15Å; R853-I890 HydrophobicContact CB-CG2 4.48Å; R853-I890 PolarHBondContact N-O 3.14Å; R853-I890 PolarHBondContact O-N 3.19Å; R853-I892 HydrophobicContact CB-CD1 4.18Å; R853-I892 VanDerWaalsContact NH2-CD1 3.27Å; R853-E915 IonicContact CZ-OE2 2.7Å; R853-E915 IonicContact NH1-OE1 3.62Å; R853-E915 PolarHBondContact NH1-OE1 2.87Å; R853-E915 IonicContact NH1-OE2 3.4Å; R853-E915 PolarHBondContact NH1-OE2 3.18Å; R853-E915 IonicContact NH2-OE2 3.27Å; R853-E915 PolarHBondContact NH2-OE2 3.21Å
854	D	87.8	Confident	86.3	Confident	57 Å²	57	58.1 Å²	58.1	31%	0.305	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	146	174.9	-74.4	-39.1	0	0	0	111.4	L852 A860 S861	L852-D854 WeakPolarHBondContact CD2-OD1 3.43Å; D854-A860 WeakPolarHBondContact OD1-CA 3.37Å; D854-A860 PolarHBondContact OD1-N 3.08Å; D854-S861 WeakPolarHBondContact OD1-CB 3.42Å; D854-S861 PolarHBondContact OD1-N 2.83Å; D854-S861 PolarHBondContact OD1-OG 3.02Å; D854-S861 VanDerWaalsContact OD2-CB 3.29Å; D854-S861 WeakPolarHBondContact OD2-CB 3.46Å; D854-S861 PolarHBondContact OD2-OG 2.8Å
855	V	82.7	Confident	86.9	Confident	48 Å²	48	57.1 Å²	57.1	29%	0.291	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-96.8	148.1	176.8	168	0	0	0	0	109.8	N857 I858 I890	V855-N857 PolarHBondContact O-N 2.84Å; V855-I858 CarbonylContact O-C 3.56Å; V855-I858 PolarHBondContact O-N 2.87Å; V855-I890 HydrophobicContact CG2-CD1 4.33Å; V855-I890 HydrophobicContact CG2-CG1 4.05Å
856	V	72.4	Confident	87.4	Confident	122 Å²	122	57.4 Å²	57.4	74%	0.739	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	132.8	-179.1	-173.2	0	0	0	0	110.2	I858	V856-I858 VanDerWaalsContact C-N 3.35Å; V856-I858 PolarHBondContact O-N 2.82Å
857	N	74.6	Confident	87.7	Confident	157 Å²	157	57.1 Å²	57.1	84%	0.84	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-13.8	-174.2	-45.9	-51.2	0	0	0	117.2	V855	V855-N857 PolarHBondContact O-N 2.84Å
858	I	79.6	Confident	87.9	Confident	47 Å²	47	59.9 Å²	59.9	24%	0.241	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-133.6	106	175.8	-60.7	177.6	0	0	0	111	V855 V856 A860 I884 I887 P888	V855-I858 CarbonylContact O-C 3.56Å; V855-I858 PolarHBondContact O-N 2.87Å; V856-I858 VanDerWaalsContact C-N 3.35Å; V856-I858 PolarHBondContact O-N 2.82Å; I858-A860 PolarHBondContact O-N 2.98Å; I858-I884 HydrophobicContact CD1-CD1 4.48Å; I858-I884 HydrophobicContact CG2-CD1 3.94Å; I858-I887 HydrophobicContact CG2-CG2 4.48Å; I858-P888 HydrophobicContact CB-CG 4.48Å; I858-P888 HydrophobicContact CD1-CG 3.93Å
859	N	86.6	Confident	87.9	Confident	88 Å²	88	63.5 Å²	63.5	47%	0.471	33%	0.326	S	S	.	.			trans	-72.8	78.5	168.7	-67.4	31.6	0	0	0	109.7	S861 N862 F863	N859-S861 PolarHBondContact O-N 2.89Å; N859-S861 VanDerWaalsContact O-N 3.14Å; N859-N862 WeakPolarHBondContact O-CB 3.33Å; N859-N862 PolarHBondContact O-N 2.76Å; N859-F863 WeakPolarHBondContact O-CD2 3.47Å
860	A	88.8	Confident	87.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-51	-33.4	173.9	0	0	0	0	0	112.2	D854 I858 N862 F863 I864 I887 F889	D854-A860 WeakPolarHBondContact OD1-CA 3.37Å; D854-A860 PolarHBondContact OD1-N 3.08Å; I858-A860 PolarHBondContact O-N 2.98Å; A860-N862 PolarHBondContact O-N 2.74Å; A860-F863 WeakPolarHBondContact O-CA 3.28Å; A860-F863 PolarHBondContact O-N 2.93Å; A860-I864 HydrophobicContact CB-CD1 4.37Å; A860-I864 HydrophobicContact CB-CG1 4.22Å; A860-I864 WeakPolarHBondContact O-CG1 3.16Å; A860-I864 PolarHBondContact O-N 3.21Å; A860-I887 HydrophobicContact CB-CG2 3.45Å; A860-I887 VanDerWaalsContact CB-CG2 3.45Å; A860-F889 HydrophobicContact CB-CB 3.7Å; A860-F889 HydrophobicContact CB-CD1 4.43Å; A860-F889 HydrophobicContact CB-CG 4.34Å
861	S	88.3	Confident	87.8	Confident	31 Å²	31	63.2 Å²	63.2	22%	0.217	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-14.2	171.7	67.5	0	0	0	0	115.3	D854 N859 R876	D854-S861 WeakPolarHBondContact OD1-CB 3.42Å; D854-S861 PolarHBondContact OD1-N 2.83Å; D854-S861 PolarHBondContact OD1-OG 3.02Å; D854-S861 VanDerWaalsContact OD2-CB 3.29Å; D854-S861 WeakPolarHBondContact OD2-CB 3.46Å; D854-S861 PolarHBondContact OD2-OG 2.8Å; N859-S861 PolarHBondContact O-N 2.89Å; N859-S861 VanDerWaalsContact O-N 3.14Å; S861-R876 VanDerWaalsContact O-CD 3.29Å; S861-R876 WeakPolarHBondContact O-CD 3.09Å; S861-R876 PolarHBondContact O-NE 2.94Å; S861-R876 PolarHBondContact O-NH1 3.01Å; S861-R876 PolarHBondContact O-NH2 2.84Å
862	N	89.6	Confident	88	Confident	94 Å²	94	60.9 Å²	60.9	50%	0.503	32%	0.316	S	S	.	.	H	α-helix	trans	-84.2	-29	168.5	-71.9	-24.8	0	0	0	112.9	N859 A860 R876	N859-N862 WeakPolarHBondContact O-CB 3.33Å; N859-N862 PolarHBondContact O-N 2.76Å; A860-N862 PolarHBondContact O-N 2.74Å; N862-R876 WeakPolarHBondContact O-CD 3.3Å
863	F	92.2	Very high	88.2	Confident	22 Å²	22	59.1 Å²	59.1	10%	0.096	31%	0.307	C	S	.	.	H	α-helix	trans	-97.6	-29	-174.1	-60.3	-92.4	0	0	0	112.9	N859 A860 R876 L879 I884 I887	N859-F863 WeakPolarHBondContact O-CD2 3.47Å; A860-F863 WeakPolarHBondContact O-CA 3.28Å; A860-F863 PolarHBondContact O-N 2.93Å; F863-R876 WeakPolarHBondContact O-CB 3.2Å; F863-R876 PolarHBondContact O-N 2.56Å; F863-L879 HydrophobicContact CB-CD2 4.12Å; F863-L879 HydrophobicContact CD1-CD2 4.14Å; F863-I884 HydrophobicContact CD1-CD1 4.27Å; F863-I884 HydrophobicContact CD1-CG2 3.8Å; F863-I884 HydrophobicContact CD2-CD1 4.21Å; F863-I884 HydrophobicContact CE1-CB 4.13Å; F863-I884 HydrophobicContact CE1-CD1 3.89Å; F863-I884 HydrophobicContact CE1-CG2 3.46Å; F863-I884 VanDerWaalsContact CE1-CG2 3.46Å; F863-I884 HydrophobicContact CE2-CD1 3.82Å; F863-I884 HydrophobicContact CG-CD1 4.44Å; F863-I884 HydrophobicContact CZ-CB 4.47Å; F863-I884 HydrophobicContact CZ-CD1 3.66Å; F863-I884 HydrophobicContact CZ-CG2 4.26Å; F863-I887 HydrophobicContact CB-CD1 3.59Å; F863-I887 HydrophobicContact CB-CG1 4.2Å; F863-I887 HydrophobicContact CB-CG2 4.47Å; F863-I887 HydrophobicContact CD1-CD1 4.39Å; F863-I887 HydrophobicContact CG-CD1 4.1Å; F863-I887 HydrophobicContact CG-CG1 4.3Å
864	I	94.1	Very high	88.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	178.9	-174.3	61.3	158.9	0	0	0	113.6	I831 L852 A860 I873 Y874 R876 I887 F889 I920	I831-I864 HydrophobicContact CD1-CB 4.46Å; I831-I864 HydrophobicContact CD1-CG2 3.46Å; I831-I864 VanDerWaalsContact CD1-CG2 3.46Å; L852-I864 HydrophobicContact CD1-CD1 3.47Å; L852-I864 VanDerWaalsContact CD1-CD1 3.47Å; L852-I864 HydrophobicContact CD1-CG1 3.87Å; A860-I864 HydrophobicContact CB-CD1 4.37Å; A860-I864 HydrophobicContact CB-CG1 4.22Å; A860-I864 WeakPolarHBondContact O-CG1 3.16Å; A860-I864 PolarHBondContact O-N 3.21Å; I864-I873 HydrophobicContact CB-CG2 4.45Å; I864-I873 HydrophobicContact CD1-CG2 3.91Å; I864-Y874 CarbonylContact C-O 3.51Å; I864-Y874 WeakPolarHBondContact CA-O 3.33Å; I864-Y874 WeakPolarHBondContact CB-O 3.46Å; I864-R876 PolarHBondContact O-NE 2.94Å; I864-R876 PolarHBondContact O-NH2 3.12Å; I864-I887 HydrophobicContact CG2-CD1 4.36Å; I864-F889 HydrophobicContact CD1-CD1 3.63Å; I864-F889 HydrophobicContact CD1-CE1 3.34Å; I864-F889 HydrophobicContact CD1-CE2 4.33Å; I864-F889 HydrophobicContact CD1-CG 4.22Å; I864-F889 HydrophobicContact CD1-CZ 3.72Å; I864-I920 HydrophobicContact CD1-CD1 3.86Å; I864-I920 HydrophobicContact CG2-CD1 3.83Å
865	Y	94.2	Very high	88.7	Confident	70 Å²	70	55.3 Å²	55.3	28%	0.275	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	159.9	160.7	62.8	-83.7	0	0	0	110.3	H828 Y874 R876	H828-Y865 AromaticContact CE1-CE1 3.98Å; H828-Y865 AromaticContact ND1-CE1 3.43Å; H828-Y865 WeakPolarHBondContact ND1-CE1 3.41Å; H828-Y865 AromaticContact ND1-CZ 3.56Å; H828-Y865 PolarHBondContact ND1-OH 3Å; Y865-Y874 HydrophobicContact CD2-CD2 4.27Å; Y865-Y874 VanDerWaalsContact CE1-CB 3.46Å; Y865-Y874 HydrophobicContact CE1-CG 4.4Å; Y865-Y874 AromaticContact CE2-CD2 3.54Å; Y865-Y874 HydrophobicContact CE2-CD2 3.54Å; Y865-Y874 HydrophobicContact CE2-CE2 4.44Å; Y865-Y874 AromaticContact CE2-CG 3.91Å; Y865-Y874 HydrophobicContact CE2-CG 3.91Å; Y865-Y874 AromaticContact CZ-CD2 3.87Å; Y865-Y874 AromaticContact CZ-CG 3.73Å; Y865-Y874 PolarHBondContact N-O 3.21Å; Y865-Y874 PolarHBondContact O-N 2.74Å; Y865-Y874 WeakPolarHBondContact OH-CB 3.16Å; Y865-R876 HydrophobicContact CD1-CB 4.33Å
866	V	93.7	Very high	89.1	Confident	22 Å²	22	58 Å²	58	13%	0.133	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.1	176.8	-174.2	0	0	0	0	109.5	L852 I872 I873 F889 I891	L852-V866 HydrophobicContact CB-CG2 4.15Å; L852-V866 HydrophobicContact CD1-CG2 3.96Å; V866-I872 CarbonylContact C-O 3.51Å; V866-I872 VanDerWaalsContact CA-O 3.31Å; V866-I872 WeakPolarHBondContact CA-O 3.23Å; V866-I873 HydrophobicContact CG2-CG1 4.24Å; V866-I873 HydrophobicContact CG2-CG2 4.29Å; V866-F889 HydrophobicContact CG2-CE2 4.14Å; V866-F889 HydrophobicContact CG2-CZ 4.41Å; V866-I891 HydrophobicContact CB-CD1 4.39Å; V866-I891 HydrophobicContact CG1-CD1 3.97Å; V866-I891 HydrophobicContact CG2-CD1 4.12Å
867	E	91.7	Very high	90	Very high	88 Å²	88	54.9 Å²	54.9	41%	0.411	27%	0.27	S	S	.	.			trans	-82.3	119.3	175.8	178.9	174.8	-128.4	0	0	111.4	N869 T870 G871 I872	E867-N869 VanDerWaalsContact C-N 3.27Å; E867-N869 PolarHBondContact O-N 3.14Å; E867-N869 VanDerWaalsContact O-N 3.12Å; E867-T870 WeakPolarHBondContact CB-OG1 3.23Å; E867-T870 HydrophobicContact CG-CG2 4.26Å; E867-T870 VanDerWaalsContact CG-OG1 3.3Å; E867-T870 WeakPolarHBondContact CG-OG1 3.48Å; E867-T870 PolarHBondContact O-N 3.34Å; E867-T870 WeakPolarHBondContact OE2-CB 3.26Å; E867-T870 WeakPolarHBondContact OE2-CG2 3.43Å; E867-T870 PolarHBondContact OE2-OG1 2.79Å; E867-G871 PolarHBondContact O-N 2.84Å; E867-I872 PolarHBondContact N-O 3.12Å
868	Q	89.1	Confident	90.8	Very high	133 Å²	133	52.1 Å²	52.1	62%	0.621	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.7	-165.7	-65.7	-176.5	-50.9	0	0	115.3	T849 Y850	T849-Q868 CarbonylContact C-O 3.54Å; T849-Q868 WeakPolarHBondContact CA-O 3.45Å; Y850-Q868 PolarHBondContact N-O 3.19Å
869	N	87.1	Confident	91.3	Very high	102 Å²	102	50.1 Å²	50.1	55%	0.545	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-6.5	-175.8	-66.7	-8	0	0	0	113.5	Y847 E867	Y847-N869 PolarHBondContact OH-ND2 3.06Å; Y847-N869 PolarHBondContact OH-OD1 2.87Å; E867-N869 VanDerWaalsContact C-N 3.27Å; E867-N869 PolarHBondContact O-N 3.14Å; E867-N869 VanDerWaalsContact O-N 3.12Å
870	T	88.9	Confident	91.4	Very high	42 Å²	42	49.5 Å²	49.5	26%	0.258	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-17.8	-169.9	64.6	0	0	0	0	113.6	Q833 E867 I872	Q833-T870 WeakPolarHBondContact CG-O 3.29Å; Q833-T870 PolarHBondContact NE2-O 2.75Å; E867-T870 WeakPolarHBondContact CB-OG1 3.23Å; E867-T870 HydrophobicContact CG-CG2 4.26Å; E867-T870 VanDerWaalsContact CG-OG1 3.3Å; E867-T870 WeakPolarHBondContact CG-OG1 3.48Å; E867-T870 PolarHBondContact O-N 3.34Å; E867-T870 WeakPolarHBondContact OE2-CB 3.26Å; E867-T870 WeakPolarHBondContact OE2-CG2 3.43Å; E867-T870 PolarHBondContact OE2-OG1 2.79Å; T870-I872 HydrophobicContact CG2-CD1 4.47Å; T870-I872 PolarHBondContact O-N 2.89Å; T870-I872 WeakPolarHBondContact OG1-CG1 3.2Å; T870-I872 PolarHBondContact OG1-N 2.91Å
871	G	89.9	Confident	91.4	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.25	C	C	.	.			trans	72.4	10.6	-176	0	0	0	0	0	113.8	I834 E867	I834-G871 PolarHBondContact N-O 2.82Å; E867-G871 PolarHBondContact O-N 2.84Å
872	I	94.5	Very high	91.2	Very high	32 Å²	32	53.4 Å²	53.4	16%	0.164	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	130.6	-177.6	-60.2	171.4	0	0	0	110.5	L830 Q833 V866 E867 T870 Y874	L830-I872 HydrophobicContact CD1-CG2 3.35Å; Q833-I872 HydrophobicContact CB-CG1 4.18Å; Q833-I872 HydrophobicContact CG-CG1 3.8Å; V866-I872 CarbonylContact C-O 3.51Å; V866-I872 VanDerWaalsContact CA-O 3.31Å; V866-I872 WeakPolarHBondContact CA-O 3.23Å; E867-I872 PolarHBondContact N-O 3.12Å; T870-I872 HydrophobicContact CG2-CD1 4.47Å; T870-I872 PolarHBondContact O-N 2.89Å; T870-I872 WeakPolarHBondContact OG1-CG1 3.2Å; T870-I872 PolarHBondContact OG1-N 2.91Å; I872-Y874 HydrophobicContact CB-CE2 4.02Å; I872-Y874 HydrophobicContact CG2-CD2 4.02Å; I872-Y874 HydrophobicContact CG2-CE1 4.27Å; I872-Y874 HydrophobicContact CG2-CE2 3.39Å
873	I	95.4	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.3	-176.6	-43.2	160.5	0	0	0	109.7	F819 I831 G832 I834 I864 V866 F889 V918 I920	F819-I873 HydrophobicContact CD2-CD1 3.69Å; F819-I873 HydrophobicContact CE2-CD1 3.29Å; F819-I873 HydrophobicContact CZ-CD1 3.88Å; I831-I873 HydrophobicContact CB-CB 4.15Å; I831-I873 HydrophobicContact CB-CG2 4.11Å; I831-I873 HydrophobicContact CD1-CG2 4.26Å; I831-I873 HydrophobicContact CG2-CG2 4.48Å; I831-I873 PolarHBondContact N-O 3.25Å; G832-I873 PolarHBondContact O-N 3.29Å; I834-I873 HydrophobicContact CD1-CD1 3.8Å; I834-I873 HydrophobicContact CD1-CG1 4.07Å; I834-I873 HydrophobicContact CG1-CD1 4.12Å; I864-I873 HydrophobicContact CB-CG2 4.45Å; I864-I873 HydrophobicContact CD1-CG2 3.91Å; V866-I873 HydrophobicContact CG2-CG1 4.24Å; V866-I873 HydrophobicContact CG2-CG2 4.29Å; I873-F889 HydrophobicContact CD1-CZ 4.08Å; I873-F889 HydrophobicContact CG1-CZ 4.39Å; I873-F889 HydrophobicContact CG2-CZ 4.29Å; I873-V918 HydrophobicContact CD1-CG1 4.36Å; I873-I920 HydrophobicContact CG2-CD1 4.35Å
874	Y	95.1	Very high	90.7	Very high	61 Å²	61	53.8 Å²	53.8	24%	0.239	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	150.7	-178.2	-69.4	-80.6	0	0	0	112.9	S829 L830 I864 Y865 I872	S829-Y874 CarbonylContact O-C 3.57Å; S829-Y874 WeakPolarHBondContact O-CA 3.39Å; L830-Y874 HydrophobicContact CB-CE1 4.35Å; L830-Y874 HydrophobicContact CD1-CE1 4.33Å; I864-Y874 CarbonylContact C-O 3.51Å; I864-Y874 WeakPolarHBondContact CA-O 3.33Å; I864-Y874 WeakPolarHBondContact CB-O 3.46Å; Y865-Y874 HydrophobicContact CD2-CD2 4.27Å; Y865-Y874 VanDerWaalsContact CE1-CB 3.46Å; Y865-Y874 HydrophobicContact CE1-CG 4.4Å; Y865-Y874 AromaticContact CE2-CD2 3.54Å; Y865-Y874 HydrophobicContact CE2-CD2 3.54Å; Y865-Y874 HydrophobicContact CE2-CE2 4.44Å; Y865-Y874 AromaticContact CE2-CG 3.91Å; Y865-Y874 HydrophobicContact CE2-CG 3.91Å; Y865-Y874 AromaticContact CZ-CD2 3.87Å; Y865-Y874 AromaticContact CZ-CG 3.73Å; Y865-Y874 PolarHBondContact N-O 3.21Å; Y865-Y874 PolarHBondContact O-N 2.74Å; Y865-Y874 WeakPolarHBondContact OH-CB 3.16Å; I872-Y874 HydrophobicContact CB-CE2 4.02Å; I872-Y874 HydrophobicContact CG2-CD2 4.02Å; I872-Y874 HydrophobicContact CG2-CE1 4.27Å; I872-Y874 HydrophobicContact CG2-CE2 3.39Å
875	S	93.9	Very high	90.4	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.014	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	130.9	172.7	74.8	0	0	0	0	112	P826 H828 S829 K877	P826-S875 PolarHBondContact O-OG 2.82Å; H828-S875 VanDerWaalsContact CA-O 3.25Å; H828-S875 WeakPolarHBondContact CA-O 3.16Å; H828-S875 PolarHBondContact N-O 2.91Å; H828-S875 PolarHBondContact N-OG 2.89Å; S829-S875 PolarHBondContact N-OG 3.01Å; S829-S875 PolarHBondContact O-N 2.84Å; S875-K877 WeakPolarHBondContact CB-O 3.28Å; S875-K877 PolarHBondContact OG-O 2.92Å
876	R	92.2	Very high	90.2	Very high	104 Å²	104	58.4 Å²	58.4	39%	0.392	28%	0.277	S	S	.	.	S	Bend	trans	-87	-24	176.4	-174.4	175.7	-69.7	-147.1	0.1	112.5	R827 S861 N862 F863 I864 Y865	R827-R876 WeakPolarHBondContact CG-O 3.33Å; R827-R876 PolarHBondContact NE-O 2.8Å; S861-R876 VanDerWaalsContact O-CD 3.29Å; S861-R876 WeakPolarHBondContact O-CD 3.09Å; S861-R876 PolarHBondContact O-NE 2.94Å; S861-R876 PolarHBondContact O-NH1 3.01Å; S861-R876 PolarHBondContact O-NH2 2.84Å; N862-R876 WeakPolarHBondContact O-CD 3.3Å; F863-R876 WeakPolarHBondContact O-CB 3.2Å; F863-R876 PolarHBondContact O-N 2.56Å; I864-R876 PolarHBondContact O-NE 2.94Å; I864-R876 PolarHBondContact O-NH2 3.12Å; Y865-R876 HydrophobicContact CD1-CB 4.33Å
877	K	89.9	Confident	90.2	Very high	58 Å²	58	57.3 Å²	57.3	25%	0.252	27%	0.27	S	S	.	.	S	Bend	trans	-140.7	177.8	172.9	58.5	159.7	-179.1	175.6	0	110.1	S875 L879 E883	S875-K877 WeakPolarHBondContact CB-O 3.28Å; S875-K877 PolarHBondContact OG-O 2.92Å; K877-L879 HydrophobicContact CG-CD2 4.48Å; K877-E883 IonicContact NZ-OE1 3.88Å; K877-E883 PolarHBondContact NZ-OE1 2.82Å; K877-E883 IonicContact NZ-OE2 3.72Å; K877-E883 PolarHBondContact NZ-OE2 2.86Å
878	I	92.1	Very high	90.2	Very high	98 Å²	98	54.9 Å²	54.9	50%	0.503	26%	0.262	S	S	.	.			trans	-64.5	139.7	162.3	-59.6	174.6	0	0	0	107.3
879	L	90.5	Very high	90.5	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.031	23%	0.233	C	C	.	.			trans	-100	147.3	177	-57.8	-179.1	0	0	0	109.7	I821 E823 G824 F863 K877 I887 I922	I821-L879 HydrophobicContact CG2-CD1 4.2Å; E823-L879 WeakPolarHBondContact CB-O 3.45Å; G824-L879 PolarHBondContact N-O 2.91Å; F863-L879 HydrophobicContact CB-CD2 4.12Å; F863-L879 HydrophobicContact CD1-CD2 4.14Å; K877-L879 HydrophobicContact CG-CD2 4.48Å; L879-I887 HydrophobicContact CD1-CD1 4.07Å; L879-I887 HydrophobicContact CD2-CD1 3.97Å; L879-I922 HydrophobicContact CB-CD1 4.04Å; L879-I922 HydrophobicContact CB-CG1 4.48Å; L879-I922 HydrophobicContact CD1-CD1 4.14Å; L879-I922 HydrophobicContact CD1-CG1 4.32Å; L879-I922 HydrophobicContact CG-CD1 4.48Å
880	D	88.7	Confident	90.7	Very high	75 Å²	75	45.8 Å²	45.8	40%	0.401	22%	0.217	S	C	.	.			trans	-149.3	117.8	-164.4	-178.5	108.6	0	0	0	105.5	E883 I884	D880-E883 HydrophobicContact CB-CB 4.11Å; D880-E883 PolarHBondContact O-N 2.81Å; D880-E883 WeakPolarHBondContact OD2-CB 3.24Å; D880-E883 PolarHBondContact OD2-N 2.88Å; D880-I884 PolarHBondContact O-N 2.83Å
881	R	87.4	Confident	90.9	Very high	51 Å²	51	43.8 Å²	43.8	19%	0.192	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-36.8	-169.8	171.5	-174.1	159.6	96.4	-14.8	111.5	E823 E883 I884 Q885 I922 D924	E823-R881 WeakPolarHBondContact OE1-CB 3.37Å; E823-R881 WeakPolarHBondContact OE2-CB 3.13Å; E823-R881 PolarHBondContact OE2-N 2.86Å; R881-E883 VanDerWaalsContact C-N 3.29Å; R881-E883 PolarHBondContact O-N 2.82Å; R881-I884 WeakPolarHBondContact CA-O 3.44Å; R881-I884 CarbonylContact O-C 3.52Å; R881-I884 PolarHBondContact O-N 3.38Å; R881-I884 VanDerWaalsContact O-N 3.1Å; R881-Q885 HydrophobicContact CG-CG 4.03Å; R881-Q885 WeakPolarHBondContact O-CG 3.37Å; R881-Q885 PolarHBondContact O-N 2.88Å; R881-I922 HydrophobicContact CB-CG2 3.92Å; R881-D924 VanDerWaalsContact CD-CA 3.4Å; R881-D924 IonicContact CZ-OD2 2.72Å; R881-D924 VanDerWaalsContact NE-CG 3.32Å; R881-D924 IonicContact NE-OD2 2.78Å; R881-D924 PolarHBondContact NE-OD2 2.68Å; R881-D924 IonicContact NH1-OD2 3.28Å; R881-D924 IonicContact NH2-OD2 3.26Å; R881-D924 PolarHBondContact NH2-OD2 2.95Å
882	E	84.1	Confident	91	Very high	62 Å²	62	43.8 Å²	43.8	29%	0.29	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-22.8	-179.6	-81.7	41.9	-103.6	0	0	111.6
883	E	85.9	Confident	90.9	Very high	107 Å²	107	42.2 Å²	42.2	50%	0.5	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-47.2	159.5	-161.7	-164.1	149.2	0	0	112.5	K877 D880 R881	K877-E883 IonicContact NZ-OE1 3.88Å; K877-E883 PolarHBondContact NZ-OE1 2.82Å; K877-E883 IonicContact NZ-OE2 3.72Å; K877-E883 PolarHBondContact NZ-OE2 2.86Å; D880-E883 HydrophobicContact CB-CB 4.11Å; D880-E883 PolarHBondContact O-N 2.81Å; D880-E883 WeakPolarHBondContact OD2-CB 3.24Å; D880-E883 PolarHBondContact OD2-N 2.88Å; R881-E883 VanDerWaalsContact C-N 3.29Å; R881-E883 PolarHBondContact O-N 2.82Å
884	I	86.6	Confident	90.5	Very high	17 Å²	17	45 Å²	45	9%	0.087	21%	0.207	C	C	.	.			trans	-153.3	119.8	-175.1	-176.2	157.7	0	0	0	113.5	I858 F863 D880 R881 Q886 I887 I922	I858-I884 HydrophobicContact CD1-CD1 4.48Å; I858-I884 HydrophobicContact CG2-CD1 3.94Å; F863-I884 HydrophobicContact CD1-CD1 4.27Å; F863-I884 HydrophobicContact CD1-CG2 3.8Å; F863-I884 HydrophobicContact CD2-CD1 4.21Å; F863-I884 HydrophobicContact CE1-CB 4.13Å; F863-I884 HydrophobicContact CE1-CD1 3.89Å; F863-I884 HydrophobicContact CE1-CG2 3.46Å; F863-I884 VanDerWaalsContact CE1-CG2 3.46Å; F863-I884 HydrophobicContact CE2-CD1 3.82Å; F863-I884 HydrophobicContact CG-CD1 4.44Å; F863-I884 HydrophobicContact CZ-CB 4.47Å; F863-I884 HydrophobicContact CZ-CD1 3.66Å; F863-I884 HydrophobicContact CZ-CG2 4.26Å; D880-I884 PolarHBondContact O-N 2.83Å; R881-I884 WeakPolarHBondContact CA-O 3.44Å; R881-I884 CarbonylContact O-C 3.52Å; R881-I884 PolarHBondContact O-N 3.38Å; R881-I884 VanDerWaalsContact O-N 3.1Å; I884-Q886 WeakPolarHBondContact CD1-O 3.48Å; I884-Q886 VanDerWaalsContact CG1-O 3.25Å; I884-Q886 WeakPolarHBondContact CG1-O 3.47Å; I884-I887 HydrophobicContact CD1-CG1 3.74Å; I884-I887 HydrophobicContact CG1-CG1 4.13Å; I884-I922 HydrophobicContact CG2-CD1 3.86Å; I884-I922 WeakPolarHBondContact O-CD1 3.37Å
885	Q	87.1	Confident	89.8	Confident	61 Å²	61	42.6 Å²	42.6	29%	0.285	20%	0.199	S	C	.	.	S	Bend	trans	-85.3	-27	-177.2	-57.3	-158	-39.4	0	0	113.8	R881 I922 K990	R881-Q885 HydrophobicContact CG-CG 4.03Å; R881-Q885 WeakPolarHBondContact O-CG 3.37Å; R881-Q885 PolarHBondContact O-N 2.88Å; Q885-I922 PolarHBondContact O-N 3.16Å; Q885-K990 VanDerWaalsContact CD-NZ 3.26Å
886	Q	91.2	Very high	88.5	Confident	105 Å²	105	45.3 Å²	45.3	49%	0.491	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	142.9	178.5	-67.5	-176.9	-46.5	0	0	111.2	I884 P888 I920 N921	I884-Q886 WeakPolarHBondContact CD1-O 3.48Å; I884-Q886 VanDerWaalsContact CG1-O 3.25Å; I884-Q886 WeakPolarHBondContact CG1-O 3.47Å; Q886-P888 WeakPolarHBondContact O-CD 3.45Å; Q886-I920 CarbonylContact C-O 3.41Å; Q886-I920 VanDerWaalsContact CA-O 3.29Å; Q886-I920 WeakPolarHBondContact CA-O 3.34Å; Q886-N921 PolarHBondContact NE2-OD1 3.32Å
887	I	92.5	Very high	86.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	92.7	172.4	-54.7	157.2	0	0	0	108.7	I858 A860 F863 I864 L879 I884 I920 I922	I858-I887 HydrophobicContact CG2-CG2 4.48Å; A860-I887 HydrophobicContact CB-CG2 3.45Å; A860-I887 VanDerWaalsContact CB-CG2 3.45Å; F863-I887 HydrophobicContact CB-CD1 3.59Å; F863-I887 HydrophobicContact CB-CG1 4.2Å; F863-I887 HydrophobicContact CB-CG2 4.47Å; F863-I887 HydrophobicContact CD1-CD1 4.39Å; F863-I887 HydrophobicContact CG-CD1 4.1Å; F863-I887 HydrophobicContact CG-CG1 4.3Å; I864-I887 HydrophobicContact CG2-CD1 4.36Å; L879-I887 HydrophobicContact CD1-CD1 4.07Å; L879-I887 HydrophobicContact CD2-CD1 3.97Å; I884-I887 HydrophobicContact CD1-CG1 3.74Å; I884-I887 HydrophobicContact CG1-CG1 4.13Å; I887-I920 HydrophobicContact CB-CB 4.23Å; I887-I920 HydrophobicContact CB-CD1 4.48Å; I887-I920 PolarHBondContact N-O 2.76Å; I887-I920 PolarHBondContact O-N 2.83Å; I887-I922 HydrophobicContact CD1-CD1 3.86Å; I887-I922 HydrophobicContact CG1-CD1 4.18Å
888	P	93.1	Very high	85	Confident	36 Å²	36	46 Å²	46	23%	0.234	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	137.6	170.9	32.6	-33.2	0	0	0	111.2	I858 Q886 V918	I858-P888 HydrophobicContact CB-CG 4.48Å; I858-P888 HydrophobicContact CD1-CG 3.93Å; Q886-P888 WeakPolarHBondContact O-CD 3.45Å; P888-V918 CarbonylContact C-O 3.51Å; P888-V918 WeakPolarHBondContact CA-O 3.36Å
889	F	93.5	Very high	83	Confident	3 Å²	3	48.6 Å²	48.6	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	170.3	168.8	67	-80.8	0	0	0	111.2	I834 L852 A860 I864 V866 I873 I891 V918 I920	I834-F889 HydrophobicContact CD1-CE2 4.43Å; I834-F889 HydrophobicContact CD1-CZ 4.45Å; L852-F889 HydrophobicContact CB-CD2 4.43Å; L852-F889 HydrophobicContact CD1-CB 4.45Å; L852-F889 HydrophobicContact CD1-CD2 3.67Å; L852-F889 HydrophobicContact CD1-CE2 3.93Å; L852-F889 HydrophobicContact CD1-CG 4.03Å; L852-F889 HydrophobicContact CD1-CZ 4.49Å; L852-F889 HydrophobicContact CG-CB 4.36Å; L852-F889 HydrophobicContact CG-CD2 3.72Å; L852-F889 HydrophobicContact CG-CE2 4.28Å; L852-F889 HydrophobicContact CG-CG 4.26Å; A860-F889 HydrophobicContact CB-CB 3.7Å; A860-F889 HydrophobicContact CB-CD1 4.43Å; A860-F889 HydrophobicContact CB-CG 4.34Å; I864-F889 HydrophobicContact CD1-CD1 3.63Å; I864-F889 HydrophobicContact CD1-CE1 3.34Å; I864-F889 HydrophobicContact CD1-CE2 4.33Å; I864-F889 HydrophobicContact CD1-CG 4.22Å; I864-F889 HydrophobicContact CD1-CZ 3.72Å; V866-F889 HydrophobicContact CG2-CE2 4.14Å; V866-F889 HydrophobicContact CG2-CZ 4.41Å; I873-F889 HydrophobicContact CD1-CZ 4.08Å; I873-F889 HydrophobicContact CG1-CZ 4.39Å; I873-F889 HydrophobicContact CG2-CZ 4.29Å; F889-I891 HydrophobicContact CE2-CB 4.38Å; F889-I891 HydrophobicContact CE2-CD1 4.21Å; F889-V918 HydrophobicContact CD1-CB 3.9Å; F889-V918 HydrophobicContact CD1-CG1 4.14Å; F889-V918 HydrophobicContact CD2-CB 4.16Å; F889-V918 HydrophobicContact CD2-CG2 4.36Å; F889-V918 HydrophobicContact CE1-CB 3.57Å; F889-V918 HydrophobicContact CE1-CG1 3.36Å; F889-V918 HydrophobicContact CE1-CG2 4.47Å; F889-V918 HydrophobicContact CE2-CB 3.86Å; F889-V918 HydrophobicContact CE2-CG1 4.18Å; F889-V918 HydrophobicContact CE2-CG2 3.9Å; F889-V918 HydrophobicContact CG-CB 4.2Å; F889-V918 HydrophobicContact CZ-CB 3.57Å; F889-V918 HydrophobicContact CZ-CG1 3.4Å; F889-V918 VanDerWaalsContact CZ-CG1 3.4Å; F889-V918 HydrophobicContact CZ-CG2 3.98Å; F889-V918 PolarHBondContact N-O 2.9Å; F889-V918 PolarHBondContact O-N 2.83Å; F889-I920 HydrophobicContact CD1-CD1 4.49Å; F889-I920 HydrophobicContact CE1-CD1 3.8Å; F889-I920 HydrophobicContact CE1-CG1 4.2Å
890	I	93.2	Very high	80.7	Confident	41 Å²	41	52.7 Å²	52.7	21%	0.21	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132.5	169.4	-67.5	166.7	0	0	0	108	R853 V855 I892 E915 A916	R853-I890 HydrophobicContact CB-CB 4.15Å; R853-I890 HydrophobicContact CB-CG2 4.48Å; R853-I890 PolarHBondContact N-O 3.14Å; R853-I890 PolarHBondContact O-N 3.19Å; V855-I890 HydrophobicContact CG2-CD1 4.33Å; V855-I890 HydrophobicContact CG2-CG1 4.05Å; I890-I892 HydrophobicContact CG2-CG1 4.38Å; I890-E915 HydrophobicContact CG2-CB 4.01Å; I890-A916 WeakPolarHBondContact CA-O 3.41Å
891	I	93.1	Very high	78.3	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	144	166	-161.9	74.1	0	0	0	109.4	L812 I834 Y850 E851 V866 F889 E915 A916 V918	L812-I891 HydrophobicContact CD1-CG2 4.3Å; L812-I891 HydrophobicContact CD2-CG2 4.44Å; I834-I891 HydrophobicContact CD1-CB 3.81Å; I834-I891 HydrophobicContact CD1-CD1 3.89Å; I834-I891 HydrophobicContact CD1-CG1 3.68Å; I834-I891 HydrophobicContact CD1-CG2 3.99Å; I834-I891 HydrophobicContact CG2-CG1 4.21Å; I834-I891 HydrophobicContact CG2-CG2 4.02Å; Y850-I891 HydrophobicContact CD1-CG1 4.35Å; E851-I891 WeakPolarHBondContact O-CD1 3.5Å; V866-I891 HydrophobicContact CB-CD1 4.39Å; V866-I891 HydrophobicContact CG1-CD1 3.97Å; V866-I891 HydrophobicContact CG2-CD1 4.12Å; F889-I891 HydrophobicContact CE2-CB 4.38Å; F889-I891 HydrophobicContact CE2-CD1 4.21Å; I891-E915 VanDerWaalsContact O-CA 3.22Å; I891-E915 WeakPolarHBondContact O-CA 3.2Å; I891-E915 WeakPolarHBondContact O-CB 3.33Å; I891-A916 HydrophobicContact CG2-CB 3.86Å; I891-A916 PolarHBondContact N-O 3.35Å; I891-A916 PolarHBondContact O-N 3.5Å; I891-V918 HydrophobicContact CB-CG2 4.01Å; I891-V918 HydrophobicContact CG2-CG2 3.89Å
892	I	91.9	Very high	75.9	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124.1	173.7	-43.8	166.8	0	0	0	107.7	Y850 E851 R853 I890 R894 Y913 D914 E915	Y850-I892 CarbonylContact C-O 3.59Å; Y850-I892 WeakPolarHBondContact CA-O 3.47Å; E851-I892 HydrophobicContact CB-CB 4.43Å; E851-I892 PolarHBondContact N-O 2.91Å; E851-I892 PolarHBondContact O-N 3.46Å; R853-I892 HydrophobicContact CB-CD1 4.18Å; R853-I892 VanDerWaalsContact NH2-CD1 3.27Å; I890-I892 HydrophobicContact CG2-CG1 4.38Å; I892-R894 VanDerWaalsContact CD1-NH2 3.29Å; I892-R894 HydrophobicContact CG2-CG 3.8Å; I892-Y913 HydrophobicContact CG2-CD2 3.83Å; I892-Y913 HydrophobicContact CG2-CG 4.18Å; I892-D914 WeakPolarHBondContact CA-O 3.29Å; I892-E915 HydrophobicContact CG1-CB 4.48Å
893	A	91.1	Very high	73.6	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.2	165.4	0	0	0	0	0	108.6	P810 L812 I848 T849 Y850 Y913 D914	P810-A893 HydrophobicContact CB-CB 4.46Å; L812-A893 HydrophobicContact CD1-CB 4.45Å; L812-A893 HydrophobicContact CD2-CB 3.94Å; L812-A893 HydrophobicContact CG-CB 4.08Å; I848-A893 HydrophobicContact CG2-CB 3.84Å; T849-A893 CarbonylContact O-C 3.58Å; T849-A893 WeakPolarHBondContact O-CA 3.1Å; Y850-A893 HydrophobicContact CD1-CB 4.4Å; Y850-A893 HydrophobicContact CE1-CB 4.28Å; A893-Y913 WeakPolarHBondContact O-CA 3.48Å; A893-Y913 WeakPolarHBondContact O-CB 3.44Å; A893-D914 PolarHBondContact N-O 2.96Å; A893-D914 PolarHBondContact O-N 2.93Å; A893-D914 VanDerWaalsContact O-N 3.08Å
894	R	87.9	Confident	71	Confident	58 Å²	58	67.5 Å²	67.5	22%	0.219	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	138.8	179.4	-55.8	-163.3	-177.2	119.8	11.4	112.5	I848 T849 E851 I892 E896 F912	I848-R894 CarbonylContact C-O 3.49Å; I848-R894 WeakPolarHBondContact CA-O 3.44Å; T849-R894 PolarHBondContact N-O 2.86Å; T849-R894 PolarHBondContact O-N 3.14Å; T849-R894 PolarHBondContact OG1-O 3.26Å; E851-R894 VanDerWaalsContact CD-NH1 3.29Å; E851-R894 VanDerWaalsContact CD-NH2 3.31Å; E851-R894 IonicContact OE1-CZ 2.68Å; E851-R894 IonicContact OE1-NH1 3.15Å; E851-R894 PolarHBondContact OE1-NH1 2.82Å; E851-R894 IonicContact OE1-NH2 2.78Å; E851-R894 PolarHBondContact OE1-NH2 2.84Å; E851-R894 IonicContact OE2-CZ 3.38Å; E851-R894 IonicContact OE2-NH1 3.15Å; E851-R894 PolarHBondContact OE2-NH1 2.88Å; E851-R894 IonicContact OE2-NH2 2.7Å; I892-R894 VanDerWaalsContact CD1-NH2 3.29Å; I892-R894 HydrophobicContact CG2-CG 3.8Å; R894-E896 PolarHBondContact O-N 3.05Å; R894-E896 VanDerWaalsContact O-N 3.07Å; R894-F912 WeakPolarHBondContact CA-O 3.29Å
895	N	80.8	Confident	68.9	Low	11 Å²	11	74.1 Å²	74.1	6%	0.059	39%	0.391	C	S	.	.			trans	-85.8	49	174.7	62.2	7	0	0	0	113.6	N806 N808 P810 D838 N845 Y847 F912	N806-N895 PolarHBondContact ND2-ND2 2.81Å; N808-N895 PolarHBondContact O-ND2 3.33Å; P810-N895 HydrophobicContact CG-CB 4.27Å; D838-N895 VanDerWaalsContact OD2-CB 3.27Å; D838-N895 WeakPolarHBondContact OD2-CB 3.38Å; D838-N895 PolarHBondContact OD2-ND2 2.72Å; N845-N895 WeakPolarHBondContact O-CB 3.11Å; Y847-N895 CarbonylContact O-C 3.36Å; Y847-N895 WeakPolarHBondContact O-CA 3.29Å; N895-F912 PolarHBondContact N-O 2.9Å; N895-F912 PolarHBondContact OD1-N 3.45Å; N895-F912 PolarHBondContact OD1-O 3.49Å
896	E	65.9	Low	66.2	Low	58 Å²	58	80.1 Å²	80.1	27%	0.271	42%	0.419	S	S	.	.			trans	-91.3	112.9	173.2	-82.9	-137.3	136.2	0	0	112.9	R894 K899 T911	R894-E896 PolarHBondContact O-N 3.05Å; R894-E896 VanDerWaalsContact O-N 3.07Å; E896-K899 IonicContact OE1-NZ 3.12Å; E896-K899 PolarHBondContact OE1-NZ 2.91Å; E896-K899 IonicContact OE2-NZ 2.76Å; E896-K899 PolarHBondContact OE2-NZ 2.94Å; E896-T911 HydrophobicContact CG-CG2 3.8Å; E896-T911 WeakPolarHBondContact OE1-CG2 3.44Å
897	K	57	Low	63.6	Low	90 Å²	90	82.4 Å²	82.4	39%	0.391	43%	0.434	S	S	.	.			trans	-53.2	128.7	163.1	-151.8	-177.5	-173.4	-168.9	0	110.3	E844 K899	E844-K897 HydrophobicContact CB-CD 4.33Å; E844-K897 VanDerWaalsContact CD-CE 3.43Å; E844-K897 WeakPolarHBondContact OE1-CE 3.46Å; E844-K897 IonicContact OE1-NZ 2.89Å; E844-K897 PolarHBondContact OE1-NZ 2.81Å; E844-K897 WeakPolarHBondContact OE2-CE 3.19Å; E844-K897 IonicContact OE2-NZ 2.83Å; E844-K897 PolarHBondContact OE2-NZ 3.37Å; K897-K899 PolarHBondContact O-N 3.45Å; K897-K899 VanDerWaalsContact O-N 3.09Å
898	P	52.3	Low	60.9	Low	87 Å²	87	90.4 Å²	90.4	57%	0.565	48%	0.477	S	S	*	.			trans	-63.9	116.1	-171.1	23.1	-33.3	0	0	0	111.1	Y847 S900	Y847-P898 HydrophobicContact CE1-CG 4.12Å; P898-S900 PolarHBondContact O-N 2.92Å
899	K	48.6	Very low	58.8	Low	153 Å²	153	96.7 Å²	96.7	67%	0.665	50%	0.496	S	S	*	.			trans	-62.3	104.3	-171.9	-64.5	-169.1	176.1	89.9	0	111.6	E896 K897	E896-K899 IonicContact OE1-NZ 3.12Å; E896-K899 PolarHBondContact OE1-NZ 2.91Å; E896-K899 IonicContact OE2-NZ 2.76Å; E896-K899 PolarHBondContact OE2-NZ 2.94Å; K897-K899 PolarHBondContact O-N 3.45Å; K897-K899 VanDerWaalsContact O-N 3.09Å
900	S	43.3	Very low	56.8	Low	92 Å²	92	101 Å²	101	64%	0.643	52%	0.522	S	S	*	.			trans	-61.9	147.5	169.4	75.7	0	0	0	0	109.7	P898 L902	P898-S900 PolarHBondContact O-N 2.92Å; S900-L902 PolarHBondContact O-N 3.25Å
901	K	37.4	Very low	55.3	Low	217 Å²	217	102.4 Å²	102.4	94%	0.943	53%	0.533	S	S	*	.	S	Bend	trans	-80	32.2	-160.4	-143.7	170.9	-171.7	173.3	0	114.5
902	L	37.3	Very low	54.7	Low	166 Å²	166	105.2 Å²	105.2	87%	0.869	55%	0.545	S	S	*	.	S	Bend	trans	-155.4	48.6	-174.8	-155.8	76.3	0	0	0	115.7	S900	S900-L902 PolarHBondContact O-N 3.25Å
903	S	36.7	Very low	54.4	Low	102 Å²	102	111.5 Å²	111.5	71%	0.713	57%	0.57	S	S	*	*			trans	-149.2	97.1	166.6	62.2	0	0	0	0	113.2
904	S	30.1	Very low	54.4	Low	121 Å²	121	113.1 Å²	113.1	85%	0.846	58%	0.578	S	S	*	*			trans	-114.4	67.6	176.4	64.3	0	0	0	0	111.7
905	I	42.3	Very low	54.5	Low	156 Å²	156	113.9 Å²	113.9	80%	0.8	58%	0.584	S	S	*	*			trans	-129.8	133.6	168.4	-62.5	-179.9	0	0	0	106.9	L907	I905-L907 PolarHBondContact O-N 2.93Å
906	H	30.4	Very low	55	Low	187 Å²	187	113.4 Å²	113.4	87%	0.866	58%	0.582	S	S	*	*			trans	-68.8	122.5	-179.8	-71.7	-3.9	0	0	0	111.4
907	L	37.4	Very low	56.3	Low	153 Å²	153	113.1 Å²	113.1	80%	0.801	59%	0.586	S	S	*	*			trans	-127.8	129.7	154.5	-86.6	157.8	0	0	0	105.8	I905 R909	I905-L907 PolarHBondContact O-N 2.93Å; L907-R909 PolarHBondContact O-N 2.95Å
908	N	35.5	Very low	58	Low	168 Å²	168	108.9 Å²	108.9	90%	0.898	57%	0.568	S	S	*	*			trans	-71.4	81	174.3	-74.8	1.9	0	0	0	109
909	R	49	Very low	60	Low	168 Å²	168	106 Å²	106	63%	0.634	55%	0.549	S	S	*	.			trans	-77.1	119.2	159.5	-75.9	-171.3	170	-135	-5.3	107.5	L907 T911	L907-R909 PolarHBondContact O-N 2.95Å; R909-T911 PolarHBondContact O-N 3.43Å
910	T	52.8	Low	62.2	Low	94 Å²	94	98.7 Å²	98.7	58%	0.577	52%	0.517	S	S	*	.			trans	-58.8	115.2	161.3	30.5	0	0	0	0	107.9	N806	N806-T910 PolarHBondContact OD1-O 3.33Å
911	T	61.3	Low	64.5	Low	69 Å²	69	96.1 Å²	96.1	42%	0.423	50%	0.496	S	S	.	.			trans	-97.7	103	173.6	55.3	0	0	0	0	107.3	E896 R909	E896-T911 HydrophobicContact CG-CG2 3.8Å; E896-T911 WeakPolarHBondContact OE1-CG2 3.44Å; R909-T911 PolarHBondContact O-N 3.43Å
912	F	79.9	Confident	67.1	Low	59 Å²	59	86 Å²	86	26%	0.259	45%	0.453	S	S	.	.			trans	-78.3	151	178.2	-65.1	-96.9	0	0	0	110.5	N806 D807 P809 R894 N895	N806-F912 WeakPolarHBondContact O-CE2 3.43Å; N806-F912 VanDerWaalsContact OD1-CD2 3.31Å; N806-F912 WeakPolarHBondContact OD1-CD2 3.1Å; D807-F912 WeakPolarHBondContact O-CZ 3.26Å; P809-F912 HydrophobicContact CB-CB 3.88Å; P809-F912 HydrophobicContact CB-CD1 4.08Å; P809-F912 HydrophobicContact CB-CG 4.31Å; R894-F912 WeakPolarHBondContact CA-O 3.29Å; N895-F912 PolarHBondContact N-O 2.9Å; N895-F912 PolarHBondContact OD1-N 3.45Å; N895-F912 PolarHBondContact OD1-O 3.49Å
913	Y	86.2	Confident	69.4	Low	133 Å²	133	81.8 Å²	81.8	52%	0.522	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	154.6	177.8	70.9	-86.5	0	0	0	111.5	I892 A893	I892-Y913 HydrophobicContact CG2-CD2 3.83Å; I892-Y913 HydrophobicContact CG2-CG 4.18Å; A893-Y913 WeakPolarHBondContact O-CA 3.48Å; A893-Y913 WeakPolarHBondContact O-CB 3.44Å
914	D	89.6	Confident	71.5	Confident	34 Å²	34	79 Å²	79	18%	0.182	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	152.8	166.4	-176.2	21	0	0	0	108.3	P810 L812 I892 A893	P810-D914 WeakPolarHBondContact O-CB 3.46Å; L812-D914 WeakPolarHBondContact CB-OD2 3.21Å; L812-D914 HydrophobicContact CD1-CB 4.1Å; L812-D914 HydrophobicContact CG-CB 4.34Å; L812-D914 PolarHBondContact N-OD2 3.08Å; I892-D914 WeakPolarHBondContact CA-O 3.29Å; A893-D914 PolarHBondContact N-O 2.96Å; A893-D914 PolarHBondContact O-N 2.93Å; A893-D914 VanDerWaalsContact O-N 3.08Å
915	E	91.7	Very high	73.9	Confident	73 Å²	73	76.9 Å²	76.9	34%	0.341	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.7	-178.3	61.4	179	-124	0	0	112.8	R853 I890 I891 I892	R853-E915 IonicContact CZ-OE2 2.7Å; R853-E915 IonicContact NH1-OE1 3.62Å; R853-E915 PolarHBondContact NH1-OE1 2.87Å; R853-E915 IonicContact NH1-OE2 3.4Å; R853-E915 PolarHBondContact NH1-OE2 3.18Å; R853-E915 IonicContact NH2-OE2 3.27Å; R853-E915 PolarHBondContact NH2-OE2 3.21Å; I890-E915 HydrophobicContact CG2-CB 4.01Å; I891-E915 VanDerWaalsContact O-CA 3.22Å; I891-E915 WeakPolarHBondContact O-CA 3.2Å; I891-E915 WeakPolarHBondContact O-CB 3.33Å; I892-E915 HydrophobicContact CG1-CB 4.48Å
916	A	90.9	Very high	75.6	Confident	2 Å²	2	70.6 Å²	70.6	2%	0.017	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	149.7	178	0	0	0	0	0	110.8	L812 Q814 H815 Y817 I890 I891	L812-A916 HydrophobicContact CD1-CB 3.72Å; Q814-A916 VanDerWaalsContact O-CB 3.28Å; Q814-A916 WeakPolarHBondContact O-CB 3.34Å; H815-A916 WeakPolarHBondContact O-CA 3.25Å; H815-A916 WeakPolarHBondContact O-CB 3.3Å; Y817-A916 HydrophobicContact CD2-CB 3.92Å; Y817-A916 HydrophobicContact CE2-CB 3.78Å; I890-A916 WeakPolarHBondContact CA-O 3.41Å; I891-A916 HydrophobicContact CG2-CB 3.86Å; I891-A916 PolarHBondContact N-O 3.35Å; I891-A916 PolarHBondContact O-N 3.5Å
917	S	92.7	Very high	78.1	Confident	51 Å²	51	66.9 Å²	66.9	36%	0.357	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	139.2	171.1	52.4	0	0	0	0	109.9	H815 H816 Y817	H815-S917 PolarHBondContact O-N 3.21Å; H815-S917 PolarHBondContact O-OG 2.61Å; H816-S917 CarbonylContact C-O 3.58Å; H816-S917 VanDerWaalsContact CA-O 3.31Å; H816-S917 WeakPolarHBondContact CA-O 3.48Å; H816-S917 PolarHBondContact ND1-O 2.82Å; H816-S917 PolarHBondContact ND1-OG 2.91Å; Y817-S917 PolarHBondContact N-O 3.29Å
918	V	93.4	Very high	80.2	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	122	-179	-171.3	0	0	0	0	109.2	Y817 F819 I834 I873 P888 F889 I891	Y817-V918 HydrophobicContact CD2-CG2 4.21Å; Y817-V918 WeakPolarHBondContact O-CA 3.33Å; F819-V918 HydrophobicContact CD2-CG1 3.76Å; F819-V918 HydrophobicContact CE2-CG1 3.72Å; I834-V918 HydrophobicContact CD1-CG2 3.83Å; I873-V918 HydrophobicContact CD1-CG1 4.36Å; P888-V918 CarbonylContact C-O 3.51Å; P888-V918 WeakPolarHBondContact CA-O 3.36Å; F889-V918 HydrophobicContact CD1-CB 3.9Å; F889-V918 HydrophobicContact CD1-CG1 4.14Å; F889-V918 HydrophobicContact CD2-CB 4.16Å; F889-V918 HydrophobicContact CD2-CG2 4.36Å; F889-V918 HydrophobicContact CE1-CB 3.57Å; F889-V918 HydrophobicContact CE1-CG1 3.36Å; F889-V918 HydrophobicContact CE1-CG2 4.47Å; F889-V918 HydrophobicContact CE2-CB 3.86Å; F889-V918 HydrophobicContact CE2-CG1 4.18Å; F889-V918 HydrophobicContact CE2-CG2 3.9Å; F889-V918 HydrophobicContact CG-CB 4.2Å; F889-V918 HydrophobicContact CZ-CB 3.57Å; F889-V918 HydrophobicContact CZ-CG1 3.4Å; F889-V918 VanDerWaalsContact CZ-CG1 3.4Å; F889-V918 HydrophobicContact CZ-CG2 3.98Å; F889-V918 PolarHBondContact N-O 2.9Å; F889-V918 PolarHBondContact O-N 2.83Å; I891-V918 HydrophobicContact CB-CG2 4.01Å; I891-V918 HydrophobicContact CG2-CG2 3.89Å
919	T	93.8	Very high	82.4	Confident	26 Å²	26	56.1 Å²	56.1	16%	0.16	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.5	176.2	-58.6	0	0	0	0	109.6	Y817 I818 F819	Y817-T919 PolarHBondContact O-N 2.97Å; I818-T919 WeakPolarHBondContact CA-O 3.2Å; F819-T919 PolarHBondContact N-O 2.9Å
920	I	93.7	Very high	84	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.1	168.2	-57.2	161.6	0	0	0	108	F819 I821 I831 I864 I873 Q886 I887 F889	F819-I920 HydrophobicContact CB-CG1 4.36Å; F819-I920 CarbonylContact O-C 3.58Å; F819-I920 VanDerWaalsContact O-CA 3.24Å; F819-I920 WeakPolarHBondContact O-CA 3.08Å; I821-I920 HydrophobicContact CG2-CG2 3.48Å; I821-I920 VanDerWaalsContact CG2-CG2 3.48Å; I831-I920 HydrophobicContact CD1-CD1 4.01Å; I831-I920 HydrophobicContact CG2-CD1 3.91Å; I831-I920 HydrophobicContact CG2-CG1 3.91Å; I831-I920 HydrophobicContact CG2-CG2 4.02Å; I864-I920 HydrophobicContact CD1-CD1 3.86Å; I864-I920 HydrophobicContact CG2-CD1 3.83Å; I873-I920 HydrophobicContact CG2-CD1 4.35Å; Q886-I920 CarbonylContact C-O 3.41Å; Q886-I920 VanDerWaalsContact CA-O 3.29Å; Q886-I920 WeakPolarHBondContact CA-O 3.34Å; I887-I920 HydrophobicContact CB-CB 4.23Å; I887-I920 HydrophobicContact CB-CD1 4.48Å; I887-I920 PolarHBondContact N-O 2.76Å; I887-I920 PolarHBondContact O-N 2.83Å; F889-I920 HydrophobicContact CD1-CD1 4.49Å; F889-I920 HydrophobicContact CE1-CD1 3.8Å; F889-I920 HydrophobicContact CE1-CG1 4.2Å
921	N	93	Very high	85.4	Confident	38 Å²	38	45.7 Å²	45.7	20%	0.203	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.7	175.3	-61.3	-47.1	0	0	0	109.8	I818 F819 D820 I821 Q886	I818-N921 VanDerWaalsContact CG2-ND2 3.31Å; I818-N921 WeakPolarHBondContact CG2-ND2 3.31Å; F819-N921 PolarHBondContact O-N 2.77Å; D820-N921 WeakPolarHBondContact OD1-CB 3.01Å; D820-N921 PolarHBondContact OD1-ND2 3.46Å; I821-N921 PolarHBondContact N-O 2.87Å; Q886-N921 PolarHBondContact NE2-OD1 3.32Å
922	I	90.8	Very high	86.4	Confident	6 Å²	6	42.5 Å²	42.5	3%	0.031	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	115.2	179	-64.4	163.6	0	0	0	109.2	I821 E823 L879 R881 I884 Q885 I887	I821-I922 HydrophobicContact CG2-CG1 4.18Å; I821-I922 CarbonylContact O-C 3.43Å; I821-I922 WeakPolarHBondContact O-CA 3.4Å; E823-I922 HydrophobicContact CB-CG2 3.76Å; L879-I922 HydrophobicContact CB-CD1 4.04Å; L879-I922 HydrophobicContact CB-CG1 4.48Å; L879-I922 HydrophobicContact CD1-CD1 4.14Å; L879-I922 HydrophobicContact CD1-CG1 4.32Å; L879-I922 HydrophobicContact CG-CD1 4.48Å; R881-I922 HydrophobicContact CB-CG2 3.92Å; I884-I922 HydrophobicContact CG2-CD1 3.86Å; I884-I922 WeakPolarHBondContact O-CD1 3.37Å; Q885-I922 PolarHBondContact O-N 3.16Å; I887-I922 HydrophobicContact CD1-CD1 3.86Å; I887-I922 HydrophobicContact CG1-CD1 4.18Å
923	I	86.4	Confident	86.3	Confident	77 Å²	77	40.4 Å²	40.4	40%	0.395	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	126.7	-173.6	-51.6	165.5	0	0	0	110.4	D820 I821 E823	D820-I923 HydrophobicContact CB-CD1 4Å; D820-I923 HydrophobicContact CB-CG1 4.33Å; I821-I923 PolarHBondContact O-N 2.9Å; E823-I923 PolarHBondContact N-O 2.92Å
924	D	81.5	Confident	85.6	Confident	43 Å²	43	36.9 Å²	36.9	23%	0.23	20%	0.199	C	C	.	.			trans	-48.5	138	177.2	-156.7	-43.4	0	0	0	115	E823 R881 N926	E823-D924 VanDerWaalsContact OE1-CA 3.25Å; E823-D924 WeakPolarHBondContact OE1-CA 3.27Å; R881-D924 VanDerWaalsContact CD-CA 3.4Å; R881-D924 IonicContact CZ-OD2 2.72Å; R881-D924 VanDerWaalsContact NE-CG 3.32Å; R881-D924 IonicContact NE-OD2 2.78Å; R881-D924 PolarHBondContact NE-OD2 2.68Å; R881-D924 IonicContact NH1-OD2 3.28Å; R881-D924 IonicContact NH2-OD2 3.26Å; R881-D924 PolarHBondContact NH2-OD2 2.95Å; D924-N926 PolarHBondContact OD1-N 3.38Å
925	Q	79.2	Confident	84.6	Confident	77 Å²	77	40.1 Å²	40.1	36%	0.36	21%	0.213	S	C	.	.			trans	-133.7	98.5	163.7	-62.3	-61.1	-50.5	0	0	110.5	E823 D927	E823-Q925 HydrophobicContact CG-CB 4.1Å; E823-Q925 HydrophobicContact CG-CG 3.89Å; E823-Q925 PolarHBondContact OE1-N 2.95Å; Q925-D927 PolarHBondContact O-N 2.89Å
926	N	78.6	Confident	82.8	Confident	24 Å²	24	39.3 Å²	39.3	13%	0.128	22%	0.224	C	C	.	.			trans	-40.9	115.8	174.4	164	-96	0	0	0	113	D924 D988 D1035 P1037 K1042	D924-N926 PolarHBondContact OD1-N 3.38Å; N926-D988 WeakPolarHBondContact CA-OD2 3.36Å; N926-D988 HydrophobicContact CB-CB 4.33Å; N926-D988 WeakPolarHBondContact CB-OD2 3.46Å; N926-D988 VanDerWaalsContact CG-OD2 3.28Å; N926-D988 PolarHBondContact ND2-OD2 2.87Å; N926-D1035 PolarHBondContact ND2-OD2 2.94Å; N926-P1037 HydrophobicContact CB-CB 4.42Å; N926-K1042 HydrophobicContact CB-CD 4.11Å; N926-K1042 VanDerWaalsContact OD1-CB 3.28Å; N926-K1042 WeakPolarHBondContact OD1-CB 3.28Å; N926-K1042 PolarHBondContact OD1-O 2.84Å
927	D	83.3	Confident	80.7	Confident	109 Å²	109	44.2 Å²	44.2	58%	0.583	25%	0.247	S	C	*	.			trans	-149	-2.6	-178	89.1	-11	0	0	0	114.2	Q925 D988	Q925-D927 PolarHBondContact O-N 2.89Å; D927-D988 PolarHBondContact N-OD2 3.15Å
928	N	81.2	Confident	78	Confident	59 Å²	59	48.5 Å²	48.5	32%	0.316	26%	0.264	S	S	.	.			trans	-108.7	149.1	176.6	-59.3	-84.7	0	0	0	112.5	A987 D988 L1044	N928-A987 HydrophobicContact CB-CB 3.83Å; N928-D988 VanDerWaalsContact CB-OD1 3.25Å; N928-D988 WeakPolarHBondContact CB-OD1 3.4Å; N928-D988 PolarHBondContact N-OD1 2.98Å; N928-D988 PolarHBondContact N-OD2 3.07Å; N928-D988 PolarHBondContact ND2-OD1 2.79Å; N928-L1044 VanDerWaalsContact C-CD1 3.49Å; N928-L1044 WeakPolarHBondContact O-CD1 3.3Å
929	A	80.6	Confident	75.3	Confident	35 Å²	35	56.2 Å²	56.2	29%	0.289	31%	0.305	S	S	.	.			trans	-115	140.1	-171.1	0	0	0	0	0	114.1	L1044	A929-L1044 HydrophobicContact CB-CB 3.82Å; A929-L1044 HydrophobicContact CB-CD1 4.37Å
930	P	83.8	Confident	72.4	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.332	C	S	.	.			trans	-48.4	132.5	-172.3	-32.1	31.5	0	0	0	117.4	A985 D986 I995 A1033 D1035 R1046 Y1048	P930-A985 CarbonylContact C-O 3.6Å; P930-A985 WeakPolarHBondContact CA-O 3.16Å; P930-D986 WeakPolarHBondContact CD-OD2 3.41Å; P930-D986 HydrophobicContact CG-CB 4.47Å; P930-D986 VanDerWaalsContact CG-OD2 3.31Å; P930-D986 WeakPolarHBondContact CG-OD2 3.46Å; P930-I995 HydrophobicContact CB-CD1 4.24Å; P930-I995 HydrophobicContact CB-CG1 4.44Å; P930-I995 HydrophobicContact CB-CG2 4.21Å; P930-I995 HydrophobicContact CG-CG1 4.31Å; P930-I995 HydrophobicContact CG-CG2 4.44Å; P930-A1033 HydrophobicContact CB-CB 4.32Å; P930-D1035 HydrophobicContact CG-CB 4.09Å; P930-R1046 VanDerWaalsContact O-CD 3.3Å; P930-R1046 WeakPolarHBondContact O-CD 3.11Å; P930-Y1048 PolarHBondContact O-OH 2.82Å
931	I	82.6	Confident	69.2	Low	44 Å²	44	74.2 Å²	74.2	23%	0.226	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	153.8	178.9	58.5	171.1	0	0	0	112.6	L933 L956 F984 A985 Y1048	I931-L933 HydrophobicContact CD1-CD1 4.17Å; I931-L933 HydrophobicContact CD1-CD2 4.23Å; I931-L933 HydrophobicContact CD1-CG 4.37Å; I931-L933 HydrophobicContact CG1-CD1 4.48Å; I931-L933 HydrophobicContact CG1-CG 4.47Å; I931-L956 HydrophobicContact CD1-CD1 4.25Å; I931-F984 CarbonylContact O-C 3.54Å; I931-F984 WeakPolarHBondContact O-CA 3.39Å; I931-A985 HydrophobicContact CG1-CB 4.25Å; I931-A985 WeakPolarHBondContact CG1-O 3.41Å; I931-A985 PolarHBondContact N-O 2.72Å; I931-A985 PolarHBondContact O-N 2.94Å; I931-Y1048 VanDerWaalsContact CA-OH 3.26Å; I931-Y1048 WeakPolarHBondContact CA-OH 3.32Å
932	M	82.1	Confident	66.2	Low	2 Å²	2	79.4 Å²	79.4	1%	0.01	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	135.9	176.3	-168.8	174.5	68.8	0	0	111.5	L959 V962 F980 Y982 Y983 F984 Y1048	M932-L959 WeakPolarHBondContact CE-O 3.4Å; M932-V962 HydrophobicContact CE-CG2 3.64Å; M932-F980 HydrophobicContact SD-CZ 4.29Å; M932-Y982 HydrophobicContact CE-CD1 4.42Å; M932-Y982 HydrophobicContact CG-CD1 4.38Å; M932-Y983 WeakPolarHBondContact CA-O 3.39Å; M932-F984 HydrophobicContact CB-CD1 3.77Å; M932-F984 HydrophobicContact CB-CE1 3.52Å; M932-F984 HydrophobicContact CB-CZ 4.31Å; M932-F984 HydrophobicContact CG-CD1 3.98Å; M932-F984 HydrophobicContact CG-CE1 3.46Å; M932-F984 VanDerWaalsContact CG-CE1 3.46Å; M932-F984 HydrophobicContact CG-CE2 4.47Å; M932-F984 HydrophobicContact CG-CZ 3.73Å; M932-F984 HydrophobicContact SD-CE1 3.68Å; M932-F984 HydrophobicContact SD-CZ 3.58Å; M932-F984 VanDerWaalsContact SD-CZ 3.58Å; M932-Y1048 HydrophobicContact CB-CD1 3.79Å; M932-Y1048 HydrophobicContact CB-CD2 4.39Å; M932-Y1048 HydrophobicContact CB-CE1 3.51Å; M932-Y1048 HydrophobicContact CB-CE2 4.16Å; M932-Y1048 HydrophobicContact CB-CG 4.22Å; M932-Y1048 HydrophobicContact CE-CD1 3.72Å; M932-Y1048 HydrophobicContact CE-CG 3.98Å; M932-Y1048 PolarHBondContact N-OH 3.34Å; M932-Y1048 HydrophobicContact SD-CD1 4.1Å; M932-Y1048 HydrophobicContact SD-CD2 4.42Å; M932-Y1048 HydrophobicContact SD-CG 3.9Å
933	L	77.1	Confident	63.2	Low	14 Å²	14	82.9 Å²	82.9	7%	0.073	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	154.9	-169	-61.7	177.5	0	0	0	111.8	I931 L956 Y982 Y983 A985	I931-L933 HydrophobicContact CD1-CD1 4.17Å; I931-L933 HydrophobicContact CD1-CD2 4.23Å; I931-L933 HydrophobicContact CD1-CG 4.37Å; I931-L933 HydrophobicContact CG1-CD1 4.48Å; I931-L933 HydrophobicContact CG1-CG 4.47Å; L933-L956 HydrophobicContact CD2-CB 4.14Å; L933-L956 HydrophobicContact CD2-CD1 4.2Å; L933-L956 HydrophobicContact CD2-CD2 4.03Å; L933-L956 HydrophobicContact CD2-CG 4.35Å; L933-Y982 CarbonylContact O-C 3.58Å; L933-Y982 WeakPolarHBondContact O-CA 3.42Å; L933-Y982 WeakPolarHBondContact O-CB 3.34Å; L933-Y982 WeakPolarHBondContact O-CD1 3.27Å; L933-Y983 HydrophobicContact CB-CD1 4.03Å; L933-Y983 HydrophobicContact CB-CD2 4.47Å; L933-Y983 HydrophobicContact CB-CE1 3.54Å; L933-Y983 HydrophobicContact CB-CE2 4.03Å; L933-Y983 HydrophobicContact CB-CG 4.47Å; L933-Y983 HydrophobicContact CD1-CE2 3.82Å; L933-Y983 WeakPolarHBondContact CD1-OH 3.48Å; L933-Y983 HydrophobicContact CG-CE2 4.49Å; L933-Y983 PolarHBondContact N-O 2.74Å; L933-Y983 WeakPolarHBondContact O-CD1 3.48Å; L933-Y983 PolarHBondContact O-N 2.78Å; L933-A985 HydrophobicContact CD1-CB 3.99Å
934	H	72.6	Confident	60.4	Low	60 Å²	60	82.6 Å²	82.6	28%	0.278	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.8	-171.6	-167.1	-53.8	0	0	0	113.5	G936 E937 P981 Y982	H934-G936 VanDerWaalsContact C-N 3.27Å; H934-G936 PolarHBondContact O-N 2.75Å; H934-E937 HydrophobicContact CB-CG 4.45Å; H934-E937 PolarHBondContact O-N 3.23Å; H934-E937 VanDerWaalsContact O-N 3.16Å; H934-P981 CarbonylContact C-O 3.57Å; H934-P981 WeakPolarHBondContact CA-O 3.45Å; H934-P981 PolarHBondContact ND1-O 2.94Å; H934-Y982 HydrophobicContact CB-CD1 4.1Å; H934-Y982 HydrophobicContact CB-CE1 3.82Å; H934-Y982 AromaticContact CD2-CE1 3.55Å; H934-Y982 AromaticContact CD2-CZ 3.43Å; H934-Y982 VanDerWaalsContact CD2-CZ 3.43Å; H934-Y982 PolarHBondContact CD2-OH 2.86Å; H934-Y982 VanDerWaalsContact CD2-OH 3.22Å; H934-Y982 AromaticContact CG-CE1 3.86Å
935	H	67.1	Low	57.7	Low	102 Å²	102	86.7 Å²	86.7	47%	0.472	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	82.4	165.2	-74.5	103.3	0	0	0	109.9	P981 Y982	H935-P981 HydrophobicContact CB-CB 4.22Å; H935-P981 PolarHBondContact N-O 3.32Å; H935-Y982 PolarHBondContact CE1-O 3.19Å; H935-Y982 VanDerWaalsContact CE1-O 3.28Å; H935-Y982 VanDerWaalsContact ND1-C 3.29Å; H935-Y982 PolarHBondContact ND1-N 2.99Å; H935-Y982 VanDerWaalsContact ND1-N 3.12Å; H935-Y982 PolarHBondContact ND1-O 2.78Å
936	G	53.9	Low	55.2	Low	56 Å²	56	92.6 Å²	92.6	58%	0.577	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	163.9	-31.7	-170.2	0	0	0	0	0	112.1	H934 I938	H934-G936 VanDerWaalsContact C-N 3.27Å; H934-G936 PolarHBondContact O-N 2.75Å; G936-I938 PolarHBondContact O-N 2.99Å
937	E	47.5	Very low	52.7	Low	104 Å²	104	95 Å²	95	49%	0.486	54%	0.542	S	S	.	.			trans	-77.5	46.6	166.7	-64.5	-169	130.3	0	0	111.5	H934 L939	H934-E937 HydrophobicContact CB-CG 4.45Å; H934-E937 PolarHBondContact O-N 3.23Å; H934-E937 VanDerWaalsContact O-N 3.16Å; E937-L939 PolarHBondContact O-N 3.19Å
938	I	36.1	Very low	50	Low	141 Å²	141	94.2 Å²	94.2	72%	0.723	56%	0.559	S	S	*	*			trans	-75.1	76.4	170.2	-52.3	-179.9	0	0	0	107.9	G936 K940	G936-I938 PolarHBondContact O-N 2.99Å; I938-K940 PolarHBondContact O-N 3.23Å
939	L	36.7	Very low	47.3	Very low	164 Å²	164	99 Å²	99	86%	0.859	58%	0.584	S	S	*	*			trans	-72.5	72.7	168.3	-78.5	175.4	0	0	0	110.1	E937 Y941	E937-L939 PolarHBondContact O-N 3.19Å; L939-Y941 PolarHBondContact O-N 3.12Å
940	K	32	Very low	44.8	Very low	169 Å²	169	103.8 Å²	103.8	74%	0.735	60%	0.6	S	S	*	*			trans	9.1	90.4	164.4	-64.2	178.4	-179.8	174.9	0	116.1	I938 N942	I938-K940 PolarHBondContact O-N 3.23Å; K940-N942 PolarHBondContact O-N 2.75Å
941	Y	26.7	Very low	42.2	Very low	235 Å²	235	108.5 Å²	108.5	92%	0.922	63%	0.633	S	S	*	*			trans	-68.5	80.8	152.3	-117.9	-94.9	0	0	0	109.4	L939	L939-Y941 PolarHBondContact O-N 3.12Å
942	N	30.6	Very low	39.5	Very low	146 Å²	146	115.2 Å²	115.2	78%	0.781	66%	0.663	S	S	*	*			trans	-86	106.5	163.8	-88.3	13.1	0	0	0	107.6	K940	K940-N942 PolarHBondContact O-N 2.75Å
943	G	28.3	Very low	36.9	Very low	79 Å²	79	120.2 Å²	120.2	81%	0.814	69%	0.694	S	S	*	*			trans	-70.1	151.8	-173.2	0	0	0	0	0	114.5
944	G	27.4	Very low	34.9	Very low	71 Å²	71	128.5 Å²	128.5	73%	0.732	73%	0.729	S	S	*	*			trans	164.4	80.9	177.1	0	0	0	0	0	112.5
945	T	24.7	Very low	33.1	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	75%	0.754	S	S	*	*	S	Bend	trans	37.7	121.3	156.8	51.6	0	0	0	0	120.1
946	E	25.6	Very low	31.9	Very low	202 Å²	202	132.8 Å²	132.8	94%	0.944	75%	0.752	S	S	*	*			trans	70.2	123.5	158.7	-58.6	177.7	-171.8	0	0	117.5
947	G	28	Very low	31.6	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	75%	0.754	S	S	*	*			trans	136.5	95.2	173.8	0	0	0	0	0	113.4	L949	G947-L949 PolarHBondContact O-N 3.04Å
948	G	25.4	Very low	32.1	Very low	91 Å²	91	136.8 Å²	136.8	94%	0.938	76%	0.756	S	S	*	*			trans	-73.7	102.7	175.5	0	0	0	0	0	111.9
949	L	24.4	Very low	33.2	Very low	161 Å²	161	132.7 Å²	132.7	84%	0.843	74%	0.735	S	S	*	*			trans	-98.6	119.7	170.5	-167.5	72.4	0	0	0	109.8	G947	G947-L949 PolarHBondContact O-N 3.04Å
950	H	29	Very low	34.6	Very low	135 Å²	135	128.6 Å²	128.6	63%	0.625	72%	0.72	S	S	*	*			trans	-125.4	155.3	169.2	-104.6	38.6	0	0	0	110.7
951	S	28.4	Very low	36.5	Very low	99 Å²	99	123.3 Å²	123.3	69%	0.692	70%	0.702	S	S	*	*	S	Bend	trans	67.9	47.1	170.5	-145.2	0	0	0	0	117.9
952	Q	26.5	Very low	38.9	Very low	185 Å²	185	112.2 Å²	112.2	86%	0.864	66%	0.659	S	S	*	*			trans	-122.6	28.6	138.1	-76.7	-154.6	-2.8	0	0	113	K954	Q952-K954 PolarHBondContact O-N 3.09Å
953	T	28.1	Very low	41.1	Very low	107 Å²	107	108.5 Å²	108.5	66%	0.656	64%	0.639	S	S	*	*			trans	-77	41.6	171.5	-24.1	0	0	0	0	112.4	L956	T953-L956 HydrophobicContact CG2-CD1 4.09Å
954	K	35	Very low	43.6	Very low	187 Å²	187	105.5 Å²	105.5	81%	0.813	60%	0.604	S	S	*	*			trans	-135.7	114.2	171.1	-72.3	177.5	-179.5	169.7	0	106.4	Q952	Q952-K954 PolarHBondContact O-N 3.09Å
955	Q	33.8	Very low	45.8	Very low	170 Å²	170	107.7 Å²	107.7	79%	0.794	59%	0.593	S	S	*	*			cis	-122.6	111.4	16.6	-61.3	162.5	-36.3	0	0	110.8	Q957	Q955-Q957 PolarHBondContact O-N 3.27Å
956	L	42.9	Very low	48.3	Very low	83 Å²	83	102.4 Å²	102.4	44%	0.435	56%	0.559	S	S	.	*			trans	-65.5	112.5	151.3	-72.4	166.9	0	0	0	106	I931 L933 T953 Q958	I931-L956 HydrophobicContact CD1-CD1 4.25Å; L933-L956 HydrophobicContact CD2-CB 4.14Å; L933-L956 HydrophobicContact CD2-CD1 4.2Å; L933-L956 HydrophobicContact CD2-CD2 4.03Å; L933-L956 HydrophobicContact CD2-CG 4.35Å; T953-L956 HydrophobicContact CG2-CD1 4.09Å; L956-Q958 PolarHBondContact O-N 2.98Å
957	Q	46.4	Very low	50.3	Low	130 Å²	130	95.9 Å²	95.9	61%	0.607	53%	0.531	S	S	*	.			trans	-67.8	111	-175.6	-74	-161.8	0.6	0	0	109	Q955 L959	Q955-Q957 PolarHBondContact O-N 3.27Å; Q957-L959 PolarHBondContact O-N 3.49Å
958	Q	58.8	Low	52.1	Low	113 Å²	113	94.3 Å²	94.3	53%	0.528	50%	0.504	S	S	.	.			trans	-75.7	77.1	-171.1	-167	165.5	85.9	0	0	110.2	L956 S960	L956-Q958 PolarHBondContact O-N 2.98Å; Q958-S960 PolarHBondContact O-N 3.38Å
959	L	58.7	Low	53.8	Low	55 Å²	55	94.6 Å²	94.6	29%	0.288	48%	0.484	S	S	.	.			trans	-63	102.6	-173.8	-76.2	163.8	0	0	0	110.5	M932 Q957 Y982 Y1048	M932-L959 WeakPolarHBondContact CE-O 3.4Å; Q957-L959 PolarHBondContact O-N 3.49Å; L959-Y982 HydrophobicContact CD1-CE1 3.84Å; L959-Y1048 WeakPolarHBondContact O-CD1 3.46Å
960	S	66.4	Low	55.4	Low	79 Å²	79	90.5 Å²	90.5	55%	0.552	47%	0.466	S	S	*	.	S	Bend	trans	-82.7	-18.8	174	54.2	0	0	0	0	112.9	Q958 A1049	Q958-S960 PolarHBondContact O-N 3.38Å; S960-A1049 PolarHBondContact O-N 3.04Å
961	V	71	Confident	56.4	Low	58 Å²	58	94 Å²	94	35%	0.352	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135.9	-179.5	-169.8	0	0	0	0	110.1	A1049 R1051	V961-A1049 CarbonylContact C-O 3.55Å; V961-A1049 VanDerWaalsContact CA-O 3.3Å; V961-A1049 WeakPolarHBondContact CA-O 3.49Å; V961-A1049 HydrophobicContact CG2-CB 4.39Å; V961-R1051 HydrophobicContact CG1-CG 4.04Å
962	V	76.7	Confident	57.6	Low	2 Å²	2	92.9 Å²	92.9	1%	0.012	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	152	178.1	166.8	0	0	0	0	110.1	M932 L964 Y982 A1049 V1050 R1051	M932-V962 HydrophobicContact CE-CG2 3.64Å; V962-L964 HydrophobicContact CG1-CD2 4.17Å; V962-L964 HydrophobicContact CG1-CG 4.19Å; V962-Y982 HydrophobicContact CB-CE2 4.06Å; V962-Y982 HydrophobicContact CG1-CD2 3.95Å; V962-Y982 HydrophobicContact CG1-CE2 3.23Å; V962-Y982 HydrophobicContact CG2-CD1 4.16Å; V962-Y982 HydrophobicContact CG2-CD2 4Å; V962-Y982 HydrophobicContact CG2-CE1 3.75Å; V962-Y982 HydrophobicContact CG2-CE2 3.61Å; V962-Y982 HydrophobicContact CG2-CG 4.29Å; V962-Y982 VanDerWaalsContact CG2-CZ 3.47Å; V962-A1049 PolarHBondContact N-O 3.15Å; V962-V1050 HydrophobicContact CB-CG1 4.37Å; V962-V1050 HydrophobicContact CB-CG2 4.31Å; V962-V1050 HydrophobicContact CG1-CG1 4.1Å; V962-R1051 WeakPolarHBondContact O-CB 3.3Å; V962-R1051 PolarHBondContact O-N 2.86Å
963	D	78.3	Confident	58.7	Low	68 Å²	68	89.7 Å²	89.7	36%	0.364	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	139.5	169	-72.1	-81.6	0	0	0	111.8	R1051 H1053	D963-R1051 CarbonylContact C-O 3.46Å; D963-R1051 WeakPolarHBondContact CA-O 3.3Å; D963-R1051 WeakPolarHBondContact OD1-CB 3.06Å; D963-R1051 IonicContact OD1-CZ 2.68Å; D963-R1051 IonicContact OD1-NE 3.37Å; D963-R1051 PolarHBondContact OD1-NE 2.8Å; D963-R1051 IonicContact OD1-NH2 3.46Å; D963-R1051 PolarHBondContact OD1-NH2 3.39Å; D963-R1051 IonicContact OD2-CZ 3.11Å; D963-R1051 IonicContact OD2-NE 1.8Å; D963-R1051 PolarHBondContact OD2-NE 2.95Å; D963-R1051 IonicContact OD2-NH2 2.73Å; D963-R1051 PolarHBondContact OD2-NH2 2.69Å; D963-H1053 VanDerWaalsContact CB-NE2 3.26Å; D963-H1053 WeakPolarHBondContact CB-NE2 3.45Å; D963-H1053 IonicContact OD1-CD2 3.3Å; D963-H1053 CovalentContact OD1-NE2 1.8Å; D963-H1053 IonicContact OD1-NE2 3.48Å; D963-H1053 PolarHBondContact OD1-NE2 3.16Å; D963-H1053 IonicContact OD2-NE2 2.68Å
964	L	81	Confident	59.8	Low	15 Å²	15	93.6 Å²	93.6	8%	0.079	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	154.8	-179.8	-58.2	176.3	0	0	0	110.6	V962 I978 F980 P981 I1014 V1050 R1051 I1052 H1053	V962-L964 HydrophobicContact CG1-CD2 4.17Å; V962-L964 HydrophobicContact CG1-CG 4.19Å; L964-I978 HydrophobicContact CB-CD1 4.44Å; L964-I978 HydrophobicContact CB-CG2 4.44Å; L964-F980 HydrophobicContact CD1-CD2 4.38Å; L964-P981 HydrophobicContact CD2-CG 4.27Å; L964-I1014 HydrophobicContact CD1-CD1 3.77Å; L964-V1050 HydrophobicContact CD1-CG1 3.6Å; L964-V1050 HydrophobicContact CG-CG1 4.15Å; L964-R1051 PolarHBondContact N-O 3.25Å; L964-I1052 HydrophobicContact CB-CG1 4.42Å; L964-I1052 HydrophobicContact CD1-CG1 4.35Å; L964-H1053 PolarHBondContact O-CD2 3.35Å; L964-H1053 PolarHBondContact O-N 3.28Å
965	K	73.9	Confident	60.7	Low	117 Å²	117	89.8 Å²	89.8	51%	0.509	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145	174.9	-93.9	-168.6	167.5	-163.3	0	112	H1053 V1055 E1057	K965-H1053 CarbonylContact C-O 3.54Å; K965-H1053 WeakPolarHBondContact CA-O 3.37Å; K965-H1053 HydrophobicContact CG-CB 4.25Å; K965-V1055 HydrophobicContact CD-CG2 4.15Å; K965-V1055 HydrophobicContact CG-CG2 4.48Å; K965-E1057 IonicContact NZ-OE1 3.78Å; K965-E1057 PolarHBondContact NZ-OE1 3.09Å; K965-E1057 VanDerWaalsContact NZ-OE1 3.12Å; K965-E1057 IonicContact NZ-OE2 3.42Å; K965-E1057 PolarHBondContact NZ-OE2 3.15Å
966	Y	76.1	Confident	62.2	Low	18 Å²	18	84 Å²	84	7%	0.071	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.6	173.6	-172.6	-91.5	0	0	0	109.4	I978 F1005 K1016 P1022 H1053 I1054 V1055	Y966-I978 HydrophobicContact CD2-CD1 4Å; Y966-I978 HydrophobicContact CD2-CG1 3.69Å; Y966-I978 HydrophobicContact CG-CD1 4.48Å; Y966-F1005 HydrophobicContact CD2-CE1 4.29Å; Y966-K1016 WeakPolarHBondContact OH-CD 3.3Å; Y966-P1022 HydrophobicContact CD1-CG 4.37Å; Y966-P1022 HydrophobicContact CE1-CG 4.16Å; Y966-H1053 PolarHBondContact N-O 3.39Å; Y966-I1054 HydrophobicContact CD1-CG1 4.21Å; Y966-I1054 HydrophobicContact CD1-CG2 4.31Å; Y966-I1054 HydrophobicContact CG-CG1 4.47Å; Y966-I1054 CarbonylContact O-C 3.43Å; Y966-I1054 WeakPolarHBondContact O-CA 3.48Å; Y966-V1055 WeakPolarHBondContact O-CG2 3.4Å; Y966-V1055 PolarHBondContact O-N 3.22Å
967	N	66.6	Low	63.7	Low	65 Å²	65	82.3 Å²	82.3	35%	0.348	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.9	-176.4	-175.5	-8.4	0	0	0	111	N969 V970 V1055	N967-N969 PolarHBondContact OD1-N 2.74Å; N967-V970 HydrophobicContact CB-CG2 4.27Å; N967-V1055 PolarHBondContact OD1-O 2.87Å
968	I	67	Low	65.1	Low	43 Å²	43	77.2 Å²	77.2	22%	0.221	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-31.8	-177.4	-53.5	-179.8	0	0	0	111.8	V970 D1021 V1024 I1054 V1055	I968-V970 VanDerWaalsContact C-N 3.27Å; I968-V970 PolarHBondContact O-N 2.88Å; I968-D1021 HydrophobicContact CG2-CB 3.97Å; I968-V1024 HydrophobicContact CD1-CG2 3.63Å; I968-I1054 HydrophobicContact CD1-CG2 3.58Å; I968-I1054 HydrophobicContact CG1-CG2 3.56Å; I968-V1055 PolarHBondContact N-O 2.96Å
969	N	60.7	Low	66.1	Low	96 Å²	96	79 Å²	79	51%	0.513	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	9.1	-162.9	-114.5	11.1	0	0	0	115	N967 K971 N1056	N967-N969 PolarHBondContact OD1-N 2.74Å; N969-K971 PolarHBondContact O-N 3.14Å; N969-K971 VanDerWaalsContact O-N 3.14Å; N969-N1056 VanDerWaalsContact CG-OD1 3.31Å; N969-N1056 PolarHBondContact ND2-OD1 2.88Å
970	V	58.8	Low	67.3	Low	76 Å²	76	76.6 Å²	76.6	46%	0.461	40%	0.403	S	S	.	.			trans	-77.9	96.1	176.8	-175.3	0	0	0	0	109.3	N967 I968 D972	N967-V970 HydrophobicContact CB-CG2 4.27Å; I968-V970 VanDerWaalsContact C-N 3.27Å; I968-V970 PolarHBondContact O-N 2.88Å; V970-D972 HydrophobicContact CG1-CB 3.99Å; V970-D972 PolarHBondContact O-N 3.49Å
971	K	48.6	Very low	67.9	Low	209 Å²	209	74.5 Å²	74.5	91%	0.909	39%	0.387	S	S	*	.			trans	-72.5	33.8	179.8	-87.1	-171.4	172.3	-178.3	0	114.9	N969	N969-K971 PolarHBondContact O-N 3.14Å; N969-K971 VanDerWaalsContact O-N 3.14Å
972	D	53.8	Low	68.4	Low	74 Å²	74	72.9 Å²	72.9	40%	0.396	38%	0.375	S	S	.	.			trans	-92.4	118.3	173	-174.4	-9.4	0	0	0	109.5	V970 F974 N975	V970-D972 HydrophobicContact CG1-CB 3.99Å; V970-D972 PolarHBondContact O-N 3.49Å; D972-F974 PolarHBondContact O-N 3.31Å; D972-F974 PolarHBondContact OD1-N 3.16Å; D972-N975 HydrophobicContact CB-CB 4.08Å; D972-N975 PolarHBondContact O-N 3.21Å
973	P	50.8	Low	68.6	Low	119 Å²	119	77.6 Å²	77.6	77%	0.773	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-6.6	-178.9	-25.1	35.6	0	0	0	116.2
974	F	50.6	Low	68.8	Low	189 Å²	189	75.6 Å²	75.6	83%	0.829	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-6.5	-174.5	-72.7	-84.2	0	0	0	115.8	D972	D972-F974 PolarHBondContact O-N 3.31Å; D972-F974 PolarHBondContact OD1-N 3.16Å
975	N	54.4	Low	68.6	Low	106 Å²	106	76.2 Å²	76.2	57%	0.567	39%	0.388	S	S	*	.			trans	-120.7	85.3	-159.6	-144.5	-16.5	0	0	0	113.7	D972	D972-N975 HydrophobicContact CB-CB 4.08Å; D972-N975 PolarHBondContact O-N 3.21Å
976	S	64.1	Low	68.7	Low	49 Å²	49	71.8 Å²	71.8	34%	0.343	37%	0.37	S	S	.	.			trans	-130.3	34.6	-171.1	58.3	0	0	0	0	114.7	K1016	S976-K1016 VanDerWaalsContact O-CB 3.28Å; S976-K1016 WeakPolarHBondContact O-CB 3.38Å; S976-K1016 PolarHBondContact O-N 2.8Å
977	C	74.7	Confident	68.5	Low	48 Å²	48	73.2 Å²	73.2	32%	0.324	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	170.5	-178.4	-51	0	0	0	0	112.9	I1013 I1014 C1015	C977-I1013 HydrophobicContact CB-CG2 3.45Å; C977-I1013 VanDerWaalsContact CB-CG2 3.45Å; C977-I1014 CarbonylContact C-O 3.48Å; C977-I1014 WeakPolarHBondContact CA-O 3.43Å; C977-C1015 HydrophobicContact CB-CB 4Å; C977-C1015 WeakPolarHBondContact CB-SG 3.5Å; C977-C1015 VanDerWaalsContact SG-CA 3.53Å; C977-C1015 WeakPolarHBondContact SG-CB 3.46Å; C977-C1015 CovalentContact SG-SG 2.04Å; C977-C1015 PolarHBondContact SG-SG 3.11Å
978	I	76.9	Confident	68.8	Low	22 Å²	22	70.4 Å²	70.4	11%	0.113	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.4	174.4	-36.1	170.9	0	0	0	108.1	L964 Y966 I1013 I1014 I1052	L964-I978 HydrophobicContact CB-CD1 4.44Å; L964-I978 HydrophobicContact CB-CG2 4.44Å; Y966-I978 HydrophobicContact CD2-CD1 4Å; Y966-I978 HydrophobicContact CD2-CG1 3.69Å; Y966-I978 HydrophobicContact CG-CD1 4.48Å; I978-I1013 CarbonylContact O-C 3.49Å; I978-I1013 WeakPolarHBondContact O-CA 3.48Å; I978-I1013 WeakPolarHBondContact O-CG2 3.1Å; I978-I1014 PolarHBondContact N-O 3.11Å; I978-I1014 PolarHBondContact O-N 3.46Å; I978-I1052 HydrophobicContact CD1-CG2 3.63Å
979	E	78.6	Confident	68.6	Low	151 Å²	151	71 Å²	71	71%	0.706	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	146	165.2	-64.9	178.6	145.4	0	0	110.7	P981	E979-P981 WeakPolarHBondContact O-CD 3.11Å
980	F	84.1	Confident	68.4	Low	5 Å²	5	72.5 Å²	72.5	2%	0.022	38%	0.375	C	S	.	.			trans	-104.8	96.6	171.1	-179.2	-114.7	0	0	0	108.6	M932 L964 Y982 F984 F1007 H1011 T1012 I1014 V1031 V1050	M932-F980 HydrophobicContact SD-CZ 4.29Å; L964-F980 HydrophobicContact CD1-CD2 4.38Å; F980-Y982 HydrophobicContact CD2-CD2 4.23Å; F980-Y982 AromaticContact CE2-CD2 3.9Å; F980-Y982 HydrophobicContact CE2-CD2 3.9Å; F980-Y982 HydrophobicContact CE2-CG 4.46Å; F980-Y982 HydrophobicContact CZ-CD2 4.18Å; F980-Y982 HydrophobicContact CZ-CG 4.29Å; F980-Y982 PolarHBondContact O-N 3.3Å; F980-F984 HydrophobicContact CE1-CE2 4.44Å; F980-F1007 HydrophobicContact CB-CE1 4.01Å; F980-F1007 AromaticContact CD1-CE1 3.8Å; F980-F1007 HydrophobicContact CD1-CE1 3.8Å; F980-F1007 AromaticContact CD1-CZ 3.92Å; F980-F1007 HydrophobicContact CD1-CZ 3.92Å; F980-F1007 HydrophobicContact CD2-CE1 4.3Å; F980-F1007 HydrophobicContact CE1-CE1 4.34Å; F980-F1007 AromaticContact CE1-CZ 3.99Å; F980-F1007 HydrophobicContact CE1-CZ 3.99Å; F980-F1007 AromaticContact CG-CE1 3.77Å; F980-F1007 HydrophobicContact CG-CE1 3.77Å; F980-F1007 HydrophobicContact CG-CZ 4.18Å; F980-F1007 HydrophobicContact CZ-CZ 4.33Å; F980-H1011 WeakPolarHBondContact CD1-O 3.45Å; F980-T1012 PolarHBondContact N-O 3.34Å; F980-I1014 HydrophobicContact CB-CD1 4.13Å; F980-I1014 HydrophobicContact CB-CG1 4.23Å; F980-I1014 HydrophobicContact CD2-CD1 3.78Å; F980-I1014 HydrophobicContact CG-CD1 4.22Å; F980-V1031 HydrophobicContact CZ-CG2 4.26Å; F980-V1050 HydrophobicContact CE2-CG1 4.26Å; F980-V1050 HydrophobicContact CE2-CG2 3.74Å; F980-V1050 HydrophobicContact CZ-CG2 4.32Å
981	P	79.8	Confident	68.2	Low	34 Å²	34	77.4 Å²	77.4	22%	0.221	39%	0.393	C	S	.	.			trans	-84	46.6	-168	35.4	-35.9	0	0	0	111.9	H934 H935 L964 E979	H934-P981 CarbonylContact C-O 3.57Å; H934-P981 WeakPolarHBondContact CA-O 3.45Å; H934-P981 PolarHBondContact ND1-O 2.94Å; H935-P981 HydrophobicContact CB-CB 4.22Å; H935-P981 PolarHBondContact N-O 3.32Å; L964-P981 HydrophobicContact CD2-CG 4.27Å; E979-P981 WeakPolarHBondContact O-CD 3.11Å
982	Y	81.2	Confident	68	Low	25 Å²	25	73.7 Å²	73.7	10%	0.098	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	149.5	178.9	-61.2	-91.8	0	0	0	112.5	M932 L933 H934 H935 L959 V962 F980	M932-Y982 HydrophobicContact CE-CD1 4.42Å; M932-Y982 HydrophobicContact CG-CD1 4.38Å; L933-Y982 CarbonylContact O-C 3.58Å; L933-Y982 WeakPolarHBondContact O-CA 3.42Å; L933-Y982 WeakPolarHBondContact O-CB 3.34Å; L933-Y982 WeakPolarHBondContact O-CD1 3.27Å; H934-Y982 HydrophobicContact CB-CD1 4.1Å; H934-Y982 HydrophobicContact CB-CE1 3.82Å; H934-Y982 AromaticContact CD2-CE1 3.55Å; H934-Y982 AromaticContact CD2-CZ 3.43Å; H934-Y982 VanDerWaalsContact CD2-CZ 3.43Å; H934-Y982 PolarHBondContact CD2-OH 2.86Å; H934-Y982 VanDerWaalsContact CD2-OH 3.22Å; H934-Y982 AromaticContact CG-CE1 3.86Å; H935-Y982 PolarHBondContact CE1-O 3.19Å; H935-Y982 VanDerWaalsContact CE1-O 3.28Å; H935-Y982 VanDerWaalsContact ND1-C 3.29Å; H935-Y982 PolarHBondContact ND1-N 2.99Å; H935-Y982 VanDerWaalsContact ND1-N 3.12Å; H935-Y982 PolarHBondContact ND1-O 2.78Å; L959-Y982 HydrophobicContact CD1-CE1 3.84Å; V962-Y982 HydrophobicContact CB-CE2 4.06Å; V962-Y982 HydrophobicContact CG1-CD2 3.95Å; V962-Y982 HydrophobicContact CG1-CE2 3.23Å; V962-Y982 HydrophobicContact CG2-CD1 4.16Å; V962-Y982 HydrophobicContact CG2-CD2 4Å; V962-Y982 HydrophobicContact CG2-CE1 3.75Å; V962-Y982 HydrophobicContact CG2-CE2 3.61Å; V962-Y982 HydrophobicContact CG2-CG 4.29Å; V962-Y982 VanDerWaalsContact CG2-CZ 3.47Å; F980-Y982 HydrophobicContact CD2-CD2 4.23Å; F980-Y982 AromaticContact CE2-CD2 3.9Å; F980-Y982 HydrophobicContact CE2-CD2 3.9Å; F980-Y982 HydrophobicContact CE2-CG 4.46Å; F980-Y982 HydrophobicContact CZ-CD2 4.18Å; F980-Y982 HydrophobicContact CZ-CG 4.29Å; F980-Y982 PolarHBondContact O-N 3.3Å
983	Y	81	Confident	68.1	Low	100 Å²	100	71.6 Å²	71.6	39%	0.392	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	176	173.3	71.5	-81.5	0	0	0	110.1	M932 L933 A985	M932-Y983 WeakPolarHBondContact CA-O 3.39Å; L933-Y983 HydrophobicContact CB-CD1 4.03Å; L933-Y983 HydrophobicContact CB-CD2 4.47Å; L933-Y983 HydrophobicContact CB-CE1 3.54Å; L933-Y983 HydrophobicContact CB-CE2 4.03Å; L933-Y983 HydrophobicContact CB-CG 4.47Å; L933-Y983 HydrophobicContact CD1-CE2 3.82Å; L933-Y983 WeakPolarHBondContact CD1-OH 3.48Å; L933-Y983 HydrophobicContact CG-CE2 4.49Å; L933-Y983 PolarHBondContact N-O 2.74Å; L933-Y983 WeakPolarHBondContact O-CD1 3.48Å; L933-Y983 PolarHBondContact O-N 2.78Å; Y983-A985 HydrophobicContact CE2-CB 4.38Å
984	F	82.1	Confident	68.9	Low	27 Å²	27	71.3 Å²	71.3	12%	0.118	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.7	178.4	-58.9	-92.8	0	0	0	110.5	I931 M932 F980 I995 V997 V1031 A1033 Y1048	I931-F984 CarbonylContact O-C 3.54Å; I931-F984 WeakPolarHBondContact O-CA 3.39Å; M932-F984 HydrophobicContact CB-CD1 3.77Å; M932-F984 HydrophobicContact CB-CE1 3.52Å; M932-F984 HydrophobicContact CB-CZ 4.31Å; M932-F984 HydrophobicContact CG-CD1 3.98Å; M932-F984 HydrophobicContact CG-CE1 3.46Å; M932-F984 VanDerWaalsContact CG-CE1 3.46Å; M932-F984 HydrophobicContact CG-CE2 4.47Å; M932-F984 HydrophobicContact CG-CZ 3.73Å; M932-F984 HydrophobicContact SD-CE1 3.68Å; M932-F984 HydrophobicContact SD-CZ 3.58Å; M932-F984 VanDerWaalsContact SD-CZ 3.58Å; F980-F984 HydrophobicContact CE1-CE2 4.44Å; F984-I995 HydrophobicContact CB-CB 4.46Å; F984-I995 HydrophobicContact CB-CD1 3.86Å; F984-I995 HydrophobicContact CB-CG2 3.87Å; F984-I995 HydrophobicContact CG-CG2 4.4Å; F984-V997 HydrophobicContact CD2-CB 4.46Å; F984-V997 HydrophobicContact CD2-CG1 4.19Å; F984-V997 HydrophobicContact CD2-CG2 3.37Å; F984-V997 HydrophobicContact CE2-CB 4.35Å; F984-V997 HydrophobicContact CE2-CG1 3.62Å; F984-V997 HydrophobicContact CE2-CG2 3.71Å; F984-V997 HydrophobicContact CG-CG2 4.12Å; F984-V997 HydrophobicContact CZ-CG1 4.3Å; F984-V1031 HydrophobicContact CE2-CG1 4.15Å; F984-V1031 HydrophobicContact CZ-CG1 3.61Å; F984-A1033 HydrophobicContact CD1-CB 3.69Å; F984-A1033 HydrophobicContact CE1-CB 3.94Å; F984-A1033 HydrophobicContact CG-CB 4.27Å; F984-Y1048 HydrophobicContact CD1-CE2 4.07Å; F984-Y1048 AromaticContact CE1-CD2 3.62Å; F984-Y1048 HydrophobicContact CE1-CD2 3.62Å; F984-Y1048 AromaticContact CE1-CE2 3.61Å; F984-Y1048 HydrophobicContact CE1-CE2 3.61Å; F984-Y1048 HydrophobicContact CE1-CG 4.36Å; F984-Y1048 HydrophobicContact CZ-CD2 4.43Å
985	A	76	Confident	70.3	Confident	27 Å²	27	63.8 Å²	63.8	22%	0.223	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	156.7	176.9	0	0	0	0	0	109.9	P930 I931 L933 Y983	P930-A985 CarbonylContact C-O 3.6Å; P930-A985 WeakPolarHBondContact CA-O 3.16Å; I931-A985 HydrophobicContact CG1-CB 4.25Å; I931-A985 WeakPolarHBondContact CG1-O 3.41Å; I931-A985 PolarHBondContact N-O 2.72Å; I931-A985 PolarHBondContact O-N 2.94Å; L933-A985 HydrophobicContact CD1-CB 3.99Å; Y983-A985 HydrophobicContact CE2-CB 4.38Å
986	D	76.1	Confident	71.6	Confident	25 Å²	25	61.2 Å²	61.2	13%	0.134	32%	0.319	C	S	.	.			trans	-122.5	159.6	173.4	-144.8	-17.8	0	0	0	110.4	P930 A993 I995 D1035	P930-D986 WeakPolarHBondContact CD-OD2 3.41Å; P930-D986 HydrophobicContact CG-CB 4.47Å; P930-D986 VanDerWaalsContact CG-OD2 3.31Å; P930-D986 WeakPolarHBondContact CG-OD2 3.46Å; D986-A993 HydrophobicContact CB-CB 3.95Å; D986-I995 HydrophobicContact CB-CD1 4.34Å; D986-D1035 WeakPolarHBondContact OD2-CB 3.49Å
987	A	71.9	Confident	72.5	Confident	48 Å²	48	59.9 Å²	59.9	40%	0.397	31%	0.308	S	S	.	.	S	Bend	trans	-89.4	-40.2	-179.6	0	0	0	0	0	112.2	N928	N928-A987 HydrophobicContact CB-CB 3.83Å
988	D	72.8	Confident	72.9	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.027	32%	0.316	C	S	.	.	S	Bend	trans	-70.8	-41	-172.2	-53.5	-15.3	0	0	0	111.5	N926 D927 N928	N926-D988 WeakPolarHBondContact CA-OD2 3.36Å; N926-D988 HydrophobicContact CB-CB 4.33Å; N926-D988 WeakPolarHBondContact CB-OD2 3.46Å; N926-D988 VanDerWaalsContact CG-OD2 3.28Å; N926-D988 PolarHBondContact ND2-OD2 2.87Å; D927-D988 PolarHBondContact N-OD2 3.15Å; N928-D988 VanDerWaalsContact CB-OD1 3.25Å; N928-D988 WeakPolarHBondContact CB-OD1 3.4Å; N928-D988 PolarHBondContact N-OD1 2.98Å; N928-D988 PolarHBondContact N-OD2 3.07Å; N928-D988 PolarHBondContact ND2-OD1 2.79Å
989	E	64.3	Low	73.1	Confident	57 Å²	57	62.1 Å²	62.1	27%	0.266	32%	0.32	S	S	.	.			trans	-106.5	86.2	-177.3	-73.6	-169.2	-173.8	0	0	113.5	E991 A993	E989-E991 VanDerWaalsContact C-N 3.25Å; E989-E991 PolarHBondContact O-N 3.45Å; E989-E991 VanDerWaalsContact O-N 3.12Å; E989-A993 HydrophobicContact CB-CB 3.88Å; E989-A993 VanDerWaalsContact OE2-CA 3.31Å; E989-A993 WeakPolarHBondContact OE2-CA 3.44Å; E989-A993 PolarHBondContact OE2-N 3.31Å
990	K	56.7	Low	73.2	Confident	126 Å²	126	58.2 Å²	58.2	55%	0.548	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.1	-178.7	-69.6	-177.2	179.3	178	0	116.3	Q885	Q885-K990 VanDerWaalsContact CD-NZ 3.26Å
991	E	53.2	Low	72.7	Confident	180 Å²	180	65.3 Å²	65.3	84%	0.841	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.2	-5.4	-170.6	-67.7	-165.8	142.2	0	0	116.7	E989	E989-E991 VanDerWaalsContact C-N 3.25Å; E989-E991 PolarHBondContact O-N 3.45Å; E989-E991 VanDerWaalsContact O-N 3.12Å
992	N	45.3	Very low	72.4	Confident	130 Å²	130	65.1 Å²	65.1	70%	0.695	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.1	13	-178.1	-93.9	-68.6	0	0	0	116.5	Q994	N992-Q994 PolarHBondContact O-N 2.66Å
993	A	56.3	Low	72	Confident	31 Å²	31	68.8 Å²	68.8	26%	0.256	37%	0.369	S	S	.	.			trans	-50.7	98.2	-179.7	0	0	0	0	0	112.7	D986 E989 I995	D986-A993 HydrophobicContact CB-CB 3.95Å; E989-A993 HydrophobicContact CB-CB 3.88Å; E989-A993 VanDerWaalsContact OE2-CA 3.31Å; E989-A993 WeakPolarHBondContact OE2-CA 3.44Å; E989-A993 PolarHBondContact OE2-N 3.31Å; A993-I995 HydrophobicContact CB-CD1 4.26Å; A993-I995 HydrophobicContact CB-CG1 4.07Å; A993-I995 PolarHBondContact O-N 3.44Å
994	Q	67.8	Low	71.7	Confident	113 Å²	113	67.6 Å²	67.6	53%	0.528	37%	0.365	S	S	.	.			trans	-77.1	76.9	175.5	-74.9	-166.6	10.2	0	0	109.9	N992 D996 R1036	N992-Q994 PolarHBondContact O-N 2.66Å; Q994-D996 PolarHBondContact O-N 2.95Å; Q994-R1036 HydrophobicContact CB-CB 4.13Å; Q994-R1036 HydrophobicContact CB-CG 4.26Å; Q994-R1036 WeakPolarHBondContact O-CG 3.28Å
995	I	78.3	Confident	71.6	Confident	31 Å²	31	66.5 Å²	66.5	16%	0.159	36%	0.36	C	S	.	.			trans	-76.1	107.8	-179.5	-56.6	168.2	0	0	0	109.6	P930 F984 D986 A993 V997 A1033 R1034	P930-I995 HydrophobicContact CB-CD1 4.24Å; P930-I995 HydrophobicContact CB-CG1 4.44Å; P930-I995 HydrophobicContact CB-CG2 4.21Å; P930-I995 HydrophobicContact CG-CG1 4.31Å; P930-I995 HydrophobicContact CG-CG2 4.44Å; F984-I995 HydrophobicContact CB-CB 4.46Å; F984-I995 HydrophobicContact CB-CD1 3.86Å; F984-I995 HydrophobicContact CB-CG2 3.87Å; F984-I995 HydrophobicContact CG-CG2 4.4Å; D986-I995 HydrophobicContact CB-CD1 4.34Å; A993-I995 HydrophobicContact CB-CD1 4.26Å; A993-I995 HydrophobicContact CB-CG1 4.07Å; A993-I995 PolarHBondContact O-N 3.44Å; I995-V997 HydrophobicContact CG2-CG2 4.23Å; I995-V997 PolarHBondContact O-N 3.38Å; I995-V997 VanDerWaalsContact O-N 3.13Å; I995-A1033 HydrophobicContact CG2-CB 3.82Å; I995-R1034 CarbonylContact C-O 3.57Å; I995-R1034 WeakPolarHBondContact CA-O 3.2Å
996	D	82.6	Confident	71.9	Confident	52 Å²	52	68.5 Å²	68.5	28%	0.278	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	102.3	172.6	-92.1	-35.7	0	0	0	110.2	Q994 A1033 R1034 R1036	Q994-D996 PolarHBondContact O-N 2.95Å; D996-A1033 VanDerWaalsContact O-CA 3.32Å; D996-A1033 WeakPolarHBondContact O-CA 3.33Å; D996-R1034 HydrophobicContact CB-CB 4.35Å; D996-R1034 PolarHBondContact N-O 3.49Å; D996-R1034 PolarHBondContact O-N 3.12Å; D996-R1036 IonicContact OD1-CZ 2.64Å; D996-R1036 IonicContact OD1-NE 3.72Å; D996-R1036 IonicContact OD1-NH2 3.32Å; D996-R1036 PolarHBondContact OD1-NH2 2.89Å; D996-R1036 IonicContact OD2-CZ 3.7Å; D996-R1036 VanDerWaalsContact OD2-CZ 3.27Å; D996-R1036 IonicContact OD2-NE 2.83Å; D996-R1036 PolarHBondContact OD2-NE 2.96Å; D996-R1036 IonicContact OD2-NH2 3.42Å; D996-R1036 PolarHBondContact OD2-NH2 2.85Å
997	V	82.5	Confident	72.2	Confident	21 Å²	21	68.9 Å²	68.9	13%	0.127	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.8	175.8	-176.5	0	0	0	0	110.3	F984 I995 F1007 H1011 V1031 V1032	F984-V997 HydrophobicContact CD2-CB 4.46Å; F984-V997 HydrophobicContact CD2-CG1 4.19Å; F984-V997 HydrophobicContact CD2-CG2 3.37Å; F984-V997 HydrophobicContact CE2-CB 4.35Å; F984-V997 HydrophobicContact CE2-CG1 3.62Å; F984-V997 HydrophobicContact CE2-CG2 3.71Å; F984-V997 HydrophobicContact CG-CG2 4.12Å; F984-V997 HydrophobicContact CZ-CG1 4.3Å; I995-V997 HydrophobicContact CG2-CG2 4.23Å; I995-V997 PolarHBondContact O-N 3.38Å; I995-V997 VanDerWaalsContact O-N 3.13Å; V997-F1007 HydrophobicContact CG1-CE2 4.43Å; V997-H1011 HydrophobicContact CG1-CB 4.29Å; V997-H1011 PolarHBondContact O-NE2 3.13Å; V997-V1031 HydrophobicContact CG1-CG1 3.71Å; V997-V1032 CarbonylContact C-O 3.51Å; V997-V1032 WeakPolarHBondContact CA-O 3.26Å
998	T	83.7	Confident	72.3	Confident	78 Å²	78	72.1 Å²	72.1	48%	0.479	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	149.2	177.3	49.2	0	0	0	0	112.7	V1031 V1032	T998-V1031 CarbonylContact O-C 3.53Å; T998-V1031 VanDerWaalsContact O-CA 3.29Å; T998-V1031 WeakPolarHBondContact O-CA 3.43Å; T998-V1032 PolarHBondContact N-O 2.92Å; T998-V1032 PolarHBondContact O-N 2.99Å
999	L	81.9	Confident	72.1	Confident	39 Å²	39	77.4 Å²	77.4	20%	0.204	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	135.1	173.4	-164	72.6	0	0	0	110.1	F1007 V1029 H1030 V1031	L999-F1007 HydrophobicContact CB-CD2 3.63Å; L999-F1007 HydrophobicContact CB-CE2 3.85Å; L999-F1007 HydrophobicContact CB-CG 4.5Å; L999-F1007 HydrophobicContact CD1-CD2 4.34Å; L999-F1007 HydrophobicContact CD1-CE2 3.91Å; L999-F1007 HydrophobicContact CD1-CZ 4.21Å; L999-F1007 HydrophobicContact CD2-CD2 4.48Å; L999-F1007 HydrophobicContact CG-CD2 4.37Å; L999-F1007 HydrophobicContact CG-CE2 4.4Å; L999-V1029 HydrophobicContact CD1-CB 4.13Å; L999-V1029 HydrophobicContact CD1-CG1 3.61Å; L999-V1029 HydrophobicContact CD2-CG1 4.11Å; L999-V1029 HydrophobicContact CG-CG1 3.69Å; L999-H1030 WeakPolarHBondContact CA-O 3.4Å; L999-V1031 HydrophobicContact CD1-CG2 3.83Å
1000	E	79.4	Confident	72.4	Confident	69 Å²	69	81.8 Å²	81.8	32%	0.322	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-71.8	140.5	170.3	-65	-169	164.4	0	0	110.8	N1002 V1029 H1030 V1032 R1047	E1000-N1002 PolarHBondContact O-N 2.92Å; E1000-V1029 WeakPolarHBondContact O-CG1 3.21Å; E1000-H1030 HydrophobicContact CB-CB 4.15Å; E1000-H1030 HydrophobicContact CG-CB 3.9Å; E1000-H1030 PolarHBondContact N-O 2.83Å; E1000-H1030 WeakPolarHBondContact OE2-CB 3.14Å; E1000-H1030 IonicContact OE2-CD2 2.7Å; E1000-H1030 IonicContact OE2-CG 3.39Å; E1000-V1032 HydrophobicContact CG-CG2 4.22Å; E1000-R1047 IonicContact OE1-CZ 3.65Å; E1000-R1047 IonicContact OE1-NE 3.7Å; E1000-R1047 IonicContact OE1-NH2 2.68Å; E1000-R1047 PolarHBondContact OE1-NH2 3.49Å
1001	T	74.5	Confident	73.3	Confident	153 Å²	153	79.7 Å²	79.7	94%	0.939	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-57.4	123.6	-164.7	46.6	0	0	0	0	114.1
1002	N	72.7	Confident	74.4	Confident	31 Å²	31	74.2 Å²	74.2	17%	0.166	39%	0.391	C	S	.	.			trans	-125.7	140.8	-177.3	-173.2	-74.9	0	0	0	111.4	E1000 Y1004 F1005 V1029	E1000-N1002 PolarHBondContact O-N 2.92Å; N1002-Y1004 PolarHBondContact O-N 2.88Å; N1002-Y1004 PolarHBondContact OD1-N 2.79Å; N1002-F1005 PolarHBondContact OD1-N 2.83Å; N1002-F1005 VanDerWaalsContact OD1-N 3.11Å; N1002-V1029 HydrophobicContact CB-CG1 4Å
1003	P	73.1	Confident	75.8	Confident	101 Å²	101	69.9 Å²	69.9	66%	0.656	37%	0.367	S	S	*	.	S	Bend	trans	-79	-12	-176.9	31.2	-36.2	0	0	0	115.1
1004	Y	74.4	Confident	77	Confident	75 Å²	75	68.5 Å²	68.5	29%	0.294	36%	0.356	S	S	.	.	S	Bend	trans	-111.2	-30.3	-177.8	-59.8	-67.7	0	0	0	113.4	N1002 K1016 I1017 P1022 Y1027	N1002-Y1004 PolarHBondContact O-N 2.88Å; N1002-Y1004 PolarHBondContact OD1-N 2.79Å; Y1004-K1016 WeakPolarHBondContact O-CA 3.37Å; Y1004-I1017 PolarHBondContact O-N 3.44Å; Y1004-P1022 HydrophobicContact CD1-CB 3.9Å; Y1004-P1022 HydrophobicContact CE1-CB 4.32Å; Y1004-P1022 HydrophobicContact CG-CB 4.22Å; Y1004-Y1027 HydrophobicContact CD2-CD1 4.42Å; Y1004-Y1027 HydrophobicContact CD2-CE1 4.29Å; Y1004-Y1027 HydrophobicContact CE2-CD1 4.32Å; Y1004-Y1027 AromaticContact CE2-CE1 3.79Å; Y1004-Y1027 HydrophobicContact CE2-CE1 3.79Å
1005	F	80.8	Confident	77.3	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.3	-165.6	-64.4	-69.1	0	0	0	113.4	Y966 N1002 I1014 C1015 I1052 I1054	Y966-F1005 HydrophobicContact CD2-CE1 4.29Å; N1002-F1005 PolarHBondContact OD1-N 2.83Å; N1002-F1005 VanDerWaalsContact OD1-N 3.11Å; F1005-I1014 HydrophobicContact CB-CG2 3.77Å; F1005-I1014 HydrophobicContact CD1-CG2 3.76Å; F1005-I1014 HydrophobicContact CG-CG2 3.99Å; F1005-C1015 WeakPolarHBondContact CA-O 3.14Å; F1005-I1052 HydrophobicContact CD1-CD1 4.31Å; F1005-I1052 HydrophobicContact CD2-CD1 3.64Å; F1005-I1052 HydrophobicContact CE1-CD1 4.45Å; F1005-I1052 HydrophobicContact CE1-CG2 4.42Å; F1005-I1052 HydrophobicContact CE2-CB 4.32Å; F1005-I1052 HydrophobicContact CE2-CD1 3.81Å; F1005-I1052 HydrophobicContact CE2-CG2 4Å; F1005-I1052 HydrophobicContact CG-CD1 3.92Å; F1005-I1052 HydrophobicContact CZ-CD1 4.21Å; F1005-I1052 HydrophobicContact CZ-CG2 3.74Å; F1005-I1054 HydrophobicContact CZ-CD1 4.39Å
1006	E	80.8	Confident	77.1	Confident	69 Å²	69	63 Å²	63	32%	0.322	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	153.9	170.6	64.8	-176.3	-171.6	0	0	111.2	R1008 I1014 C1015 I1017	E1006-R1008 HydrophobicContact CG-CG 4.27Å; E1006-R1008 IonicContact OE1-CZ 3.57Å; E1006-R1008 IonicContact OE1-NE 3.84Å; E1006-R1008 PolarHBondContact OE1-NE 2.86Å; E1006-R1008 IonicContact OE1-NH2 3.58Å; E1006-R1008 PolarHBondContact OE1-NH2 3.05Å; E1006-I1014 WeakPolarHBondContact O-CA 3.35Å; E1006-C1015 PolarHBondContact N-O 3.47Å; E1006-C1015 VanDerWaalsContact N-O 3.08Å; E1006-C1015 PolarHBondContact O-N 3.33Å; E1006-I1017 HydrophobicContact CB-CD1 4.07Å; E1006-I1017 HydrophobicContact CB-CG1 4.09Å; E1006-I1017 HydrophobicContact CG-CD1 4.42Å; E1006-I1017 HydrophobicContact CG-CG1 3.89Å
1007	F	83.3	Confident	76.7	Confident	33 Å²	33	64.4 Å²	64.4	15%	0.145	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	137.8	165.8	-85.2	-45.7	0	0	0	110.4	F980 V997 L999 H1011 I1013 I1014 V1031	F980-F1007 HydrophobicContact CB-CE1 4.01Å; F980-F1007 AromaticContact CD1-CE1 3.8Å; F980-F1007 HydrophobicContact CD1-CE1 3.8Å; F980-F1007 AromaticContact CD1-CZ 3.92Å; F980-F1007 HydrophobicContact CD1-CZ 3.92Å; F980-F1007 HydrophobicContact CD2-CE1 4.3Å; F980-F1007 HydrophobicContact CE1-CE1 4.34Å; F980-F1007 AromaticContact CE1-CZ 3.99Å; F980-F1007 HydrophobicContact CE1-CZ 3.99Å; F980-F1007 AromaticContact CG-CE1 3.77Å; F980-F1007 HydrophobicContact CG-CE1 3.77Å; F980-F1007 HydrophobicContact CG-CZ 4.18Å; F980-F1007 HydrophobicContact CZ-CZ 4.33Å; V997-F1007 HydrophobicContact CG1-CE2 4.43Å; L999-F1007 HydrophobicContact CB-CD2 3.63Å; L999-F1007 HydrophobicContact CB-CE2 3.85Å; L999-F1007 HydrophobicContact CB-CG 4.5Å; L999-F1007 HydrophobicContact CD1-CD2 4.34Å; L999-F1007 HydrophobicContact CD1-CE2 3.91Å; L999-F1007 HydrophobicContact CD1-CZ 4.21Å; L999-F1007 HydrophobicContact CD2-CD2 4.48Å; L999-F1007 HydrophobicContact CG-CD2 4.37Å; L999-F1007 HydrophobicContact CG-CE2 4.4Å; F1007-H1011 HydrophobicContact CD1-CB 4.18Å; F1007-H1011 WeakPolarHBondContact CD1-O 3.32Å; F1007-H1011 HydrophobicContact CD2-CB 4.05Å; F1007-H1011 AromaticContact CD2-CD2 3.7Å; F1007-H1011 HydrophobicContact CE1-CB 4.31Å; F1007-H1011 WeakPolarHBondContact CE1-O 3.25Å; F1007-H1011 HydrophobicContact CE2-CB 4.19Å; F1007-H1011 HydrophobicContact CG-CB 4.07Å; F1007-H1011 HydrophobicContact CZ-CB 4.33Å; F1007-I1013 CarbonylContact C-O 3.55Å; F1007-I1013 WeakPolarHBondContact CA-O 3.18Å; F1007-I1014 HydrophobicContact CD1-CD1 4.5Å; F1007-I1014 HydrophobicContact CD1-CG1 3.64Å; F1007-I1014 HydrophobicContact CE1-CD1 3.92Å; F1007-I1014 HydrophobicContact CE1-CG1 3.53Å; F1007-V1031 HydrophobicContact CE2-CG1 4.37Å; F1007-V1031 HydrophobicContact CE2-CG2 4.17Å; F1007-V1031 HydrophobicContact CZ-CG2 4.02Å
1008	R	74	Confident	75.8	Confident	116 Å²	116	65.9 Å²	65.9	44%	0.438	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	166.8	165.8	-64.4	-167.2	-178.4	163.9	1.7	109.1	E1006 I1013 C1015	E1006-R1008 HydrophobicContact CG-CG 4.27Å; E1006-R1008 IonicContact OE1-CZ 3.57Å; E1006-R1008 IonicContact OE1-NE 3.84Å; E1006-R1008 PolarHBondContact OE1-NE 2.86Å; E1006-R1008 IonicContact OE1-NH2 3.58Å; E1006-R1008 PolarHBondContact OE1-NH2 3.05Å; R1008-I1013 PolarHBondContact N-O 2.89Å; R1008-I1013 PolarHBondContact O-N 3.39Å; R1008-I1013 VanDerWaalsContact O-O 3.12Å; R1008-C1015 HydrophobicContact CG-CB 4.15Å
1009	L	69.3	Low	74.8	Confident	117 Å²	117	71.9 Å²	71.9	61%	0.613	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	63.8	176.3	-64.9	156.6	0	0	0	110.9	H1011 T1012 I1013	L1009-H1011 VanDerWaalsContact C-N 3.28Å; L1009-H1011 PolarHBondContact O-N 3.38Å; L1009-T1012 WeakPolarHBondContact O-CB 3.22Å; L1009-T1012 WeakPolarHBondContact O-CG2 3.43Å; L1009-T1012 PolarHBondContact O-N 3.08Å; L1009-T1012 PolarHBondContact O-OG1 2.78Å; L1009-I1013 HydrophobicContact CD1-CB 4.41Å; L1009-I1013 HydrophobicContact CD1-CD1 3.73Å; L1009-I1013 HydrophobicContact CD1-CG1 4.19Å
1010	D	70.9	Confident	74.1	Confident	149 Å²	149	77.5 Å²	77.5	80%	0.797	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	43.6	173.4	-51.2	-27.1	0	0	0	114.1	T1012	D1010-T1012 PolarHBondContact O-N 2.73Å
1011	H	74.6	Confident	73.3	Confident	81 Å²	81	78.6 Å²	78.6	38%	0.375	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	5.8	-179.1	-36.7	100.7	0	0	0	115.5	F980 V997 F1007 L1009	F980-H1011 WeakPolarHBondContact CD1-O 3.45Å; V997-H1011 HydrophobicContact CG1-CB 4.29Å; V997-H1011 PolarHBondContact O-NE2 3.13Å; F1007-H1011 HydrophobicContact CD1-CB 4.18Å; F1007-H1011 WeakPolarHBondContact CD1-O 3.32Å; F1007-H1011 HydrophobicContact CD2-CB 4.05Å; F1007-H1011 AromaticContact CD2-CD2 3.7Å; F1007-H1011 HydrophobicContact CE1-CB 4.31Å; F1007-H1011 WeakPolarHBondContact CE1-O 3.25Å; F1007-H1011 HydrophobicContact CE2-CB 4.19Å; F1007-H1011 HydrophobicContact CG-CB 4.07Å; F1007-H1011 HydrophobicContact CZ-CB 4.33Å; L1009-H1011 VanDerWaalsContact C-N 3.28Å; L1009-H1011 PolarHBondContact O-N 3.38Å
1012	T	75.6	Confident	72.9	Confident	66 Å²	66	71.5 Å²	71.5	41%	0.405	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-18.7	179.4	67.1	0	0	0	0	114	F980 L1009 D1010	F980-T1012 PolarHBondContact N-O 3.34Å; L1009-T1012 WeakPolarHBondContact O-CB 3.22Å; L1009-T1012 WeakPolarHBondContact O-CG2 3.43Å; L1009-T1012 PolarHBondContact O-N 3.08Å; L1009-T1012 PolarHBondContact O-OG1 2.78Å; D1010-T1012 PolarHBondContact O-N 2.73Å
1013	I	75.8	Confident	73	Confident	38 Å²	38	73.2 Å²	73.2	20%	0.195	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134.9	-178.1	-59.7	-161.7	0	0	0	111.3	C977 I978 F1007 R1008 L1009	C977-I1013 HydrophobicContact CB-CG2 3.45Å; C977-I1013 VanDerWaalsContact CB-CG2 3.45Å; I978-I1013 CarbonylContact O-C 3.49Å; I978-I1013 WeakPolarHBondContact O-CA 3.48Å; I978-I1013 WeakPolarHBondContact O-CG2 3.1Å; F1007-I1013 CarbonylContact C-O 3.55Å; F1007-I1013 WeakPolarHBondContact CA-O 3.18Å; R1008-I1013 PolarHBondContact N-O 2.89Å; R1008-I1013 PolarHBondContact O-N 3.39Å; R1008-I1013 VanDerWaalsContact O-O 3.12Å; L1009-I1013 HydrophobicContact CD1-CB 4.41Å; L1009-I1013 HydrophobicContact CD1-CD1 3.73Å; L1009-I1013 HydrophobicContact CD1-CG1 4.19Å
1014	I	80.6	Confident	72.9	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.015	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	113.2	173.2	-66	170	0	0	0	108.5	L964 C977 I978 F980 F1005 E1006 F1007 I1052	L964-I1014 HydrophobicContact CD1-CD1 3.77Å; C977-I1014 CarbonylContact C-O 3.48Å; C977-I1014 WeakPolarHBondContact CA-O 3.43Å; I978-I1014 PolarHBondContact N-O 3.11Å; I978-I1014 PolarHBondContact O-N 3.46Å; F980-I1014 HydrophobicContact CB-CD1 4.13Å; F980-I1014 HydrophobicContact CB-CG1 4.23Å; F980-I1014 HydrophobicContact CD2-CD1 3.78Å; F980-I1014 HydrophobicContact CG-CD1 4.22Å; F1005-I1014 HydrophobicContact CB-CG2 3.77Å; F1005-I1014 HydrophobicContact CD1-CG2 3.76Å; F1005-I1014 HydrophobicContact CG-CG2 3.99Å; E1006-I1014 WeakPolarHBondContact O-CA 3.35Å; F1007-I1014 HydrophobicContact CD1-CD1 4.5Å; F1007-I1014 HydrophobicContact CD1-CG1 3.64Å; F1007-I1014 HydrophobicContact CE1-CD1 3.92Å; F1007-I1014 HydrophobicContact CE1-CG1 3.53Å; I1014-I1052 HydrophobicContact CG2-CD1 4.12Å
1015	C	74.5	Confident	73	Confident	5 Å²	5	71.1 Å²	71.1	3%	0.034	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	148.6	-173.7	-77	0	0	0	0	113.6	C977 F1005 E1006 R1008	C977-C1015 HydrophobicContact CB-CB 4Å; C977-C1015 WeakPolarHBondContact CB-SG 3.5Å; C977-C1015 VanDerWaalsContact SG-CA 3.53Å; C977-C1015 WeakPolarHBondContact SG-CB 3.46Å; C977-C1015 CovalentContact SG-SG 2.04Å; C977-C1015 PolarHBondContact SG-SG 3.11Å; F1005-C1015 WeakPolarHBondContact CA-O 3.14Å; E1006-C1015 PolarHBondContact N-O 3.47Å; E1006-C1015 VanDerWaalsContact N-O 3.08Å; E1006-C1015 PolarHBondContact O-N 3.33Å; R1008-C1015 HydrophobicContact CG-CB 4.15Å
1016	K	75.1	Confident	72.8	Confident	24 Å²	24	75.5 Å²	75.5	10%	0.104	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.7	172.4	-178.3	-171.8	173	-159.8	0	111.2	Y966 S976 Y1004 S1018 K1019 E1020 D1021	Y966-K1016 WeakPolarHBondContact OH-CD 3.3Å; S976-K1016 VanDerWaalsContact O-CB 3.28Å; S976-K1016 WeakPolarHBondContact O-CB 3.38Å; S976-K1016 PolarHBondContact O-N 2.8Å; Y1004-K1016 WeakPolarHBondContact O-CA 3.37Å; K1016-S1018 WeakPolarHBondContact CE-O 3.42Å; K1016-K1019 PolarHBondContact NZ-O 2.75Å; K1016-E1020 WeakPolarHBondContact CE-O 3.46Å; K1016-E1020 PolarHBondContact NZ-O 2.76Å; K1016-D1021 IonicContact NZ-OD1 2.7Å; K1016-D1021 PolarHBondContact NZ-OD1 2.75Å
1017	I	73.8	Confident	72.6	Confident	81 Å²	81	75.2 Å²	75.2	42%	0.415	39%	0.386	S	S	.	.			trans	-83.8	-38.1	179.8	-56.3	170.6	0	0	0	112.2	Y1004 E1006	Y1004-I1017 PolarHBondContact O-N 3.44Å; E1006-I1017 HydrophobicContact CB-CD1 4.07Å; E1006-I1017 HydrophobicContact CB-CG1 4.09Å; E1006-I1017 HydrophobicContact CG-CD1 4.42Å; E1006-I1017 HydrophobicContact CG-CG1 3.89Å
1018	S	63.6	Low	72.6	Confident	52 Å²	52	77.3 Å²	77.3	36%	0.364	40%	0.401	S	S	.	.			trans	-89	163.2	-169.7	-170.5	0	0	0	0	114.4	K1016 E1020	K1016-S1018 WeakPolarHBondContact CE-O 3.42Å; S1018-E1020 PolarHBondContact OG-N 3.41Å; S1018-E1020 VanDerWaalsContact OG-N 3.11Å
1019	K	63.2	Low	72.9	Confident	204 Å²	204	72.2 Å²	72.2	89%	0.887	38%	0.383	S	S	*	.	S	Bend	trans	-76.1	-37.8	161.4	-75.3	-171.8	176.4	-178.1	0	112	K1016	K1016-K1019 PolarHBondContact NZ-O 2.75Å
1020	E	65.2	Low	73.6	Confident	157 Å²	157	70.4 Å²	70.4	73%	0.734	37%	0.371	S	S	*	.	S	Bend	trans	-69.9	136.6	177.6	-61.9	-178.6	152.2	0	0	110.6	K1016 S1018	K1016-E1020 WeakPolarHBondContact CE-O 3.46Å; K1016-E1020 PolarHBondContact NZ-O 2.76Å; S1018-E1020 PolarHBondContact OG-N 3.41Å; S1018-E1020 VanDerWaalsContact OG-N 3.11Å
1021	D	64.4	Low	74.4	Confident	92 Å²	92	63.3 Å²	63.3	49%	0.492	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-71.3	136.1	178.2	-67.9	-50.6	0	0	0	111.7	I968 K1016	I968-D1021 HydrophobicContact CG2-CB 3.97Å; K1016-D1021 IonicContact NZ-OD1 2.7Å; K1016-D1021 PolarHBondContact NZ-OD1 2.75Å
1022	P	65.9	Low	75	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.019	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-68.9	146.1	-179.1	32.2	-36.8	0	0	0	110	Y966 Y1004 I1054	Y966-P1022 HydrophobicContact CD1-CG 4.37Å; Y966-P1022 HydrophobicContact CE1-CG 4.16Å; Y1004-P1022 HydrophobicContact CD1-CB 3.9Å; Y1004-P1022 HydrophobicContact CE1-CB 4.32Å; Y1004-P1022 HydrophobicContact CG-CB 4.22Å; P1022-I1054 HydrophobicContact CB-CD1 3.68Å; P1022-I1054 HydrophobicContact CG-CD1 3.69Å; P1022-I1054 HydrophobicContact CG-CG1 4.33Å
1023	P	73.7	Confident	75.5	Confident	67 Å²	67	57.8 Å²	57.8	44%	0.435	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-60.1	144.4	-177.5	-22.8	32.8	0	0	0	113.1	G1025 I1054	P1023-G1025 PolarHBondContact O-N 2.81Å; P1023-I1054 VanDerWaalsContact O-CD1 3.3Å; P1023-I1054 WeakPolarHBondContact O-CD1 3.41Å
1024	V	71.5	Confident	76	Confident	100 Å²	100	61.9 Å²	61.9	61%	0.606	32%	0.318	S	S	*	.	S	Bend	trans	-57.7	120.2	170.6	175.8	0	0	0	0	109.1	I968 I1054	I968-V1024 HydrophobicContact CD1-CG2 3.63Å; V1024-I1054 WeakPolarHBondContact CG1-O 3.49Å
1025	G	75.5	Confident	76.1	Confident	32 Å²	32	61.9 Å²	61.9	33%	0.33	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	164.3	-177	-171.3	0	0	0	0	0	113.3	P1023 I1054	P1023-G1025 PolarHBondContact O-N 2.81Å; G1025-I1054 PolarHBondContact N-O 2.81Å; G1025-I1054 PolarHBondContact O-N 2.76Å
1026	Q	77.7	Confident	76.4	Confident	96 Å²	96	67.6 Å²	67.6	45%	0.449	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.5	178	-170.9	-175.4	14.2	0	0	110.1	I1052 H1053	Q1026-I1052 WeakPolarHBondContact CA-O 3.23Å; Q1026-H1053 PolarHBondContact NE2-CE1 3.09Å; Q1026-H1053 PolarHBondContact NE2-NE2 2.97Å; Q1026-H1053 PolarHBondContact OE1-CE1 2.76Å
1027	Y	76.9	Confident	76.3	Confident	64 Å²	64	67.1 Å²	67.1	25%	0.251	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	154.5	-178.5	-66	-96.4	0	0	0	109.9	Y1004 R1051 I1052 I1054	Y1004-Y1027 HydrophobicContact CD2-CD1 4.42Å; Y1004-Y1027 HydrophobicContact CD2-CE1 4.29Å; Y1004-Y1027 HydrophobicContact CE2-CD1 4.32Å; Y1004-Y1027 AromaticContact CE2-CE1 3.79Å; Y1004-Y1027 HydrophobicContact CE2-CE1 3.79Å; Y1027-R1051 CarbonylContact O-C 3.55Å; Y1027-R1051 WeakPolarHBondContact O-CA 3.06Å; Y1027-I1052 PolarHBondContact N-O 3.44Å; Y1027-I1052 PolarHBondContact O-N 2.82Å; Y1027-I1054 HydrophobicContact CD2-CD1 3.77Å; Y1027-I1054 HydrophobicContact CE2-CD1 3.7Å
1028	T	81.8	Confident	76.1	Confident	77 Å²	77	70.1 Å²	70.1	47%	0.472	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.1	175.8	-53	0	0	0	0	110.6	A1049 V1050 R1051	T1028-A1049 HydrophobicContact CG2-CB 4.39Å; T1028-V1050 CarbonylContact C-O 3.53Å; T1028-V1050 WeakPolarHBondContact CA-O 3.49Å; T1028-R1051 HydrophobicContact CG2-CG 4.2Å
1029	V	81.3	Confident	76.4	Confident	9 Å²	9	71.2 Å²	71.2	6%	0.055	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	152.9	177.5	-150.8	0	0	0	0	108.7	L999 E1000 N1002 V1050 I1052	L999-V1029 HydrophobicContact CD1-CB 4.13Å; L999-V1029 HydrophobicContact CD1-CG1 3.61Å; L999-V1029 HydrophobicContact CD2-CG1 4.11Å; L999-V1029 HydrophobicContact CG-CG1 3.69Å; E1000-V1029 WeakPolarHBondContact O-CG1 3.21Å; N1002-V1029 HydrophobicContact CB-CG1 4Å; V1029-V1050 PolarHBondContact N-O 2.9Å; V1029-V1050 PolarHBondContact O-N 2.73Å; V1029-I1052 HydrophobicContact CG2-CD1 4.08Å
1030	H	85	Confident	76.9	Confident	79 Å²	79	66.8 Å²	66.8	37%	0.366	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	143	178.8	-74.6	-60.9	0	0	0	112.3	L999 E1000 Y1048	L999-H1030 WeakPolarHBondContact CA-O 3.4Å; E1000-H1030 HydrophobicContact CB-CB 4.15Å; E1000-H1030 HydrophobicContact CG-CB 3.9Å; E1000-H1030 PolarHBondContact N-O 2.83Å; E1000-H1030 WeakPolarHBondContact OE2-CB 3.14Å; E1000-H1030 IonicContact OE2-CD2 2.7Å; E1000-H1030 IonicContact OE2-CG 3.39Å; H1030-Y1048 WeakPolarHBondContact CA-O 3.47Å; H1030-Y1048 PolarHBondContact ND1-O 2.73Å
1031	V	86.5	Confident	77.5	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.6	172.5	-175.9	0	0	0	0	108.8	F980 F984 V997 T998 L999 F1007 Y1048 V1050	F980-V1031 HydrophobicContact CZ-CG2 4.26Å; F984-V1031 HydrophobicContact CE2-CG1 4.15Å; F984-V1031 HydrophobicContact CZ-CG1 3.61Å; V997-V1031 HydrophobicContact CG1-CG1 3.71Å; T998-V1031 CarbonylContact O-C 3.53Å; T998-V1031 VanDerWaalsContact O-CA 3.29Å; T998-V1031 WeakPolarHBondContact O-CA 3.43Å; L999-V1031 HydrophobicContact CD1-CG2 3.83Å; F1007-V1031 HydrophobicContact CE2-CG1 4.37Å; F1007-V1031 HydrophobicContact CE2-CG2 4.17Å; F1007-V1031 HydrophobicContact CZ-CG2 4.02Å; V1031-Y1048 PolarHBondContact N-O 2.91Å; V1031-Y1048 PolarHBondContact O-N 2.9Å; V1031-V1050 HydrophobicContact CG2-CG2 3.71Å
1032	V	87.2	Confident	78	Confident	30 Å²	30	63.9 Å²	63.9	18%	0.182	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.1	-178.8	-167.7	0	0	0	0	109	V997 T998 E1000 R1046 R1047	V997-V1032 CarbonylContact C-O 3.51Å; V997-V1032 WeakPolarHBondContact CA-O 3.26Å; T998-V1032 PolarHBondContact N-O 2.92Å; T998-V1032 PolarHBondContact O-N 2.99Å; E1000-V1032 HydrophobicContact CG-CG2 4.22Å; V1032-R1046 WeakPolarHBondContact CG1-O 3.36Å; V1032-R1047 HydrophobicContact CG1-CG 4.03Å; V1032-R1047 HydrophobicContact CG2-CG 4.13Å
1033	A	86.1	Confident	78.7	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143.1	176.4	0	0	0	0	0	110.2	P930 F984 I995 D996 K1045 R1046 Y1048	P930-A1033 HydrophobicContact CB-CB 4.32Å; F984-A1033 HydrophobicContact CD1-CB 3.69Å; F984-A1033 HydrophobicContact CE1-CB 3.94Å; F984-A1033 HydrophobicContact CG-CB 4.27Å; I995-A1033 HydrophobicContact CG2-CB 3.82Å; D996-A1033 VanDerWaalsContact O-CA 3.32Å; D996-A1033 WeakPolarHBondContact O-CA 3.33Å; A1033-K1045 CarbonylContact O-C 3.35Å; A1033-K1045 WeakPolarHBondContact O-CA 3.2Å; A1033-R1046 PolarHBondContact N-O 3.06Å; A1033-R1046 PolarHBondContact O-N 3.24Å; A1033-Y1048 HydrophobicContact CB-CE2 4.2Å
1034	R	86.2	Confident	79.1	Confident	124 Å²	124	65.1 Å²	65.1	47%	0.468	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	140.8	174.2	-176.2	-157	-52.5	175	7.3	109.4	I995 D996 S1043 L1044 K1045	I995-R1034 CarbonylContact C-O 3.57Å; I995-R1034 WeakPolarHBondContact CA-O 3.2Å; D996-R1034 HydrophobicContact CB-CB 4.35Å; D996-R1034 PolarHBondContact N-O 3.49Å; D996-R1034 PolarHBondContact O-N 3.12Å; R1034-S1043 WeakPolarHBondContact CD-OG 3.4Å; R1034-S1043 WeakPolarHBondContact CG-OG 3.44Å; R1034-L1044 WeakPolarHBondContact CA-O 2.98Å; R1034-L1044 WeakPolarHBondContact CG-O 3.34Å; R1034-K1045 HydrophobicContact CB-CB 4.04Å; R1034-K1045 HydrophobicContact CG-CB 3.98Å
1035	D	84.2	Confident	79.8	Confident	4 Å²	4	68 Å²	68	2%	0.021	36%	0.356	C	S	.	.			trans	-69.9	-178.2	170.5	66.6	5.4	0	0	0	113.2	N926 P930 D986 P1037 S1043 L1044	N926-D1035 PolarHBondContact ND2-OD2 2.94Å; P930-D1035 HydrophobicContact CG-CB 4.09Å; D986-D1035 WeakPolarHBondContact OD2-CB 3.49Å; D1035-P1037 WeakPolarHBondContact OD1-CD 3.33Å; D1035-P1037 WeakPolarHBondContact OD2-CD 3.47Å; D1035-S1043 WeakPolarHBondContact OD1-CA 3.32Å; D1035-S1043 WeakPolarHBondContact OD1-CB 3.35Å; D1035-S1043 PolarHBondContact OD1-OG 2.98Å; D1035-L1044 PolarHBondContact N-O 3.23Å; D1035-L1044 VanDerWaalsContact N-O 3.11Å; D1035-L1044 PolarHBondContact OD1-N 3.38Å; D1035-L1044 VanDerWaalsContact OD1-O 3.05Å; D1035-L1044 WeakPolarHBondContact OD2-CB 3.12Å; D1035-L1044 PolarHBondContact OD2-N 2.95Å
1036	R	78.9	Confident	80.3	Confident	124 Å²	124	70.2 Å²	70.2	47%	0.468	35%	0.354	S	S	.	.			trans	-147.8	64	167.3	-66.4	-175.8	179.3	173.7	-1.9	112.2	Q994 D996	Q994-R1036 HydrophobicContact CB-CB 4.13Å; Q994-R1036 HydrophobicContact CB-CG 4.26Å; Q994-R1036 WeakPolarHBondContact O-CG 3.28Å; D996-R1036 IonicContact OD1-CZ 2.64Å; D996-R1036 IonicContact OD1-NE 3.72Å; D996-R1036 IonicContact OD1-NH2 3.32Å; D996-R1036 PolarHBondContact OD1-NH2 2.89Å; D996-R1036 IonicContact OD2-CZ 3.7Å; D996-R1036 VanDerWaalsContact OD2-CZ 3.27Å; D996-R1036 IonicContact OD2-NE 2.83Å; D996-R1036 PolarHBondContact OD2-NE 2.96Å; D996-R1036 IonicContact OD2-NH2 3.42Å; D996-R1036 PolarHBondContact OD2-NH2 2.85Å
1037	P	73.2	Confident	80.6	Confident	14 Å²	14	74 Å²	74	9%	0.091	36%	0.364	C	S	.	.			trans	-58.9	154.6	178	24.6	-35.4	0	0	0	112.4	N926 D1035 D1039 K1042	N926-P1037 HydrophobicContact CB-CB 4.42Å; D1035-P1037 WeakPolarHBondContact OD1-CD 3.33Å; D1035-P1037 WeakPolarHBondContact OD2-CD 3.47Å; P1037-D1039 CarbonylContact O-C 3.57Å; P1037-D1039 PolarHBondContact O-N 3.19Å; P1037-K1042 HydrophobicContact CG-CB 4.09Å
1038	T	71	Confident	81	Confident	144 Å²	144	71.2 Å²	71.2	88%	0.883	35%	0.354	S	S	*	.	S	Bend	trans	-52.6	-30.6	-179.8	-39.2	0	0	0	0	113.8
1039	D	70.1	Confident	81.1	Confident	76 Å²	76	68.2 Å²	68.2	41%	0.406	34%	0.336	S	S	.	.	S	Bend	trans	-100.2	107.6	166.6	-175.4	-18.6	0	0	0	109.5	P1037 T1041 K1042	P1037-D1039 CarbonylContact O-C 3.57Å; P1037-D1039 PolarHBondContact O-N 3.19Å; D1039-T1041 PolarHBondContact O-N 2.89Å; D1039-T1041 VanDerWaalsContact OD1-CB 3.3Å; D1039-T1041 WeakPolarHBondContact OD1-CB 3.36Å; D1039-T1041 WeakPolarHBondContact OD1-CG2 3.44Å; D1039-T1041 PolarHBondContact OD1-N 2.9Å; D1039-T1041 PolarHBondContact OD1-OG1 2.04Å; D1039-T1041 PolarHBondContact OD2-OG1 3.03Å; D1039-K1042 HydrophobicContact CB-CG 4.41Å; D1039-K1042 PolarHBondContact O-N 3.08Å
1040	P	73.1	Confident	81.2	Confident	110 Å²	110	67.8 Å²	67.8	71%	0.714	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-5.9	-178	29	-35.9	0	0	0	113.8	K1042	P1040-K1042 VanDerWaalsContact C-N 3.32Å
1041	T	77.2	Confident	81.1	Confident	121 Å²	121	68.3 Å²	68.3	74%	0.742	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-18.3	170.8	70.2	0	0	0	0	113.3	D1039	D1039-T1041 PolarHBondContact O-N 2.89Å; D1039-T1041 VanDerWaalsContact OD1-CB 3.3Å; D1039-T1041 WeakPolarHBondContact OD1-CB 3.36Å; D1039-T1041 WeakPolarHBondContact OD1-CG2 3.44Å; D1039-T1041 PolarHBondContact OD1-N 2.9Å; D1039-T1041 PolarHBondContact OD1-OG1 2.04Å; D1039-T1041 PolarHBondContact OD2-OG1 3.03Å
1042	K	74.8	Confident	80.8	Confident	67 Å²	67	68.3 Å²	68.3	29%	0.291	33%	0.332	S	S	.	.	S	Bend	trans	-86.3	-15.4	178.8	-67.4	-161.4	168.5	-161.5	0	115.2	N926 P1037 D1039 P1040 L1044	N926-K1042 HydrophobicContact CB-CD 4.11Å; N926-K1042 VanDerWaalsContact OD1-CB 3.28Å; N926-K1042 WeakPolarHBondContact OD1-CB 3.28Å; N926-K1042 PolarHBondContact OD1-O 2.84Å; P1037-K1042 HydrophobicContact CG-CB 4.09Å; D1039-K1042 HydrophobicContact CB-CG 4.41Å; D1039-K1042 PolarHBondContact O-N 3.08Å; P1040-K1042 VanDerWaalsContact C-N 3.32Å; K1042-L1044 WeakPolarHBondContact O-CG 3.3Å; K1042-L1044 PolarHBondContact O-N 2.92Å
1043	S	80	Confident	80.5	Confident	45 Å²	45	70.2 Å²	70.2	32%	0.315	34%	0.339	S	S	.	.			trans	-50.1	125.1	-167.8	176.9	0	0	0	0	116.7	R1034 D1035	R1034-S1043 WeakPolarHBondContact CD-OG 3.4Å; R1034-S1043 WeakPolarHBondContact CG-OG 3.44Å; D1035-S1043 WeakPolarHBondContact OD1-CA 3.32Å; D1035-S1043 WeakPolarHBondContact OD1-CB 3.35Å; D1035-S1043 PolarHBondContact OD1-OG 2.98Å
1044	L	84.1	Confident	80	Confident	51 Å²	51	70.4 Å²	70.4	27%	0.267	34%	0.34	S	S	.	.			trans	-106.4	152.5	-179	-56.2	176	0	0	0	112.3	N928 A929 R1034 D1035 K1042	N928-L1044 VanDerWaalsContact C-CD1 3.49Å; N928-L1044 WeakPolarHBondContact O-CD1 3.3Å; A929-L1044 HydrophobicContact CB-CB 3.82Å; A929-L1044 HydrophobicContact CB-CD1 4.37Å; R1034-L1044 WeakPolarHBondContact CA-O 2.98Å; R1034-L1044 WeakPolarHBondContact CG-O 3.34Å; D1035-L1044 PolarHBondContact N-O 3.23Å; D1035-L1044 VanDerWaalsContact N-O 3.11Å; D1035-L1044 PolarHBondContact OD1-N 3.38Å; D1035-L1044 VanDerWaalsContact OD1-O 3.05Å; D1035-L1044 WeakPolarHBondContact OD2-CB 3.12Å; D1035-L1044 PolarHBondContact OD2-N 2.95Å; K1042-L1044 WeakPolarHBondContact O-CG 3.3Å; K1042-L1044 PolarHBondContact O-N 2.92Å
1045	K	84.6	Confident	79.3	Confident	160 Å²	160	65.8 Å²	65.8	70%	0.696	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.3	150.7	-171.2	71.5	-162.1	174.4	-158.4	0	114.8	A1033 R1034	A1033-K1045 CarbonylContact O-C 3.35Å; A1033-K1045 WeakPolarHBondContact O-CA 3.2Å; R1034-K1045 HydrophobicContact CB-CB 4.04Å; R1034-K1045 HydrophobicContact CG-CB 3.98Å
1046	R	85.7	Confident	78.2	Confident	80 Å²	80	69.9 Å²	69.9	30%	0.302	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	160.4	-174.4	-153.4	151.1	-175	-178.5	3.1	113.4	P930 V1032 A1033 Y1048	P930-R1046 VanDerWaalsContact O-CD 3.3Å; P930-R1046 WeakPolarHBondContact O-CD 3.11Å; V1032-R1046 WeakPolarHBondContact CG1-O 3.36Å; A1033-R1046 PolarHBondContact N-O 3.06Å; A1033-R1046 PolarHBondContact O-N 3.24Å; R1046-Y1048 HydrophobicContact CB-CE2 3.92Å; R1046-Y1048 VanDerWaalsContact CD-OH 3.3Å; R1046-Y1048 WeakPolarHBondContact CD-OH 3.07Å; R1046-Y1048 HydrophobicContact CG-CE2 3.96Å
1047	R	85.2	Confident	77.2	Confident	174 Å²	174	69.8 Å²	69.8	66%	0.657	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.8	-175.3	-77.1	-177.5	149	175.5	-11.1	111.6	E1000 V1032	E1000-R1047 IonicContact OE1-CZ 3.65Å; E1000-R1047 IonicContact OE1-NE 3.7Å; E1000-R1047 IonicContact OE1-NH2 2.68Å; E1000-R1047 PolarHBondContact OE1-NH2 3.49Å; V1032-R1047 HydrophobicContact CG1-CG 4.03Å; V1032-R1047 HydrophobicContact CG2-CG 4.13Å
1048	Y	85.5	Confident	75.7	Confident	7 Å²	7	77.8 Å²	77.8	3%	0.027	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	162.6	-172.9	-58.5	-84.5	0	0	0	111.2	P930 I931 M932 L959 F984 H1030 V1031 A1033 R1046	P930-Y1048 PolarHBondContact O-OH 2.82Å; I931-Y1048 VanDerWaalsContact CA-OH 3.26Å; I931-Y1048 WeakPolarHBondContact CA-OH 3.32Å; M932-Y1048 HydrophobicContact CB-CD1 3.79Å; M932-Y1048 HydrophobicContact CB-CD2 4.39Å; M932-Y1048 HydrophobicContact CB-CE1 3.51Å; M932-Y1048 HydrophobicContact CB-CE2 4.16Å; M932-Y1048 HydrophobicContact CB-CG 4.22Å; M932-Y1048 HydrophobicContact CE-CD1 3.72Å; M932-Y1048 HydrophobicContact CE-CG 3.98Å; M932-Y1048 PolarHBondContact N-OH 3.34Å; M932-Y1048 HydrophobicContact SD-CD1 4.1Å; M932-Y1048 HydrophobicContact SD-CD2 4.42Å; M932-Y1048 HydrophobicContact SD-CG 3.9Å; L959-Y1048 WeakPolarHBondContact O-CD1 3.46Å; F984-Y1048 HydrophobicContact CD1-CE2 4.07Å; F984-Y1048 AromaticContact CE1-CD2 3.62Å; F984-Y1048 HydrophobicContact CE1-CD2 3.62Å; F984-Y1048 AromaticContact CE1-CE2 3.61Å; F984-Y1048 HydrophobicContact CE1-CE2 3.61Å; F984-Y1048 HydrophobicContact CE1-CG 4.36Å; F984-Y1048 HydrophobicContact CZ-CD2 4.43Å; H1030-Y1048 WeakPolarHBondContact CA-O 3.47Å; H1030-Y1048 PolarHBondContact ND1-O 2.73Å; V1031-Y1048 PolarHBondContact N-O 2.91Å; V1031-Y1048 PolarHBondContact O-N 2.9Å; A1033-Y1048 HydrophobicContact CB-CE2 4.2Å; R1046-Y1048 HydrophobicContact CB-CE2 3.92Å; R1046-Y1048 VanDerWaalsContact CD-OH 3.3Å; R1046-Y1048 WeakPolarHBondContact CD-OH 3.07Å; R1046-Y1048 HydrophobicContact CG-CE2 3.96Å
1049	A	82.7	Confident	74	Confident	13 Å²	13	77.3 Å²	77.3	11%	0.107	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.1	179.3	0	0	0	0	0	112.5	S960 V961 V962 T1028	S960-A1049 PolarHBondContact O-N 3.04Å; V961-A1049 CarbonylContact C-O 3.55Å; V961-A1049 VanDerWaalsContact CA-O 3.3Å; V961-A1049 WeakPolarHBondContact CA-O 3.49Å; V961-A1049 HydrophobicContact CG2-CB 4.39Å; V962-A1049 PolarHBondContact N-O 3.15Å; T1028-A1049 HydrophobicContact CG2-CB 4.39Å
1050	V	83.3	Confident	72.2	Confident	1 Å²	1	78 Å²	78	1%	0.006	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	121.9	-176.5	-176.1	0	0	0	0	109	V962 L964 F980 T1028 V1029 V1031	V962-V1050 HydrophobicContact CB-CG1 4.37Å; V962-V1050 HydrophobicContact CB-CG2 4.31Å; V962-V1050 HydrophobicContact CG1-CG1 4.1Å; L964-V1050 HydrophobicContact CD1-CG1 3.6Å; L964-V1050 HydrophobicContact CG-CG1 4.15Å; F980-V1050 HydrophobicContact CE2-CG1 4.26Å; F980-V1050 HydrophobicContact CE2-CG2 3.74Å; F980-V1050 HydrophobicContact CZ-CG2 4.32Å; T1028-V1050 CarbonylContact C-O 3.53Å; T1028-V1050 WeakPolarHBondContact CA-O 3.49Å; V1029-V1050 PolarHBondContact N-O 2.9Å; V1029-V1050 PolarHBondContact O-N 2.73Å; V1031-V1050 HydrophobicContact CG2-CG2 3.71Å
1051	R	84.1	Confident	70.3	Confident	89 Å²	89	78.7 Å²	78.7	34%	0.336	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.9	-179.2	-55.6	-169	-63.9	-150.8	-6.3	110.4	V961 V962 D963 L964 Y1027 T1028	V961-R1051 HydrophobicContact CG1-CG 4.04Å; V962-R1051 WeakPolarHBondContact O-CB 3.3Å; V962-R1051 PolarHBondContact O-N 2.86Å; D963-R1051 CarbonylContact C-O 3.46Å; D963-R1051 WeakPolarHBondContact CA-O 3.3Å; D963-R1051 WeakPolarHBondContact OD1-CB 3.06Å; D963-R1051 IonicContact OD1-CZ 2.68Å; D963-R1051 IonicContact OD1-NE 3.37Å; D963-R1051 PolarHBondContact OD1-NE 2.8Å; D963-R1051 IonicContact OD1-NH2 3.46Å; D963-R1051 PolarHBondContact OD1-NH2 3.39Å; D963-R1051 IonicContact OD2-CZ 3.11Å; D963-R1051 IonicContact OD2-NE 1.8Å; D963-R1051 PolarHBondContact OD2-NE 2.95Å; D963-R1051 IonicContact OD2-NH2 2.73Å; D963-R1051 PolarHBondContact OD2-NH2 2.69Å; L964-R1051 PolarHBondContact N-O 3.25Å; Y1027-R1051 CarbonylContact O-C 3.55Å; Y1027-R1051 WeakPolarHBondContact O-CA 3.06Å; T1028-R1051 HydrophobicContact CG2-CG 4.2Å
1052	I	80.7	Confident	68.2	Low	0 Å²	0	79.4 Å²	79.4	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.3	-177.3	-56.2	171.6	0	0	0	108.9	L964 I978 F1005 I1014 Q1026 Y1027 V1029	L964-I1052 HydrophobicContact CB-CG1 4.42Å; L964-I1052 HydrophobicContact CD1-CG1 4.35Å; I978-I1052 HydrophobicContact CD1-CG2 3.63Å; F1005-I1052 HydrophobicContact CD1-CD1 4.31Å; F1005-I1052 HydrophobicContact CD2-CD1 3.64Å; F1005-I1052 HydrophobicContact CE1-CD1 4.45Å; F1005-I1052 HydrophobicContact CE1-CG2 4.42Å; F1005-I1052 HydrophobicContact CE2-CB 4.32Å; F1005-I1052 HydrophobicContact CE2-CD1 3.81Å; F1005-I1052 HydrophobicContact CE2-CG2 4Å; F1005-I1052 HydrophobicContact CG-CD1 3.92Å; F1005-I1052 HydrophobicContact CZ-CD1 4.21Å; F1005-I1052 HydrophobicContact CZ-CG2 3.74Å; I1014-I1052 HydrophobicContact CG2-CD1 4.12Å; Q1026-I1052 WeakPolarHBondContact CA-O 3.23Å; Y1027-I1052 PolarHBondContact N-O 3.44Å; Y1027-I1052 PolarHBondContact O-N 2.82Å; V1029-I1052 HydrophobicContact CG2-CD1 4.08Å
1053	H	80.3	Confident	66.2	Low	70 Å²	70	84.8 Å²	84.8	32%	0.324	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119	-179.2	-63.5	-107.8	0	0	0	110.7	D963 L964 K965 Y966 Q1026	D963-H1053 VanDerWaalsContact CB-NE2 3.26Å; D963-H1053 WeakPolarHBondContact CB-NE2 3.45Å; D963-H1053 IonicContact OD1-CD2 3.3Å; D963-H1053 CovalentContact OD1-NE2 1.8Å; D963-H1053 IonicContact OD1-NE2 3.48Å; D963-H1053 PolarHBondContact OD1-NE2 3.16Å; D963-H1053 IonicContact OD2-NE2 2.68Å; L964-H1053 PolarHBondContact O-CD2 3.35Å; L964-H1053 PolarHBondContact O-N 3.28Å; K965-H1053 CarbonylContact C-O 3.54Å; K965-H1053 WeakPolarHBondContact CA-O 3.37Å; K965-H1053 HydrophobicContact CG-CB 4.25Å; Y966-H1053 PolarHBondContact N-O 3.39Å; Q1026-H1053 PolarHBondContact NE2-CE1 3.09Å; Q1026-H1053 PolarHBondContact NE2-NE2 2.97Å; Q1026-H1053 PolarHBondContact OE1-CE1 2.76Å
1054	I	75.9	Confident	63.8	Low	4 Å²	4	87.6 Å²	87.6	2%	0.021	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.2	-179.1	-64.4	155.4	0	0	0	109.5	Y966 I968 F1005 P1022 P1023 V1024 G1025 Y1027	Y966-I1054 HydrophobicContact CD1-CG1 4.21Å; Y966-I1054 HydrophobicContact CD1-CG2 4.31Å; Y966-I1054 HydrophobicContact CG-CG1 4.47Å; Y966-I1054 CarbonylContact O-C 3.43Å; Y966-I1054 WeakPolarHBondContact O-CA 3.48Å; I968-I1054 HydrophobicContact CD1-CG2 3.58Å; I968-I1054 HydrophobicContact CG1-CG2 3.56Å; F1005-I1054 HydrophobicContact CZ-CD1 4.39Å; P1022-I1054 HydrophobicContact CB-CD1 3.68Å; P1022-I1054 HydrophobicContact CG-CD1 3.69Å; P1022-I1054 HydrophobicContact CG-CG1 4.33Å; P1023-I1054 VanDerWaalsContact O-CD1 3.3Å; P1023-I1054 WeakPolarHBondContact O-CD1 3.41Å; V1024-I1054 WeakPolarHBondContact CG1-O 3.49Å; G1025-I1054 PolarHBondContact N-O 2.81Å; G1025-I1054 PolarHBondContact O-N 2.76Å; Y1027-I1054 HydrophobicContact CD2-CD1 3.77Å; Y1027-I1054 HydrophobicContact CE2-CD1 3.7Å
1055	V	71.2	Confident	61.3	Low	28 Å²	28	94.6 Å²	94.6	17%	0.17	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	171.2	-166.4	-62.1	0	0	0	0	114.4	K965 Y966 N967 I968	K965-V1055 HydrophobicContact CD-CG2 4.15Å; K965-V1055 HydrophobicContact CG-CG2 4.48Å; Y966-V1055 WeakPolarHBondContact O-CG2 3.4Å; Y966-V1055 PolarHBondContact O-N 3.22Å; N967-V1055 PolarHBondContact OD1-O 2.87Å; I968-V1055 PolarHBondContact N-O 2.96Å
1056	N	61.6	Low	58.7	Low	90 Å²	90	93.2 Å²	93.2	48%	0.481	48%	0.479	S	S	.	.			trans	-156.3	106.7	-176.6	-173.1	-6.5	0	0	0	110.3	N969	N969-N1056 VanDerWaalsContact CG-OD1 3.31Å; N969-N1056 PolarHBondContact ND2-OD1 2.88Å
1057	E	57.9	Low	56.2	Low	121 Å²	121	96 Å²	96	57%	0.565	50%	0.499	S	S	*	.			trans	-140.2	153.3	-164.6	-67.5	170.7	152	0	0	113	K965	K965-E1057 IonicContact NZ-OE1 3.78Å; K965-E1057 PolarHBondContact NZ-OE1 3.09Å; K965-E1057 VanDerWaalsContact NZ-OE1 3.12Å; K965-E1057 IonicContact NZ-OE2 3.42Å; K965-E1057 PolarHBondContact NZ-OE2 3.15Å
1058	Q	40	Very low	53.7	Low	183 Å²	183	94 Å²	94	86%	0.855	50%	0.501	S	S	*	.			trans	-136	118	171.8	-86	-164.4	-27.7	0	0	113.4
1059	V	36.1	Very low	50.9	Low	133 Å²	133	100.6 Å²	100.6	81%	0.806	54%	0.536	S	S	*	.			trans	65.1	139.7	150.6	-172.9	0	0	0	0	120.8
1060	S	32.3	Very low	48.5	Very low	92 Å²	92	108.3 Å²	108.3	64%	0.643	57%	0.567	S	S	*	*			trans	71.3	105.1	165.3	48.4	0	0	0	0	119.2
1061	T	32.4	Very low	45.8	Very low	124 Å²	124	114.7 Å²	114.7	76%	0.761	60%	0.602	S	S	*	*				63.3	135.3	66.1	71.9	0	0	0	0	113.9
1062	I	34	Very low	43.5	Very low	136 Å²	136	117.8 Å²	117.8	70%	0.697	62%	0.623	S	S	*	*			cis	-164.1	175.4	9.1	-128.5	167.5	0	0	0	112.7
1063	E	32.1	Very low	41.2	Very low	180 Å²	180	123.5 Å²	123.5	84%	0.841	65%	0.653	S	S	*	*			trans	80.5	153.8	157.6	-98.9	150.1	-128.3	0	0	122.7
1064	S	29.7	Very low	39.2	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	68%	0.678	S	S	*	*			trans	-140.6	166.6	-173.2	59.1	0	0	0	0	109.9
1065	Q	33.1	Very low	37	Very low	198 Å²	198	135.7 Å²	135.7	93%	0.925	71%	0.713	S	S	*	*			trans	-118	110.2	172.5	-73.5	-169.4	-13.3	0	0	111.5
1066	T	29.3	Very low	35	Very low	130 Å²	130	139.8 Å²	139.8	80%	0.798	74%	0.742	S	S	*	*			trans	-90.9	136.7	156.8	38.7	0	0	0	0	109.1
1067	N	33.2	Very low	34	Very low	138 Å²	138	141 Å²	141	74%	0.738	76%	0.755	S	S	*	*			trans	-162.3	143.9	165.1	-124.3	-33	0	0	0	114.9
1068	L	31.7	Very low	32.9	Very low	134 Å²	134	140.6 Å²	140.6	70%	0.702	76%	0.763	S	S	*	*			trans	62.5	125.7	161.7	-56.6	159.7	0	0	0	117.9
1069	L	27.9	Very low	32.6	Very low	145 Å²	145	138.6 Å²	138.6	76%	0.759	76%	0.763	S	S	*	*			cis	101.3	142.6	22.1	-77.7	158.2	0	0	0	116
1070	K	31.3	Very low	32.3	Very low	175 Å²	175	137.8 Å²	137.8	76%	0.761	76%	0.763	S	S	*	*			trans	91.8	111.4	161.5	-68.8	162.3	-177.8	178.1	0	118.5
1071	N	28.3	Very low	32.1	Very low	135 Å²	135	136.7 Å²	136.7	72%	0.722	77%	0.766	S	S	*	*			trans	12.5	143.1	132.2	-46.2	31.9	0	0	0	118.6
1072	I	33.7	Very low	32.1	Very low	153 Å²	153	138.1 Å²	138.1	79%	0.785	77%	0.769	S	S	*	*				-155.2	134.4	117.8	-100.5	149.5	0	0	0	108.4	F1074	I1072-F1074 HydrophobicContact CG2-CD2 4.29Å; I1072-F1074 HydrophobicContact CG2-CE2 4.5Å
1073	D	33.7	Very low	32.2	Very low	120 Å²	120	137.7 Å²	137.7	64%	0.642	77%	0.773	S	S	*	*			trans	-78.3	-173.3	175.6	-49.3	-82.2	0	0	0	111.2
1074	F	37.1	Very low	32.3	Very low	193 Å²	193	138 Å²	138	85%	0.846	77%	0.774	S	S	*	*				-167.1	98.9	113.2	-105.1	-66	0	0	0	111.9	I1072	I1072-F1074 HydrophobicContact CG2-CD2 4.29Å; I1072-F1074 HydrophobicContact CG2-CE2 4.5Å
1075	D	31	Very low	32.7	Very low	138 Å²	138	138.5 Å²	138.5	74%	0.738	78%	0.775	S	S	*	*			trans	-57.8	156.9	153.2	-77	-54.3	0	0	0	111.2
1076	S	29.3	Very low	32.7	Very low	114 Å²	114	134.5 Å²	134.5	80%	0.797	76%	0.764	S	S	*	*				-163.8	144.3	119.8	-83.7	0	0	0	0	113.6
1077	P	39.3	Very low	32.8	Very low	116 Å²	116	135.1 Å²	135.1	75%	0.753	76%	0.756	S	S	*	*			trans	-100.1	-141	174.2	31	-9	0	0	0	107.6
1078	P	35.1	Very low	32.8	Very low	111 Å²	111	138.3 Å²	138.3	72%	0.721	76%	0.758	S	S	*	*			cis	-141.6	-152.8	-4.6	39	-14.8	0	0	0	114.9
1079	V	33.9	Very low	32.8	Very low	141 Å²	141	137.2 Å²	137.2	86%	0.855	75%	0.752	S	S	*	*			trans	96.4	137.3	165.5	-164.9	0	0	0	0	116.2
1080	S	29.5	Very low	33	Very low	116 Å²	116	138.6 Å²	138.6	81%	0.811	76%	0.755	S	S	*	*			trans	-127	155.1	-158.8	53	0	0	0	0	112.9
1081	G	28.8	Very low	33.2	Very low	69 Å²	69	134.7 Å²	134.7	71%	0.711	75%	0.747	S	S	*	*			trans	160.4	99.2	164.5	0	0	0	0	0	115.2
1082	D	32.8	Very low	33.4	Very low	155 Å²	155	134.2 Å²	134.2	83%	0.829	75%	0.749	S	S	*	*			trans	55.2	121	149.7	-53.7	-21.1	0	0	0	123
1083	T	35.3	Very low	33.4	Very low	127 Å²	127	136.2 Å²	136.2	78%	0.779	75%	0.746	S	S	*	*			trans	70.2	75.8	140.5	57.1	0	0	0	0	123
1084	H	35.2	Very low	33.6	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.866	75%	0.749	S	S	*	*			trans	47.1	129.6	139.5	-69	-82	0	0	0	124.2
1085	P	37.6	Very low	33.5	Very low	114 Å²	114	134 Å²	134	74%	0.74	74%	0.743	S	S	*	*			trans	-86.7	-171	174	39.5	-38.3	0	0	0	113.7
1086	T	33.5	Very low	33.7	Very low	114 Å²	114	130.4 Å²	130.4	70%	0.699	74%	0.738	S	S	*	*			cis	-161.4	166	26.6	-15	0	0	0	0	108.3
1087	K	30.2	Very low	34	Very low	143 Å²	143	133.1 Å²	133.1	62%	0.622	74%	0.736	S	S	*	*			cis	73.3	136.8	24.2	-120.5	174.2	170.9	179.3	0	114.7
1088	W	34.2	Very low	33.8	Very low	204 Å²	204	133 Å²	133	77%	0.773	73%	0.729	S	S	*	*			cis	-150.3	-172.1	25.8	-69	84.3	0	0	0	112.7
1089	L	31.2	Very low	33.9	Very low	111 Å²	111	137 Å²	137	58%	0.581	74%	0.735	S	S	*	*				-167.6	71.4	-62.4	-142.9	-179.9	0	0	0	115.3
1090	Q	31.5	Very low	33.6	Very low	175 Å²	175	139 Å²	139	82%	0.818	73%	0.732	S	S	*	*			trans	65.9	-169.6	154.7	-111.8	-178.3	34.6	0	0	118.3
1091	P	35.6	Very low	33.7	Very low	93 Å²	93	138.8 Å²	138.8	60%	0.604	72%	0.722	S	S	*	*			cis	-140.3	-172.4	-14.6	23.8	2.8	0	0	0	117.3
1092	V	33.1	Very low	33.7	Very low	125 Å²	125	143 Å²	143	76%	0.758	73%	0.727	S	S	*	*			trans	118.1	139.8	137.4	-176.8	0	0	0	0	117.7
1093	R	34	Very low	33.4	Very low	194 Å²	194	140.4 Å²	140.4	73%	0.732	71%	0.713	S	S	*	*			cis	-179.2	167.5	-40.8	-166.6	-178.5	-88	177.5	-6.1	108
1094	L	36.9	Very low	33.2	Very low	134 Å²	134	143.2 Å²	143.2	70%	0.702	72%	0.715	S	S	*	*			trans	90	135.5	156.9	-51.4	171.7	0	0	0	115.6
1095	N	35.5	Very low	32.8	Very low	132 Å²	132	139.4 Å²	139.4	71%	0.706	70%	0.698	S	S	*	*			cis	-159.1	145.2	-25.1	-113.6	3.2	0	0	0	105.3
1096	G	35.5	Very low	32.6	Very low	63 Å²	63	139.3 Å²	139.3	65%	0.649	69%	0.686	S	S	*	*			cis	117.9	137	49	0	0	0	0	0	105.7
1097	K	34.8	Very low	32.8	Very low	172 Å²	172	143.4 Å²	143.4	75%	0.748	69%	0.688	S	S	*	*				177.8	163.3	66	-81.1	-171.6	151.6	-150.7	0	108.3
1098	D	36.5	Very low	33.1	Very low	114 Å²	114	147 Å²	147	61%	0.61	70%	0.699	S	S	*	*			cis	-151.2	127.7	-21.7	-87	-33.3	0	0	0	103.3
1099	K	37.4	Very low	33.4	Very low	193 Å²	193	141.9 Å²	141.9	84%	0.839	69%	0.693	S	S	*	*				49.2	95.8	79.6	-81.7	-163.7	171.1	-169.2	0	115
1100	K	27.5	Very low	33.5	Very low	183 Å²	183	144.9 Å²	144.9	80%	0.796	70%	0.701	S	S	*	*			trans	-150	145.5	143.2	-75.2	-160.8	159.6	-70.5	0	109.2
1101	D	30	Very low	33.7	Very low	113 Å²	113	143.5 Å²	143.5	60%	0.604	70%	0.698	S	S	*	*			cis	-152.8	156.2	-21.5	-105.2	-22.5	0	0	0	108.8
1102	L	29.8	Very low	33.6	Very low	156 Å²	156	145.4 Å²	145.4	82%	0.817	70%	0.702	S	S	*	*			trans	-66.5	171.7	158.2	-119	67.2	0	0	0	109.2
1103	D	27	Very low	33.8	Very low	101 Å²	101	144.9 Å²	144.9	54%	0.54	70%	0.701	S	S	.	*			trans	154.8	94.7	141.1	-80	-4.9	0	0	0	108.6	K1106	D1103-K1106 VanDerWaalsContact CG-N 3.25Å; D1103-K1106 PolarHBondContact OD2-N 3.24Å
1104	F	29.7	Very low	33.8	Very low	186 Å²	186	140.1 Å²	140.1	82%	0.816	70%	0.697	S	S	*	*	S	Bend		-40.3	92	92.7	-156.4	-82.7	0	0	0	113.8
1105	E	28.1	Very low	33.7	Very low	108 Å²	108	139.4 Å²	139.4	51%	0.505	70%	0.698	S	S	.	*	S	Bend	trans	61.3	113	166	-58	-166.3	131	0	0	117.6
1106	K	33.5	Very low	33.6	Very low	111 Å²	111	139.4 Å²	139.4	48%	0.483	70%	0.699	S	S	.	*			cis	-178.7	134.3	32.8	-103.3	150.2	-167.3	146.9	0	111.8	D1103	D1103-K1106 VanDerWaalsContact CG-N 3.25Å; D1103-K1106 PolarHBondContact OD2-N 3.24Å
1107	R	36.3	Very low	33.5	Very low	200 Å²	200	143.5 Å²	143.5	76%	0.755	71%	0.706	S	S	*	*			trans	79.8	104.7	142.3	-57.4	160.5	-178.7	174.7	-1.8	120.7
1108	Y	37	Very low	33.3	Very low	218 Å²	218	140 Å²	140	86%	0.855	71%	0.709	S	S	*	*				64	166.9	121.5	-71	-65.5	0	0	0	120.9
1109	P	40.2	Very low	33.1	Very low	98 Å²	98	144.2 Å²	144.2	64%	0.636	72%	0.718	S	S	*	*			cis	-130.6	167.3	-6.6	20	4.2	0	0	0	117.1
1110	K	34.3	Very low	32.6	Very low	173 Å²	173	142.7 Å²	142.7	75%	0.752	71%	0.713	S	S	*	*			trans	69.1	134.5	148.2	-75.4	165	-176.6	179.9	0	117.8
1111	I	34.2	Very low	32.6	Very low	147 Å²	147	139.1 Å²	139.1	75%	0.754	71%	0.712	S	S	*	*			cis	-144	126.9	1.4	-82.5	132.9	0	0	0	105.6
1112	I	35.4	Very low	32.5	Very low	133 Å²	133	143.6 Å²	143.6	68%	0.682	72%	0.721	S	S	*	*			cis	84.4	133.9	45.5	-64.3	169	0	0	0	112.7
1113	P	35.7	Very low	32.3	Very low	114 Å²	114	144.1 Å²	144.1	74%	0.74	72%	0.72	S	S	*	*			cis	-103	-148.5	-5.6	35.1	-17.6	0	0	0	110.6
1114	S	34.8	Very low	32.2	Very low	93 Å²	93	144.3 Å²	144.3	65%	0.65	73%	0.729	S	S	*	*			cis	-159.5	124.4	-0.8	14.2	0	0	0	0	107.9
1115	T	34.9	Very low	32	Very low	119 Å²	119	141.6 Å²	141.6	73%	0.73	73%	0.728	S	S	*	*				67.3	133.5	81.2	63.4	0	0	0	0	118.1
1116	N	32.8	Very low	32.1	Very low	133 Å²	133	141.4 Å²	141.4	71%	0.711	74%	0.738	S	S	*	*			cis	-175.8	133	-25.1	-107	-8.3	0	0	0	108.3
1117	N	32.8	Very low	31.9	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	75%	0.753	S	S	*	*				64.8	116.6	86.1	-81.2	-19.7	0	0	0	118.5
1118	A	32.5	Very low	31.6	Very low	98 Å²	98	140 Å²	140	81%	0.81	76%	0.755	S	S	*	*			trans	164.9	155.3	147	0	0	0	0	0	112.5
1119	Y	31.1	Very low	31.2	Very low	203 Å²	203	136.8 Å²	136.8	80%	0.796	75%	0.753	S	S	*	*			cis	-160.6	155.9	-32.8	-131.9	-92.2	0	0	0	109.3
1120	Q	28.2	Very low	30.8	Very low	160 Å²	160	137 Å²	137	75%	0.748	75%	0.745	S	S	*	*			trans	-7.4	152.6	171.5	-64.5	170.6	-38.5	0	0	124.4
1121	S	25.9	Very low	30.6	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	74%	0.735	S	S	*	*				117.9	129	126.2	71.4	0	0	0	0	122
1122	Y	28.1	Very low	30.4	Very low	206 Å²	206	132.4 Å²	132.4	81%	0.808	73%	0.731	S	S	*	*			trans	50	115.6	146.6	-82	-101.4	0	0	0	124.4
1123	Q	25.8	Very low	30.2	Very low	167 Å²	167	133.9 Å²	133.9	78%	0.78	74%	0.736	S	S	*	*			trans	68.1	140	134.6	-78.8	-178.3	-31.2	0	0	123.7
1124	S	24.6	Very low	30.2	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	75%	0.746	S	S	*	*			trans	87	125.6	148.5	68.3	0	0	0	0	121.9
1125	T	26.2	Very low	30.2	Very low	129 Å²	129	147.2 Å²	147.2	79%	0.791	76%	0.758	S	S	*	*			trans	68.1	121.7	145.9	45.3	0	0	0	0	123.2
1126	S	29.2	Very low	30.3	Very low	103 Å²	103	144 Å²	144	72%	0.72	75%	0.749	S	S	*	*			trans	79.1	113.8	130.3	65.8	0	0	0	0	123.7
1127	V	30.2	Very low	30.6	Very low	132 Å²	132	145.1 Å²	145.1	80%	0.8	75%	0.754	S	S	*	*				84.5	113.4	120.1	172.8	0	0	0	0	121.1
1128	L	30.6	Very low	31.4	Very low	151 Å²	151	142.1 Å²	142.1	79%	0.791	75%	0.745	S	S	*	*			trans	58.4	113.4	148.1	-91.4	78.4	0	0	0	124
1129	D	28.6	Very low	32	Very low	150 Å²	150	140.8 Å²	140.8	80%	0.802	73%	0.727	S	S	*	*				83.6	169.5	114.3	-138.8	-4.6	0	0	0	123.2
1130	E	30.5	Very low	33.2	Very low	103 Å²	103	137.1 Å²	137.1	48%	0.481	72%	0.72	S	S	.	*			trans	75	71.7	174.8	-62.4	-140.5	154.3	0	0	120.9	S1479	E1130-S1479 PolarHBondContact OE2-OG 3.2Å
1131	S	29.8	Very low	34.5	Very low	78 Å²	78	132.6 Å²	132.6	55%	0.545	71%	0.71	S	S	.	*				53.9	147.2	117.9	86.9	0	0	0	0	124.9	Q1478	S1131-Q1478 PolarHBondContact O-NE2 2.84Å
1132	Q	30.5	Very low	36.2	Very low	144 Å²	144	132.3 Å²	132.3	67%	0.673	70%	0.699	S	S	*	*			trans	90.5	123.7	156.5	-63.6	-152.1	1.2	0	0	122.2
1133	Q	31.3	Very low	38	Very low	165 Å²	165	126.2 Å²	126.2	77%	0.771	68%	0.683	S	S	*	*			trans	60.1	101.7	146	-63.4	-173.5	12.3	0	0	121
1134	R	35.8	Very low	40.1	Very low	255 Å²	255	121 Å²	121	96%	0.962	67%	0.668	S	S	*	*				-160.4	62	112.7	-106.2	173.9	-158.9	-151.6	5.6	113.5
1135	Y	34.5	Very low	42.3	Very low	231 Å²	231	118.2 Å²	118.2	91%	0.906	65%	0.652	S	S	*	*			trans	-81.7	125.2	157.9	-80.5	-96.2	0	0	0	108.8
1136	G	37.9	Very low	44.5	Very low	52 Å²	52	117.3 Å²	117.3	54%	0.536	64%	0.641	S	S	.	*			trans	-179.5	92.5	179.9	0	0	0	0	0	114.7
1137	L	39.5	Very low	46.9	Very low	157 Å²	157	117.9 Å²	117.9	82%	0.822	64%	0.635	S	S	*	*	S	Bend	trans	-166.1	-31	155.4	-110.6	159.1	0	0	0	112.1
1138	S	49	Very low	49.1	Very low	85 Å²	85	115 Å²	115	59%	0.594	62%	0.62	S	S	*	*	S	Bend	trans	-81.3	-36.8	172.7	52.3	0	0	0	0	113.7	I1140 A1141 I1142	S1138-I1140 VanDerWaalsContact C-N 3.33Å; S1138-I1140 PolarHBondContact O-N 2.98Å; S1138-A1141 PolarHBondContact O-N 3.15Å; S1138-I1142 PolarHBondContact O-N 2.88Å
1139	T	45.5	Very low	51.4	Low	70 Å²	70	111.6 Å²	111.6	43%	0.429	61%	0.606	S	S	.	*	H	α-helix	trans	-64.8	-31.3	-176	42.1	0	0	0	0	113.9	I1142 V1143	T1139-I1142 PolarHBondContact O-N 2.75Å; T1139-V1143 WeakPolarHBondContact O-CB 3.39Å; T1139-V1143 VanDerWaalsContact O-CG2 3.3Å; T1139-V1143 WeakPolarHBondContact O-CG2 3.31Å; T1139-V1143 PolarHBondContact O-N 3.03Å
1140	I	55.5	Low	53.6	Low	126 Å²	126	107.1 Å²	107.1	65%	0.646	59%	0.59	S	S	*	*	H	α-helix	trans	-67.6	-37.8	179.1	-61.6	176.9	0	0	0	111	S1138 A1144	S1138-I1140 VanDerWaalsContact C-N 3.33Å; S1138-I1140 PolarHBondContact O-N 2.98Å; I1140-A1144 VanDerWaalsContact O-CB 3.22Å; I1140-A1144 WeakPolarHBondContact O-CB 3.25Å; I1140-A1144 PolarHBondContact O-N 3.23Å
1141	A	55.7	Low	55.9	Low	66 Å²	66	103.6 Å²	103.6	55%	0.545	58%	0.582	S	S	.	*	H	α-helix	trans	-67.2	-42.8	175.9	0	0	0	0	0	111.9	S1138 A1144 A1145	S1138-A1141 PolarHBondContact O-N 3.15Å; A1141-A1144 PolarHBondContact O-N 3.44Å; A1141-A1145 WeakPolarHBondContact O-CB 3.41Å; A1141-A1145 PolarHBondContact O-N 2.86Å
1142	I	61.6	Low	58.3	Low	103 Å²	103	105 Å²	105	53%	0.528	58%	0.582	S	S	.	*	H	α-helix	trans	-67.7	-42.3	178.5	-63	169.9	0	0	0	110.9	S1138 T1139 A1145 L1146	S1138-I1142 PolarHBondContact O-N 2.88Å; T1139-I1142 PolarHBondContact O-N 2.75Å; I1142-A1145 PolarHBondContact O-N 2.82Å; I1142-L1146 HydrophobicContact CG2-CD1 3.98Å; I1142-L1146 HydrophobicContact CG2-CG 4.43Å; I1142-L1146 WeakPolarHBondContact O-CB 3.33Å; I1142-L1146 WeakPolarHBondContact O-CG 3.22Å; I1142-L1146 PolarHBondContact O-N 2.77Å
1143	V	65.6	Low	60.5	Low	78 Å²	78	102.9 Å²	102.9	47%	0.473	58%	0.575	S	S	.	*	H	α-helix	trans	-67.3	-37.9	175.6	171.1	0	0	0	0	111.4	T1139 L1146 I1147	T1139-V1143 WeakPolarHBondContact O-CB 3.39Å; T1139-V1143 VanDerWaalsContact O-CG2 3.3Å; T1139-V1143 WeakPolarHBondContact O-CG2 3.31Å; T1139-V1143 PolarHBondContact O-N 3.03Å; V1143-L1146 PolarHBondContact O-N 2.04Å; V1143-I1147 HydrophobicContact CG1-CD1 3.68Å; V1143-I1147 HydrophobicContact CG1-CG1 4.3Å; V1143-I1147 WeakPolarHBondContact O-CB 3.38Å; V1143-I1147 VanDerWaalsContact O-CG1 3.22Å; V1143-I1147 WeakPolarHBondContact O-CG1 3.37Å; V1143-I1147 PolarHBondContact O-N 3.36Å
1144	A	71	Confident	62.7	Low	56 Å²	56	98.3 Å²	98.3	46%	0.463	56%	0.561	S	S	.	*	H	α-helix	trans	-63.4	-40.6	172.8	0	0	0	0	0	112.2	I1140 A1141 I1147 S1148	I1140-A1144 VanDerWaalsContact O-CB 3.22Å; I1140-A1144 WeakPolarHBondContact O-CB 3.25Å; I1140-A1144 PolarHBondContact O-N 3.23Å; A1141-A1144 PolarHBondContact O-N 3.44Å; A1144-I1147 PolarHBondContact O-N 3.11Å; A1144-S1148 WeakPolarHBondContact O-CB 3.47Å; A1144-S1148 PolarHBondContact O-N 2.82Å; A1144-S1148 PolarHBondContact O-OG 3.46Å
1145	A	70.3	Confident	64.9	Low	49 Å²	49	92 Å²	92	41%	0.405	55%	0.545	S	S	.	.	H	α-helix	trans	-66.9	-41.9	175.1	0	0	0	0	0	112.5	A1141 I1142 S1148 V1149	A1141-A1145 WeakPolarHBondContact O-CB 3.41Å; A1141-A1145 PolarHBondContact O-N 2.86Å; I1142-A1145 PolarHBondContact O-N 2.82Å; A1145-S1148 WeakPolarHBondContact CA-OG 3.07Å; A1145-S1148 PolarHBondContact O-N 3.18Å; A1145-S1148 PolarHBondContact O-OG 2.82Å; A1145-V1149 WeakPolarHBondContact O-CB 3.07Å; A1145-V1149 VanDerWaalsContact O-CG2 3.29Å; A1145-V1149 WeakPolarHBondContact O-CG2 3.42Å; A1145-V1149 PolarHBondContact O-N 2.78Å
1146	L	72.6	Confident	66.9	Low	110 Å²	110	86 Å²	86	58%	0.576	53%	0.528	S	S	*	.	H	α-helix	trans	-67.9	-36.1	175.7	-71.9	172.1	0	0	0	112	I1142 V1143 A1150	I1142-L1146 HydrophobicContact CG2-CD1 3.98Å; I1142-L1146 HydrophobicContact CG2-CG 4.43Å; I1142-L1146 WeakPolarHBondContact O-CB 3.33Å; I1142-L1146 WeakPolarHBondContact O-CG 3.22Å; I1142-L1146 PolarHBondContact O-N 2.77Å; V1143-L1146 PolarHBondContact O-N 2.04Å; L1146-A1150 WeakPolarHBondContact O-CB 3.43Å; L1146-A1150 PolarHBondContact O-N 3.39Å
1147	I	78.7	Confident	68.7	Low	115 Å²	115	88.8 Å²	88.8	59%	0.59	53%	0.53	S	S	*	.	H	α-helix	trans	-68.4	-37.9	171.9	-70.5	169.7	0	0	0	110.9	V1143 A1144 G1151	V1143-I1147 HydrophobicContact CG1-CD1 3.68Å; V1143-I1147 HydrophobicContact CG1-CG1 4.3Å; V1143-I1147 WeakPolarHBondContact O-CB 3.38Å; V1143-I1147 VanDerWaalsContact O-CG1 3.22Å; V1143-I1147 WeakPolarHBondContact O-CG1 3.37Å; V1143-I1147 PolarHBondContact O-N 3.36Å; A1144-I1147 PolarHBondContact O-N 3.11Å; I1147-G1151 WeakPolarHBondContact O-CA 3.43Å; I1147-G1151 PolarHBondContact O-N 2.66Å
1148	S	76.3	Confident	70.6	Confident	70 Å²	70	85.2 Å²	85.2	49%	0.49	51%	0.511	S	S	.	.	H	α-helix	trans	-69.5	-39	175.6	70.4	0	0	0	0	112.1	A1144 A1145 G1151 L1152	A1144-S1148 WeakPolarHBondContact O-CB 3.47Å; A1144-S1148 PolarHBondContact O-N 2.82Å; A1144-S1148 PolarHBondContact O-OG 3.46Å; A1145-S1148 WeakPolarHBondContact CA-OG 3.07Å; A1145-S1148 PolarHBondContact O-N 3.18Å; A1145-S1148 PolarHBondContact O-OG 2.82Å; S1148-G1151 PolarHBondContact O-N 3.44Å; S1148-L1152 WeakPolarHBondContact O-CB 3.41Å; S1148-L1152 PolarHBondContact O-N 2.78Å
1149	V	78.3	Confident	71.8	Confident	80 Å²	80	82.9 Å²	82.9	49%	0.485	50%	0.5	S	S	.	.	H	α-helix	trans	-69	-43.1	175.4	169.4	0	0	0	0	111.3	A1145 G1151 L1152 L1153	A1145-V1149 WeakPolarHBondContact O-CB 3.07Å; A1145-V1149 VanDerWaalsContact O-CG2 3.29Å; A1145-V1149 WeakPolarHBondContact O-CG2 3.42Å; A1145-V1149 PolarHBondContact O-N 2.78Å; V1149-G1151 VanDerWaalsContact C-N 3.31Å; V1149-G1151 PolarHBondContact O-N 3.13Å; V1149-L1152 PolarHBondContact O-N 2.97Å; V1149-L1153 HydrophobicContact CG1-CD1 4.21Å; V1149-L1153 WeakPolarHBondContact O-CB 3.13Å; V1149-L1153 PolarHBondContact O-N 3.13Å
1150	A	75.9	Confident	73.1	Confident	56 Å²	56	82.9 Å²	82.9	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-64.9	-35.8	172.8	0	0	0	0	0	111.8	L1146 C1154	L1146-A1150 WeakPolarHBondContact O-CB 3.43Å; L1146-A1150 PolarHBondContact O-N 3.39Å; A1150-C1154 WeakPolarHBondContact O-CB 3.48Å; A1150-C1154 PolarHBondContact O-N 3.45Å
1151	G	79.2	Confident	73.9	Confident	30 Å²	30	80.9 Å²	80.9	31%	0.309	49%	0.494	S	S	.	.	H	α-helix	trans	-65.3	-41.2	171.8	0	0	0	0	0	112.6	I1147 S1148 V1149 C1154 L1155	I1147-G1151 WeakPolarHBondContact O-CA 3.43Å; I1147-G1151 PolarHBondContact O-N 2.66Å; S1148-G1151 PolarHBondContact O-N 3.44Å; V1149-G1151 VanDerWaalsContact C-N 3.31Å; V1149-G1151 PolarHBondContact O-N 3.13Å; G1151-C1154 PolarHBondContact O-N 2.8Å; G1151-L1155 WeakPolarHBondContact O-CB 3.45Å; G1151-L1155 VanDerWaalsContact O-CG 3.31Å; G1151-L1155 WeakPolarHBondContact O-CG 3.47Å; G1151-L1155 PolarHBondContact O-N 2.78Å
1152	L	79.7	Confident	74.5	Confident	107 Å²	107	81.7 Å²	81.7	56%	0.56	49%	0.488	S	S	*	.	H	α-helix	trans	-68	-41.7	174.6	-114.7	159.9	0	0	0	112	S1148 V1149 L1155 L1156	S1148-L1152 WeakPolarHBondContact O-CB 3.41Å; S1148-L1152 PolarHBondContact O-N 2.78Å; V1149-L1152 PolarHBondContact O-N 2.97Å; L1152-L1155 PolarHBondContact O-N 3.34Å; L1152-L1156 HydrophobicContact CD2-CD1 4.39Å; L1152-L1156 VanDerWaalsContact O-CB 3.29Å; L1152-L1156 WeakPolarHBondContact O-CB 3.44Å; L1152-L1156 VanDerWaalsContact O-CG 3.25Å; L1152-L1156 WeakPolarHBondContact O-CG 3.46Å; L1152-L1156 PolarHBondContact O-N 2.87Å
1153	L	76.9	Confident	74.5	Confident	100 Å²	100	78.8 Å²	78.8	52%	0.524	48%	0.479	S	S	.	.	H	α-helix	trans	-63.7	-39.7	171.7	-91.5	160.8	0	0	0	111.8	V1149 L1156 L1157	V1149-L1153 HydrophobicContact CG1-CD1 4.21Å; V1149-L1153 WeakPolarHBondContact O-CB 3.13Å; V1149-L1153 PolarHBondContact O-N 3.13Å; L1153-L1156 PolarHBondContact O-N 2.94Å; L1153-L1157 VanDerWaalsContact O-CB 3.3Å; L1153-L1157 WeakPolarHBondContact O-CB 3.31Å; L1153-L1157 VanDerWaalsContact O-CG 3.23Å; L1153-L1157 WeakPolarHBondContact O-CG 3.5Å; L1153-L1157 PolarHBondContact O-N 3.26Å
1154	C	78.2	Confident	74.3	Confident	69 Å²	69	81.8 Å²	81.8	47%	0.466	49%	0.49	S	S	.	.	H	α-helix	trans	-68.4	-39.7	175.6	-166	0	0	0	0	111.4	A1150 G1151 L1157 I1158	A1150-C1154 WeakPolarHBondContact O-CB 3.48Å; A1150-C1154 PolarHBondContact O-N 3.45Å; G1151-C1154 PolarHBondContact O-N 2.8Å; C1154-L1157 PolarHBondContact O-N 3.2Å; C1154-I1158 VanDerWaalsContact O-CB 3.26Å; C1154-I1158 WeakPolarHBondContact O-CB 3.44Å; C1154-I1158 WeakPolarHBondContact O-CD1 3.48Å; C1154-I1158 WeakPolarHBondContact O-CG1 3.26Å; C1154-I1158 PolarHBondContact O-N 2.98Å
1155	L	80.7	Confident	73.1	Confident	122 Å²	122	87.6 Å²	87.6	64%	0.639	51%	0.505	S	S	*	.	H	α-helix	trans	-69.5	-31.8	173.2	-75	170.8	0	0	0	112.9	G1151 L1152 G1159	G1151-L1155 WeakPolarHBondContact O-CB 3.45Å; G1151-L1155 VanDerWaalsContact O-CG 3.31Å; G1151-L1155 WeakPolarHBondContact O-CG 3.47Å; G1151-L1155 PolarHBondContact O-N 2.78Å; L1152-L1155 PolarHBondContact O-N 3.34Å; L1155-G1159 WeakPolarHBondContact O-CA 3.11Å; L1155-G1159 PolarHBondContact O-N 2.77Å
1156	L	77.3	Confident	71.8	Confident	105 Å²	105	95 Å²	95	55%	0.55	52%	0.522	S	S	.	.	H	α-helix	trans	-72	-39.9	171.4	-77.5	167.4	0	0	0	111.4	L1152 L1153 G1159 V1160	L1152-L1156 HydrophobicContact CD2-CD1 4.39Å; L1152-L1156 VanDerWaalsContact O-CB 3.29Å; L1152-L1156 WeakPolarHBondContact O-CB 3.44Å; L1152-L1156 VanDerWaalsContact O-CG 3.25Å; L1152-L1156 WeakPolarHBondContact O-CG 3.46Å; L1152-L1156 PolarHBondContact O-N 2.87Å; L1153-L1156 PolarHBondContact O-N 2.94Å; L1156-G1159 CarbonylContact O-C 3.55Å; L1156-G1159 WeakPolarHBondContact O-CA 3.32Å; L1156-G1159 PolarHBondContact O-N 2.89Å; L1156-V1160 WeakPolarHBondContact O-CB 3.44Å; L1156-V1160 VanDerWaalsContact O-CG2 3.3Å; L1156-V1160 WeakPolarHBondContact O-CG2 3.29Å; L1156-V1160 PolarHBondContact O-N 3.33Å
1157	L	75.5	Confident	70.3	Confident	110 Å²	110	96.1 Å²	96.1	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-69.1	-40	174.5	-74.3	168.2	0	0	0	111.7	L1153 C1154 G1159 V1160 V1161	L1153-L1157 VanDerWaalsContact O-CB 3.3Å; L1153-L1157 WeakPolarHBondContact O-CB 3.31Å; L1153-L1157 VanDerWaalsContact O-CG 3.23Å; L1153-L1157 WeakPolarHBondContact O-CG 3.5Å; L1153-L1157 PolarHBondContact O-N 3.26Å; C1154-L1157 PolarHBondContact O-N 3.2Å; L1157-G1159 VanDerWaalsContact C-N 3.31Å; L1157-V1160 PolarHBondContact O-N 3.11Å; L1157-V1161 WeakPolarHBondContact O-CB 3.24Å; L1157-V1161 VanDerWaalsContact O-CG2 3.26Å; L1157-V1161 WeakPolarHBondContact O-CG2 3.38Å; L1157-V1161 PolarHBondContact O-N 3.2Å
1158	I	78.7	Confident	68.3	Low	83 Å²	83	96.1 Å²	96.1	43%	0.426	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-38.7	169.6	-71.3	165.4	0	0	0	110	C1154 V1161 I1162	C1154-I1158 VanDerWaalsContact O-CB 3.26Å; C1154-I1158 WeakPolarHBondContact O-CB 3.44Å; C1154-I1158 WeakPolarHBondContact O-CD1 3.48Å; C1154-I1158 WeakPolarHBondContact O-CG1 3.26Å; C1154-I1158 PolarHBondContact O-N 2.98Å; I1158-V1161 PolarHBondContact O-N 3.48Å; I1158-I1162 HydrophobicContact CG2-CD1 3.64Å; I1158-I1162 HydrophobicContact CG2-CG1 4.29Å; I1158-I1162 VanDerWaalsContact O-CB 3.26Å; I1158-I1162 WeakPolarHBondContact O-CB 3.45Å; I1158-I1162 WeakPolarHBondContact O-CG1 3.26Å; I1158-I1162 PolarHBondContact O-N 2.8Å
1159	G	74.8	Confident	66.4	Low	35 Å²	35	97.8 Å²	97.8	36%	0.361	54%	0.541	S	S	.	.	H	α-helix	trans	-61.8	-43.6	173.3	0	0	0	0	0	112.7	L1155 L1156 L1157 I1162 A1163	L1155-G1159 WeakPolarHBondContact O-CA 3.11Å; L1155-G1159 PolarHBondContact O-N 2.77Å; L1156-G1159 CarbonylContact O-C 3.55Å; L1156-G1159 WeakPolarHBondContact O-CA 3.32Å; L1156-G1159 PolarHBondContact O-N 2.89Å; L1157-G1159 VanDerWaalsContact C-N 3.31Å; G1159-I1162 PolarHBondContact O-N 3.34Å; G1159-A1163 VanDerWaalsContact O-CB 3.26Å; G1159-A1163 WeakPolarHBondContact O-CB 3.31Å; G1159-A1163 PolarHBondContact O-N 3.02Å
1160	V	73.5	Confident	64.1	Low	71 Å²	71	105.6 Å²	105.6	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-68.3	-40.5	174.8	167.6	0	0	0	0	111.1	L1156 L1157 A1163 M1164	L1156-V1160 WeakPolarHBondContact O-CB 3.44Å; L1156-V1160 VanDerWaalsContact O-CG2 3.3Å; L1156-V1160 WeakPolarHBondContact O-CG2 3.29Å; L1156-V1160 PolarHBondContact O-N 3.33Å; L1157-V1160 PolarHBondContact O-N 3.11Å; V1160-A1163 PolarHBondContact O-N 2.83Å; V1160-M1164 HydrophobicContact CG1-CE 3.96Å; V1160-M1164 HydrophobicContact CG1-CG 4.4Å; V1160-M1164 HydrophobicContact CG1-SD 3.85Å; V1160-M1164 VanDerWaalsContact O-CB 3.31Å; V1160-M1164 WeakPolarHBondContact O-CB 3.33Å; V1160-M1164 VanDerWaalsContact O-CG 3.29Å; V1160-M1164 WeakPolarHBondContact O-CG 3.29Å; V1160-M1164 PolarHBondContact O-N 2.89Å
1161	V	71.6	Confident	62.1	Low	84 Å²	84	109 Å²	109	51%	0.509	58%	0.577	S	S	.	*	H	α-helix	trans	-68.6	-35.5	175.3	168.3	0	0	0	0	111.7	L1157 I1158 K1165	L1157-V1161 WeakPolarHBondContact O-CB 3.24Å; L1157-V1161 VanDerWaalsContact O-CG2 3.26Å; L1157-V1161 WeakPolarHBondContact O-CG2 3.38Å; L1157-V1161 PolarHBondContact O-N 3.2Å; I1158-V1161 PolarHBondContact O-N 3.48Å; V1161-K1165 VanDerWaalsContact O-CB 3.29Å; V1161-K1165 WeakPolarHBondContact O-CB 3.18Å; V1161-K1165 PolarHBondContact O-N 3.33Å
1162	I	69	Low	59.9	Low	83 Å²	83	116.1 Å²	116.1	43%	0.426	60%	0.602	S	S	.	*	H	α-helix	trans	-71.6	-37	172.7	-72.1	171	0	0	0	110.8	I1158 G1159 K1165 R1166	I1158-I1162 HydrophobicContact CG2-CD1 3.64Å; I1158-I1162 HydrophobicContact CG2-CG1 4.29Å; I1158-I1162 VanDerWaalsContact O-CB 3.26Å; I1158-I1162 WeakPolarHBondContact O-CB 3.45Å; I1158-I1162 WeakPolarHBondContact O-CG1 3.26Å; I1158-I1162 PolarHBondContact O-N 2.8Å; G1159-I1162 PolarHBondContact O-N 3.34Å; I1162-K1165 CarbonylContact O-C 3.54Å; I1162-K1165 PolarHBondContact O-N 3.29Å; I1162-R1166 VanDerWaalsContact O-CB 3.27Å; I1162-R1166 WeakPolarHBondContact O-CB 3.4Å; I1162-R1166 VanDerWaalsContact O-CG 3.27Å; I1162-R1166 WeakPolarHBondContact O-CG 3.33Å; I1162-R1166 PolarHBondContact O-N 3.01Å
1163	A	60.1	Low	57.7	Low	42 Å²	42	119 Å²	119	35%	0.347	62%	0.618	S	S	.	*	H	α-helix	trans	-65.6	-48	173.1	0	0	0	0	0	111.1	G1159 V1160 K1165 R1166 I1167	G1159-A1163 VanDerWaalsContact O-CB 3.26Å; G1159-A1163 WeakPolarHBondContact O-CB 3.31Å; G1159-A1163 PolarHBondContact O-N 3.02Å; V1160-A1163 PolarHBondContact O-N 2.83Å; A1163-K1165 VanDerWaalsContact C-N 3.26Å; A1163-K1165 PolarHBondContact O-N 3.48Å; A1163-R1166 CarbonylContact O-C 3.55Å; A1163-R1166 WeakPolarHBondContact O-CA 3.35Å; A1163-R1166 PolarHBondContact O-N 3.32Å; A1163-I1167 VanDerWaalsContact O-CG1 3.31Å; A1163-I1167 WeakPolarHBondContact O-CG1 3.41Å; A1163-I1167 PolarHBondContact O-N 2.9Å
1164	M	62.2	Low	55.6	Low	141 Å²	141	123.1 Å²	123.1	70%	0.695	64%	0.635	S	S	*	*	H	α-helix	trans	-65.3	-26.5	175.3	-71.2	177.1	169.5	0	0	112.7	V1160	V1160-M1164 HydrophobicContact CG1-CE 3.96Å; V1160-M1164 HydrophobicContact CG1-CG 4.4Å; V1160-M1164 HydrophobicContact CG1-SD 3.85Å; V1160-M1164 VanDerWaalsContact O-CB 3.31Å; V1160-M1164 WeakPolarHBondContact O-CB 3.33Å; V1160-M1164 VanDerWaalsContact O-CG 3.29Å; V1160-M1164 WeakPolarHBondContact O-CG 3.29Å; V1160-M1164 PolarHBondContact O-N 2.89Å
1165	K	46.4	Very low	53.5	Low	178 Å²	178	126.7 Å²	126.7	77%	0.774	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	4.5	167.1	-78	-169.1	167.9	-175.2	0	115	V1161 I1162 A1163	V1161-K1165 VanDerWaalsContact O-CB 3.29Å; V1161-K1165 WeakPolarHBondContact O-CB 3.18Å; V1161-K1165 PolarHBondContact O-N 3.33Å; I1162-K1165 CarbonylContact O-C 3.54Å; I1162-K1165 PolarHBondContact O-N 3.29Å; A1163-K1165 VanDerWaalsContact C-N 3.26Å; A1163-K1165 PolarHBondContact O-N 3.48Å
1166	R	43	Very low	51.3	Low	205 Å²	205	126.2 Å²	126.2	77%	0.774	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	-6.4	174.2	-74.8	-178.3	171.9	-170	-3.1	114	I1162 A1163 V1168	I1162-R1166 VanDerWaalsContact O-CB 3.27Å; I1162-R1166 WeakPolarHBondContact O-CB 3.4Å; I1162-R1166 VanDerWaalsContact O-CG 3.27Å; I1162-R1166 WeakPolarHBondContact O-CG 3.33Å; I1162-R1166 PolarHBondContact O-N 3.01Å; A1163-R1166 CarbonylContact O-C 3.55Å; A1163-R1166 WeakPolarHBondContact O-CA 3.35Å; A1163-R1166 PolarHBondContact O-N 3.32Å; R1166-V1168 VanDerWaalsContact C-N 3.34Å; R1166-V1168 PolarHBondContact O-N 2.83Å
1167	I	40.4	Very low	49.2	Very low	132 Å²	132	127.8 Å²	127.8	68%	0.677	67%	0.672	S	S	*	*			trans	-94	72.1	168.9	-59.5	162.2	0	0	0	108	A1163	A1163-I1167 VanDerWaalsContact O-CG1 3.31Å; A1163-I1167 WeakPolarHBondContact O-CG1 3.41Å; A1163-I1167 PolarHBondContact O-N 2.9Å
1168	V	36.4	Very low	47.5	Very low	115 Å²	115	128.1 Å²	128.1	70%	0.697	68%	0.681	S	S	*	*	S	Bend	trans	-118.8	120.9	155.7	176.3	0	0	0	0	105.4	R1166 R1170	R1166-V1168 VanDerWaalsContact C-N 3.34Å; R1166-V1168 PolarHBondContact O-N 2.83Å; V1168-R1170 PolarHBondContact O-N 3.44Å
1169	P	35.8	Very low	45.1	Very low	105 Å²	105	132.5 Å²	132.5	68%	0.682	70%	0.704	S	S	*	*			trans	-66	103.4	-175.6	-21.4	33.3	0	0	0	112.2	T1171	P1169-T1171 VanDerWaalsContact C-N 3.28Å; P1169-T1171 HydrophobicContact CB-CG2 4.2Å; P1169-T1171 PolarHBondContact O-N 3.43Å; P1169-T1171 VanDerWaalsContact O-N 3.16Å
1170	R	30.4	Very low	43.2	Very low	245 Å²	245	140.3 Å²	140.3	93%	0.925	73%	0.731	S	S	*	*			trans	-81.3	77.2	160.5	-88.1	-170.3	167.9	-165.6	-4.2	109.3	V1168 H1172	V1168-R1170 PolarHBondContact O-N 3.44Å; R1170-H1172 PolarHBondContact O-N 3.41Å
1171	T	34.9	Very low	41.3	Very low	126 Å²	126	145.8 Å²	145.8	77%	0.773	75%	0.749	S	S	*	*			trans	-92.1	73.9	173.2	48.7	0	0	0	0	111.1	P1169	P1169-T1171 VanDerWaalsContact C-N 3.28Å; P1169-T1171 HydrophobicContact CB-CG2 4.2Å; P1169-T1171 PolarHBondContact O-N 3.43Å; P1169-T1171 VanDerWaalsContact O-N 3.16Å
1172	H	32.1	Very low	39.4	Very low	181 Å²	181	148.3 Å²	148.3	84%	0.838	76%	0.76	S	S	*	*			trans	-93.7	120	151.2	-97.3	-86.4	0	0	0	107.8	R1170	R1170-H1172 PolarHBondContact O-N 3.41Å
1173	N	34.7	Very low	37.7	Very low	168 Å²	168	149.6 Å²	149.6	90%	0.898	77%	0.767	S	S	*	*			trans	-158.5	121.2	156.9	-98.7	-27.3	0	0	0	108.3
1174	E	32.2	Very low	36.5	Very low	186 Å²	186	153.1 Å²	153.1	87%	0.869	78%	0.781	S	S	*	*			trans	-76.9	147.6	168.8	-52.5	167.2	128.8	0	0	109.3
1175	V	34.9	Very low	35	Very low	144 Å²	144	154.4 Å²	154.4	87%	0.873	78%	0.782	S	S	*	*			trans	-171.5	147	154.7	129.7	0	0	0	0	108.4
1176	P	34.5	Very low	34.4	Very low	112 Å²	112	152.2 Å²	152.2	73%	0.727	78%	0.775	S	S	*	*				-111.8	168.1	-129.6	39.7	-36.4	0	0	0	117	P1178	P1176-P1178 WeakPolarHBondContact O-CD 3.46Å
1177	V	32.9	Very low	34	Very low	137 Å²	137	148.5 Å²	148.5	83%	0.83	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-71	125.5	174.6	180	0	0	0	0	111.8
1178	P	38.7	Very low	33.6	Very low	118 Å²	118	147.3 Å²	147.3	77%	0.766	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-79.5	133.6	170	-11.3	28.5	0	0	0	112.2	P1176	P1176-P1178 WeakPolarHBondContact O-CD 3.46Å
1179	L	28.8	Very low	33.5	Very low	174 Å²	174	151.4 Å²	151.4	91%	0.911	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-78.1	125	169.5	-77.6	160.3	0	0	0	111.3
1180	Q	34	Very low	33.4	Very low	200 Å²	200	152.1 Å²	152.1	94%	0.935	78%	0.78	S	S	*	*			trans	-148	165.4	144.6	-119.8	172.6	16	0	0	112.9
1181	K	33.8	Very low	33.5	Very low	186 Å²	186	144 Å²	144	81%	0.809	77%	0.772	S	S	*	*			trans	-112.6	148	-154.7	-81.3	-176.3	177.8	-179.4	0	113
1182	N	32.6	Very low	33.3	Very low	136 Å²	136	146.7 Å²	146.7	73%	0.727	78%	0.78	S	S	*	*			trans	67.8	151.8	146.9	-66.9	31.6	0	0	0	116.3
1183	N	33.2	Very low	33.3	Very low	110 Å²	110	142.6 Å²	142.6	59%	0.588	77%	0.772	S	S	*	*			cis	-153.1	161.8	1.4	-127.4	33	0	0	0	111.5
1184	D	34.2	Very low	33.1	Very low	117 Å²	117	141.2 Å²	141.2	63%	0.626	77%	0.77	S	S	*	*			trans	61.2	123.3	145.6	-58.4	-24.9	0	0	0	122.9
1185	K	32.3	Very low	33	Very low	167 Å²	167	142.7 Å²	142.7	73%	0.726	77%	0.767	S	S	*	*			trans	75.5	151.7	141.3	-65.6	166.4	170.5	-109.8	0	118.3
1186	E	33.8	Very low	32.8	Very low	133 Å²	133	142.6 Å²	142.6	62%	0.621	76%	0.762	S	S	*	*			cis	-158	141.4	-4.2	-124.5	153.3	-154.5	0	0	110.2
1187	T	32.8	Very low	32.6	Very low	126 Å²	126	145.3 Å²	145.3	77%	0.773	77%	0.767	S	S	*	*			trans	56.7	147.9	152	51.2	0	0	0	0	121.2
1188	D	33.6	Very low	32.4	Very low	107 Å²	107	144.1 Å²	144.1	57%	0.572	76%	0.76	S	S	*	*			cis	-151.6	171.2	-5.4	-141.2	-14.5	0	0	0	113
1189	R	33.6	Very low	32	Very low	202 Å²	202	143.2 Å²	143.2	76%	0.762	76%	0.757	S	S	*	*			trans	-16.7	156.4	158.1	-66.3	152.5	-172.9	127.4	-5.9	118.1
1190	S	33.8	Very low	32.1	Very low	119 Å²	119	146 Å²	146	83%	0.832	76%	0.757	S	S	*	*			cis	-176.7	161	-0.9	44.3	0	0	0	0	107.8
1191	G	31.7	Very low	32.2	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	75%	0.749	S	S	*	*			cis	139.6	134.9	2.3	0	0	0	0	0	111.4
1192	I	31.6	Very low	32	Very low	183 Å²	183	138.2 Å²	138.2	94%	0.938	75%	0.745	S	S	*	*			trans	-143.3	144.8	159.2	-95.1	163.6	0	0	0	106.5
1193	S	32.1	Very low	32.2	Very low	95 Å²	95	137 Å²	137	66%	0.664	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-100.8	129.7	-158	55.1	0	0	0	0	115.3
1194	V	30.5	Very low	32.1	Very low	140 Å²	140	140 Å²	140	85%	0.848	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-83.7	129	156.9	179.4	0	0	0	0	108.7
1195	W	30.7	Very low	31.9	Very low	217 Å²	217	143.9 Å²	143.9	82%	0.822	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-78.4	122	170.4	-83	72.8	0	0	0	109.9
1196	N	29.4	Very low	31.9	Very low	142 Å²	142	142.2 Å²	142.2	76%	0.759	77%	0.766	S	S	*	*			trans	-118.4	91.9	176.9	-166.5	4.9	0	0	0	109.1
1197	M	29.8	Very low	32	Very low	169 Å²	169	142 Å²	142	83%	0.833	77%	0.769	S	S	*	*			trans	-87.5	111.5	171.2	-78	-172.8	69.7	0	0	109.3
1198	T	30.3	Very low	32.4	Very low	111 Å²	111	140.1 Å²	140.1	68%	0.681	75%	0.754	S	S	*	*			trans	-74.9	168.3	-179.3	49.7	0	0	0	0	113.2
1199	S	29.7	Very low	32.4	Very low	100 Å²	100	143.1 Å²	143.1	70%	0.699	77%	0.766	S	S	*	*			trans	65.7	87.6	164.3	64.1	0	0	0	0	118.1
1200	Y	30.1	Very low	32.7	Very low	233 Å²	233	142.4 Å²	142.4	91%	0.914	77%	0.772	S	S	*	*				-134.2	140.3	111.9	-89.3	-77.9	0	0	0	109.3
1201	P	36.3	Very low	33.5	Very low	118 Å²	118	141.3 Å²	141.3	77%	0.766	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-87	122.3	-175.8	32.4	-32.5	0	0	0	112.5
1202	S	30	Very low	33.6	Very low	103 Å²	103	141.1 Å²	141.1	72%	0.72	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-79.6	129.3	167.8	52.3	0	0	0	0	111.2	E1204	S1202-E1204 PolarHBondContact O-N 3.22Å
1203	P	35.6	Very low	33.9	Very low	110 Å²	110	140.3 Å²	140.3	71%	0.714	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-71.8	119.9	170.7	-15.6	30.5	0	0	0	111.2
1204	E	31.3	Very low	34.2	Very low	174 Å²	174	142.2 Å²	142.2	81%	0.813	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-77.5	127.6	170.2	-63.9	-178.4	133.6	0	0	110.5	S1202 T1206	S1202-E1204 PolarHBondContact O-N 3.22Å; E1204-T1206 PolarHBondContact O-N 3.47Å
1205	Y	30.7	Very low	34.5	Very low	198 Å²	198	141.8 Å²	141.8	78%	0.776	74%	0.741	S	S	*	*			trans	-88.2	92.2	169.7	-75.8	-83.3	0	0	0	110.2
1206	T	33.1	Very low	34.6	Very low	133 Å²	133	138.7 Å²	138.7	82%	0.816	74%	0.735	S	S	*	*			trans	-76	134.6	168	33.6	0	0	0	0	110.9	E1204	E1204-T1206 PolarHBondContact O-N 3.47Å
1207	L	35.3	Very low	34.7	Very low	129 Å²	129	140 Å²	140	68%	0.675	74%	0.737	S	S	*	*			trans	-102.2	110.3	-178.1	-165.6	92.7	0	0	0	110.3	M1209	L1207-M1209 HydrophobicContact CD2-CG 4.39Å; L1207-M1209 PolarHBondContact O-N 3.33Å
1208	D	40.1	Very low	34.9	Very low	85 Å²	85	140.3 Å²	140.3	46%	0.455	74%	0.736	S	S	.	*			trans	-67.8	117	169.3	169.5	29.6	0	0	0	110.6	E1210 T1211 G1212	D1208-E1210 PolarHBondContact OD1-N 3.33Å; D1208-T1211 WeakPolarHBondContact OD2-CB 3.42Å; D1208-T1211 WeakPolarHBondContact OD2-CG2 3.39Å; D1208-T1211 PolarHBondContact OD2-N 2.77Å; D1208-T1211 PolarHBondContact OD2-OG1 2.62Å; D1208-G1212 PolarHBondContact O-N 3.39Å
1209	M	33.5	Very low	35	Very low	170 Å²	170	143 Å²	143	84%	0.837	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-2.8	-178	-75.4	-166.1	-78.8	0	0	114.5	L1207	L1207-M1209 HydrophobicContact CD2-CG 4.39Å; L1207-M1209 PolarHBondContact O-N 3.33Å
1210	E	40.4	Very low	35	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-25.8	173.2	-68	-155.3	134.7	0	0	113.9	D1208	D1208-E1210 PolarHBondContact OD1-N 3.33Å
1211	T	51.3	Low	35	Very low	96 Å²	96	141.7 Å²	141.7	59%	0.589	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.4	-18.2	-173.5	69.8	0	0	0	0	116.5	D1208 K1213	D1208-T1211 WeakPolarHBondContact OD2-CB 3.42Å; D1208-T1211 WeakPolarHBondContact OD2-CG2 3.39Å; D1208-T1211 PolarHBondContact OD2-N 2.77Å; D1208-T1211 PolarHBondContact OD2-OG1 2.62Å; T1211-K1213 VanDerWaalsContact C-N 3.25Å; T1211-K1213 PolarHBondContact O-N 3.24Å
1212	G	34.5	Very low	34.9	Very low	70 Å²	70	141.6 Å²	141.6	72%	0.722	74%	0.744	S	S	*	*			trans	62.7	23.7	171.9	0	0	0	0	0	115.6	D1208	D1208-G1212 PolarHBondContact O-N 3.39Å
1213	K	38.1	Very low	34.8	Very low	165 Å²	165	141.5 Å²	141.5	72%	0.717	75%	0.749	S	S	*	*			trans	-118.8	127.9	177.4	-84.7	-174.8	172.5	-179.5	0	112.1	T1211	T1211-K1213 VanDerWaalsContact C-N 3.25Å; T1211-K1213 PolarHBondContact O-N 3.24Å
1214	I	36.7	Very low	34.6	Very low	135 Å²	135	139.6 Å²	139.6	69%	0.692	75%	0.75	S	S	*	*			trans	-79	136.6	164.5	-58.6	172.4	0	0	0	108.2
1215	I	37.1	Very low	34.5	Very low	131 Å²	131	139 Å²	139	67%	0.672	74%	0.744	S	S	*	*			trans	-128.3	109.2	176.9	-56.7	178.9	0	0	0	108.7
1216	E	33.3	Very low	34.5	Very low	152 Å²	152	138.4 Å²	138.4	71%	0.71	74%	0.742	S	S	*	*			trans	-78.9	132.3	170.8	-65.9	-179.7	141.2	0	0	110.6
1217	H	31.7	Very low	34.5	Very low	170 Å²	170	137.2 Å²	137.2	79%	0.787	74%	0.736	S	S	*	*			trans	-110.9	84.1	177.6	-108.9	-85.8	0	0	0	111.7
1218	H	33.8	Very low	34.1	Very low	175 Å²	175	137.7 Å²	137.7	81%	0.81	74%	0.739	S	S	*	*			trans	-78.7	123.3	168.2	-86	-41.7	0	0	0	112.4
1219	L	32.2	Very low	33.7	Very low	167 Å²	167	141.9 Å²	141.9	87%	0.874	76%	0.756	S	S	*	*			trans	-109.9	121.8	147.7	-63.9	166.5	0	0	0	104.5
1220	G	29.2	Very low	33.4	Very low	68 Å²	68	138 Å²	138	70%	0.701	75%	0.746	S	S	*	*			cis	99.7	129	27.4	0	0	0	0	0	108.2
1221	R	30.9	Very low	32.8	Very low	239 Å²	239	133.4 Å²	133.4	90%	0.902	73%	0.734	S	S	*	*			cis	-162.3	-166	21.4	-71.1	173.6	167.8	173.9	-3	108.1
1222	P	33.7	Very low	31.6	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	74%	0.743	S	S	*	*			cis	-120	138.8	-30.1	21.4	-0.9	0	0	0	111.8
1223	A	28.7	Very low	31.2	Very low	100 Å²	100	141.8 Å²	141.8	83%	0.826	75%	0.75	S	S	*	*				77	97.9	61.9	0	0	0	0	0	116.4
1224	G	31	Very low	30.6	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	74%	0.742	S	S	*	*			trans	-162.5	97	158.8	0	0	0	0	0	110.1
1225	K	29.9	Very low	30.1	Very low	162 Å²	162	141 Å²	141	70%	0.704	75%	0.752	S	S	*	*				60.3	121.8	78	-71.7	-175.2	165.7	-156.7	0	112.3
1226	Y	30.2	Very low	29.5	Very low	185 Å²	185	137.5 Å²	137.5	73%	0.725	75%	0.748	S	S	*	*			cis	-145.7	-157.5	5	-82.3	-71.8	0	0	0	109.4
1227	P	33.1	Very low	29.1	Very low	107 Å²	107	135.6 Å²	135.6	70%	0.695	75%	0.751	S	S	*	*				-129.6	-177.5	-91.8	42.3	-24.4	0	0	0	115.4
1228	N	28	Very low	28.9	Very low	139 Å²	139	134.3 Å²	134.3	74%	0.743	75%	0.75	S	S	*	*			trans	-6.8	132.2	159.1	-51.5	-2	0	0	0	119.1
1229	H	31	Very low	28.5	Very low	173 Å²	173	130.7 Å²	130.7	80%	0.801	75%	0.745	S	S	*	*				166.8	107.3	118.2	-92.8	-70.9	0	0	0	108.2
1230	S	26.3	Very low	28.3	Very low	89 Å²	89	126.5 Å²	126.5	62%	0.622	73%	0.734	S	S	*	*				89.7	144.2	65.8	73.9	0	0	0	0	114.1
1231	S	27.6	Very low	28.2	Very low	91 Å²	91	129.3 Å²	129.3	64%	0.636	73%	0.733	S	S	*	*			trans	59.8	102.1	166.9	63.4	0	0	0	0	118.5
1232	D	26.2	Very low	28.1	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	73%	0.725	S	S	*	*				55.7	152.8	113.5	-51.4	-48.2	0	0	0	122.2
1233	K	26.2	Very low	27.8	Very low	196 Å²	196	127.1 Å²	127.1	85%	0.852	73%	0.726	S	S	*	*			trans	83.3	140.2	164.3	-57.4	174.5	-171.9	172.2	0	115.6
1234	S	26.4	Very low	27.9	Very low	80 Å²	80	128.2 Å²	128.2	56%	0.559	73%	0.727	S	S	*	*			cis	-175.2	151.9	-13.5	48.7	0	0	0	0	110.2
1235	F	25.2	Very low	28	Very low	203 Å²	203	132.7 Å²	132.7	89%	0.89	73%	0.728	S	S	*	*			trans	63.4	137.2	174.8	-54.7	-79.7	0	0	0	113.8
1236	G	25.2	Very low	28.3	Very low	58 Å²	58	130.6 Å²	130.6	60%	0.598	73%	0.731	S	S	*	*			cis	114.7	146.6	10	0	0	0	0	0	110.1
1237	S	25.5	Very low	28.4	Very low	111 Å²	111	125 Å²	125	78%	0.776	72%	0.719	S	S	*	*			trans	58.5	133.8	-173	32.4	0	0	0	0	114.1
1238	D	26.2	Very low	28.5	Very low	144 Å²	144	129.2 Å²	129.2	77%	0.77	72%	0.723	S	S	*	*			cis	-164.6	158.6	28.7	-127	-30.9	0	0	0	114.4
1239	S	26.4	Very low	28.6	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	72%	0.724	S	S	*	*			trans	64.2	151.6	144	77.4	0	0	0	0	122.8
1240	A	27.1	Very low	28.6	Very low	78 Å²	78	125.9 Å²	125.9	65%	0.645	72%	0.717	S	S	*	*			trans	69	147.9	140.8	0	0	0	0	0	120.4
1241	N	27.3	Very low	28.8	Very low	128 Å²	128	127.6 Å²	127.6	68%	0.684	72%	0.724	S	S	*	*			cis	-168.2	166.7	-18.5	-102.7	-18.1	0	0	0	108.7
1242	H	29.9	Very low	29.1	Very low	160 Å²	160	128.5 Å²	128.5	74%	0.741	73%	0.726	S	S	*	*			trans	71.5	148.4	162.1	-51.4	-51.7	0	0	0	117
1243	L	27.4	Very low	29.5	Very low	148 Å²	148	129.7 Å²	129.7	78%	0.775	73%	0.727	S	S	*	*			cis	-160.2	174.7	-14.5	-116.7	168.5	0	0	0	110.7
1244	C	30	Very low	30	Very low	123 Å²	123	125.1 Å²	125.1	83%	0.831	72%	0.717	S	S	*	*			trans	93.3	125.2	166.2	-62.4	0	0	0	0	119.8
1245	H	33.3	Very low	30.3	Very low	166 Å²	166	128.4 Å²	128.4	77%	0.769	73%	0.727	S	S	*	*			trans	-78.5	174.3	176.9	-111.9	-133.4	0	0	0	112.4
1246	P	35.1	Very low	30.5	Very low	118 Å²	118	124.7 Å²	124.7	77%	0.766	72%	0.717	S	S	*	*			cis	-135.1	-163.7	17.8	32.7	-9.5	0	0	0	115.2
1247	S	33	Very low	30.7	Very low	68 Å²	68	128.4 Å²	128.4	48%	0.476	72%	0.721	S	S	.	*				-170.6	179.5	-66.3	63.1	0	0	0	0	111.5
1248	Y	36.3	Very low	31	Very low	195 Å²	195	128.7 Å²	128.7	77%	0.765	72%	0.723	S	S	*	*			trans	76.6	98.4	-177.8	-63.3	-79.7	0	0	0	116.1
1249	L	30	Very low	31.1	Very low	148 Å²	148	126.2 Å²	126.2	78%	0.775	72%	0.723	S	S	*	*				83.6	141.8	70.6	-92	76.9	0	0	0	112.3
1250	S	30.2	Very low	31.1	Very low	94 Å²	94	130.8 Å²	130.8	66%	0.657	73%	0.734	S	S	*	*			cis	-178.3	155.8	-2	43.7	0	0	0	0	107.5
1251	T	30.9	Very low	31.1	Very low	124 Å²	124	138.1 Å²	138.1	76%	0.761	75%	0.745	S	S	*	*			cis	-168.8	-178.5	-4.1	24.2	0	0	0	0	105.6
1252	T	33.6	Very low	31.1	Very low	110 Å²	110	142.4 Å²	142.4	68%	0.675	76%	0.757	S	S	*	*			cis	-163.6	133	10.2	5.7	0	0	0	0	106
1253	H	33.5	Very low	31	Very low	173 Å²	173	139.6 Å²	139.6	80%	0.801	76%	0.756	S	S	*	*				66.1	147.1	94.9	-82.4	-40.7	0	0	0	118.4
1254	P	38	Very low	31.3	Very low	100 Å²	100	137.7 Å²	137.7	65%	0.649	75%	0.752	S	S	*	*			cis	-145.6	-155.8	-49.3	36.5	-14	0	0	0	113.3
1255	L	32.2	Very low	31.1	Very low	149 Å²	149	138.1 Å²	138.1	78%	0.78	75%	0.751	S	S	*	*			trans	97.1	133.4	163.4	-57	174.9	0	0	0	117.3
1256	D	30.2	Very low	31	Very low	125 Å²	125	134.9 Å²	134.9	67%	0.668	75%	0.747	S	S	*	*			cis	-163.7	169.6	-23.2	-148.8	-11.6	0	0	0	111.5
1257	I	28.7	Very low	30.6	Very low	135 Å²	135	137.3 Å²	137.3	69%	0.692	75%	0.752	S	S	*	*			trans	54.1	108.8	158.7	-63.1	152.9	0	0	0	115.8
1258	S	31.6	Very low	30.3	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	76%	0.761	S	S	*	*				-176.7	161.6	68.9	34.5	0	0	0	0	111.8
1259	A	28.2	Very low	29.9	Very low	92 Å²	92	133.7 Å²	133.7	76%	0.76	76%	0.755	S	S	*	*			trans	-145.8	148.6	172.8	0	0	0	0	0	111.1
1260	Q	26.9	Very low	29.7	Very low	196 Å²	196	132.2 Å²	132.2	92%	0.916	75%	0.747	S	S	*	*				179	168.3	124.3	-97.3	176.1	17	0	0	112.8
1261	R	26.6	Very low	29.7	Very low	232 Å²	232	133.7 Å²	133.7	88%	0.875	74%	0.739	S	S	*	*			trans	-83.6	151.8	-174.1	-51.2	165.8	179.3	167.5	-3.6	111.5
1262	F	27.1	Very low	29.6	Very low	218 Å²	218	130.1 Å²	130.1	96%	0.956	73%	0.726	S	S	*	*			trans	-161.5	160.7	140	-97.3	-65	0	0	0	111.7
1263	S	28.1	Very low	29.5	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	72%	0.721	S	S	*	*			trans	-134.5	-177.3	170.1	64.7	0	0	0	0	107.4
1264	P	34.5	Very low	29.3	Very low	107 Å²	107	124.5 Å²	124.5	70%	0.695	71%	0.708	S	S	*	*			cis	-128.6	-152.2	-20.5	25.4	-0.3	0	0	0	111
1265	V	25.4	Very low	28.9	Very low	133 Å²	133	125.8 Å²	125.8	81%	0.806	70%	0.703	S	S	*	*			trans	84.1	149.3	157.1	-170	0	0	0	0	118.3
1266	S	30.2	Very low	28.7	Very low	98 Å²	98	125.5 Å²	125.5	69%	0.685	69%	0.692	S	S	*	*			trans	-83.9	153.5	-180	50.1	0	0	0	0	114.3
1267	I	26.8	Very low	28.6	Very low	169 Å²	169	124.7 Å²	124.7	87%	0.867	69%	0.686	S	S	*	*			trans	-176	166.9	135.9	-97.8	156.6	0	0	0	109.5
1268	S	26.7	Very low	28.6	Very low	96 Å²	96	124.7 Å²	124.7	67%	0.671	69%	0.693	S	S	*	*			trans	-86.6	158.2	-166.8	53	0	0	0	0	117
1269	S	27.8	Very low	28.4	Very low	90 Å²	90	123.6 Å²	123.6	63%	0.629	67%	0.674	S	S	*	*			trans	79.9	155.1	145.8	73.9	0	0	0	0	121.3
1270	L	27.4	Very low	28.4	Very low	118 Å²	118	125 Å²	125	62%	0.618	68%	0.675	S	S	*	*			trans	68.6	91.9	158.3	-72.2	156.3	0	0	0	120.9
1271	Y	30.2	Very low	28.4	Very low	125 Å²	125	123.9 Å²	123.9	49%	0.49	68%	0.675	S	S	.	*				71.1	139.8	122.6	-106.9	-137	0	0	0	123.9	L1458 L1459 H1460	Y1271-L1458 HydrophobicContact CD2-CD2 4.09Å; Y1271-L1458 WeakPolarHBondContact CE2-O 3.13Å; Y1271-L1458 VanDerWaalsContact CZ-O 3.26Å; Y1271-L1458 PolarHBondContact OH-O 2.7Å; Y1271-L1459 HydrophobicContact CD2-CB 4.34Å; Y1271-L1459 HydrophobicContact CE2-CB 3.93Å; Y1271-L1459 PolarHBondContact OH-O 3.41Å; Y1271-H1460 HydrophobicContact CD2-CB 4.18Å; Y1271-H1460 AromaticContact CD2-CD2 3.53Å; Y1271-H1460 HydrophobicContact CE2-CB 3.47Å; Y1271-H1460 VanDerWaalsContact CE2-CB 3.47Å; Y1271-H1460 AromaticContact CE2-CD2 3.65Å; Y1271-H1460 AromaticContact CE2-CG 3.97Å; Y1271-H1460 PolarHBondContact OH-O 3.11Å
1272	G	28.7	Very low	28.4	Very low	48 Å²	48	121.1 Å²	121.1	50%	0.495	67%	0.669	S	S	.	*			trans	173.7	81.6	171.3	0	0	0	0	0	113.6
1273	S	31.4	Very low	28.7	Very low	80 Å²	80	117.8 Å²	117.8	56%	0.559	66%	0.66	S	S	*	*			trans	-83	138.3	176.1	60.5	0	0	0	0	113.2
1274	V	29.2	Very low	28.8	Very low	86 Å²	86	118.6 Å²	118.6	52%	0.521	66%	0.663	S	S	.	*			trans	-122	170.4	148.8	-177.9	0	0	0	0	106.2	F1455 N1456	V1274-F1455 VanDerWaalsContact C-CB 3.41Å; V1274-F1455 HydrophobicContact CB-CB 4.01Å; V1274-F1455 HydrophobicContact CB-CD1 3.87Å; V1274-F1455 HydrophobicContact CB-CG 4.03Å; V1274-F1455 HydrophobicContact CG1-CB 3.91Å; V1274-F1455 HydrophobicContact CG1-CD1 4.2Å; V1274-F1455 HydrophobicContact CG1-CD2 4.28Å; V1274-F1455 HydrophobicContact CG1-CG 3.91Å; V1274-F1455 CarbonylContact O-C 3.59Å; V1274-N1456 CarbonylContact O-C 3.58Å; V1274-N1456 WeakPolarHBondContact O-CA 2.89Å; V1274-N1456 WeakPolarHBondContact O-CB 3.44Å; V1274-N1456 PolarHBondContact O-N 3.18Å; V1274-N1456 VanDerWaalsContact O-O 3.08Å
1275	K	28.9	Very low	28.4	Very low	126 Å²	126	119.6 Å²	119.6	55%	0.548	67%	0.667	S	S	.	*			trans	-147.6	149.7	-167.4	-173.9	-179.4	177.9	-167.8	0	112.8	N1454 F1455	K1275-N1454 CarbonylContact C-O 3.45Å; K1275-N1454 VanDerWaalsContact C-O 3.26Å; K1275-F1455 WeakPolarHBondContact CA-O 3.32Å
1276	Y	28.7	Very low	28.5	Very low	143 Å²	143	118.7 Å²	118.7	56%	0.561	66%	0.662	S	S	*	*			trans	151.1	166.6	142.8	-88.7	-70.5	0	0	0	121.3	A1453 N1454 F1455	Y1276-A1453 CarbonylContact C-O 3.53Å; Y1276-A1453 VanDerWaalsContact C-O 3.22Å; Y1276-A1453 WeakPolarHBondContact CB-O 3.07Å; Y1276-A1453 CarbonylContact O-C 3.6Å; Y1276-N1454 PolarHBondContact N-O 3.17Å; Y1276-N1454 VanDerWaalsContact N-O 3.12Å; Y1276-N1454 CarbonylContact O-C 3.59Å; Y1276-N1454 WeakPolarHBondContact O-CA 3.44Å; Y1276-N1454 PolarHBondContact O-N 3.13Å; Y1276-N1454 VanDerWaalsContact O-N 3.15Å; Y1276-F1455 PolarHBondContact N-O 2.9Å; Y1276-F1455 PolarHBondContact O-N 3.18Å
1277	M	28.3	Very low	28.4	Very low	109 Å²	109	122.8 Å²	122.8	54%	0.537	67%	0.668	S	S	.	*			trans	36.8	95.2	157.1	-71.2	162.6	161.6	0	0	122.8	A1453	M1277-A1453 PolarHBondContact O-N 2.9Å
1278	T	27.1	Very low	28.4	Very low	135 Å²	135	123.2 Å²	123.2	83%	0.828	66%	0.663	S	S	*	*			trans	-65.8	154.3	140.6	52.2	0	0	0	0	113.6
1279	Q	27.3	Very low	28.3	Very low	94 Å²	94	125 Å²	125	44%	0.439	67%	0.671	S	S	.	*			trans	-143.8	148.5	147.9	-78.7	-157.3	-7.9	0	0	112.4	N1450	Q1279-N1450 VanDerWaalsContact OE1-CA 3.28Å
1280	P	28.7	Very low	28.2	Very low	120 Å²	120	127.2 Å²	127.2	78%	0.779	68%	0.681	S	S	*	*			trans	-102.6	160	-175.5	39	-34.9	0	0	0	114.4
1281	L	27.7	Very low	28.1	Very low	174 Å²	174	128.3 Å²	128.3	91%	0.911	69%	0.692	S	S	*	*			trans	-124.7	161.4	171.6	-108.9	161.7	0	0	0	112.4
1282	K	27.1	Very low	28	Very low	174 Å²	174	134 Å²	134	76%	0.757	71%	0.713	S	S	*	*			trans	-107.2	146	-151.4	-67.7	170.6	-179.1	165.7	0	114.7
1283	I	33.7	Very low	27.8	Very low	148 Å²	148	140.1 Å²	140.1	76%	0.759	73%	0.728	S	S	*	*			trans	-67.4	143.8	167.7	-57.6	160	0	0	0	111	T1285	I1283-T1285 HydrophobicContact CG2-CG2 3.72Å
1284	P	29.3	Very low	27.7	Very low	117 Å²	117	143.5 Å²	143.5	76%	0.76	74%	0.739	S	S	*	*			trans	-117.4	96.2	154.9	34.5	-22.6	0	0	0	112.1	T1286	P1284-T1286 PolarHBondContact O-N 2.91Å
1285	T	26.8	Very low	27.7	Very low	128 Å²	128	144.9 Å²	144.9	79%	0.785	75%	0.749	S	S	*	*			trans	-85	88.8	173.9	40.2	0	0	0	0	112.1	I1283	I1283-T1285 HydrophobicContact CG2-CG2 3.72Å
1286	T	26.8	Very low	27.6	Very low	115 Å²	115	146.2 Å²	146.2	71%	0.706	76%	0.755	S	S	*	*			trans	-156.6	119.4	159.3	41.4	0	0	0	0	110.1	P1284	P1284-T1286 PolarHBondContact O-N 2.91Å
1287	F	27.3	Very low	27.5	Very low	184 Å²	184	145.3 Å²	145.3	81%	0.807	76%	0.76	S	S	*	*				-167.8	122.4	114.5	-109.6	-73.9	0	0	0	113.2
1288	K	26.5	Very low	27.4	Very low	177 Å²	177	147.9 Å²	147.9	77%	0.77	77%	0.774	S	S	*	*			trans	1.8	132.2	162.5	-60.9	178	178.8	-179.5	0	120.2
1289	T	24.8	Very low	27.4	Very low	134 Å²	134	145.7 Å²	145.7	82%	0.822	77%	0.765	S	S	*	*			trans	-58.6	136.9	151.5	47.3	0	0	0	0	112.5
1290	T	27.5	Very low	27.4	Very low	137 Å²	137	147.1 Å²	147.1	84%	0.84	78%	0.78	S	S	*	*			trans	-136.2	101.1	163.2	26.8	0	0	0	0	111.4
1291	T	25	Very low	27.4	Very low	141 Å²	141	148 Å²	148	87%	0.865	79%	0.787	S	S	*	*			trans	-67.6	134	164.8	-0.7	0	0	0	0	110.1
1292	R	26.9	Very low	27.4	Very low	243 Å²	243	147.5 Å²	147.5	92%	0.917	79%	0.785	S	S	*	*			trans	-142.6	161.2	164	-104.3	-174.1	175.3	-171.3	-2.3	111.1
1293	Q	25.7	Very low	27.4	Very low	177 Å²	177	141.8 Å²	141.8	83%	0.827	78%	0.776	S	S	*	*			trans	-108.5	144.2	-156.8	-64.5	150.6	-78.2	0	0	113.6
1294	I	29.4	Very low	27.1	Very low	151 Å²	151	141 Å²	141	77%	0.774	78%	0.783	S	S	*	*				12.7	119.7	129.4	-59.7	170.9	0	0	0	114.5	K1296	I1294-K1296 HydrophobicContact CG2-CD 4.33Å; I1294-K1296 HydrophobicContact CG2-CG 4.05Å
1295	P	27.8	Very low	27	Very low	115 Å²	115	144.4 Å²	144.4	75%	0.747	79%	0.789	S	S	*	*				-130.5	156.3	81.4	37.4	-25.1	0	0	0	113.3
1296	K	26.5	Very low	27	Very low	154 Å²	154	146.1 Å²	146.1	67%	0.67	79%	0.792	S	S	*	*			cis	72.4	137.5	44.5	-78.2	-166.3	136.2	-109.9	0	114.7	I1294	I1294-K1296 HydrophobicContact CG2-CD 4.33Å; I1294-K1296 HydrophobicContact CG2-CG 4.05Å
1297	D	27	Very low	26.9	Very low	124 Å²	124	149.2 Å²	149.2	66%	0.663	80%	0.798	S	S	*	*			cis	-108.4	-119.8	-16.4	-79.7	-66.5	0	0	0	109.3
1298	I	27.1	Very low	26.8	Very low	163 Å²	163	148 Å²	148	84%	0.836	80%	0.799	S	S	*	*			cis	-150.4	-137.4	-4.1	-161.8	159.5	0	0	0	110.8
1299	S	25.9	Very low	26.8	Very low	89 Å²	89	145.7 Å²	145.7	62%	0.622	80%	0.8	S	S	*	*			trans	-91.1	151.2	-166	61.8	0	0	0	0	113.8
1300	V	27.4	Very low	27.4	Very low	125 Å²	125	144.3 Å²	144.3	76%	0.758	79%	0.792	S	S	*	*			cis	67.8	106.6	39.8	-175	0	0	0	0	113.6
1301	C	29.2	Very low	27.6	Very low	137 Å²	137	147.1 Å²	147.1	93%	0.926	79%	0.792	S	S	*	*			trans	-130.1	141.8	148.1	-85	0	0	0	0	107.2
1302	D	27.9	Very low	28.1	Very low	164 Å²	164	147.8 Å²	147.8	88%	0.877	79%	0.791	S	S	*	*			trans	-130.4	160.8	-170.5	-174.4	17.9	0	0	0	109.6
1303	G	26.8	Very low	28.2	Very low	55 Å²	55	142.9 Å²	142.9	57%	0.567	78%	0.783	S	S	*	*			trans	107.2	137.2	155.9	0	0	0	0	0	118.9
1304	S	28.4	Very low	28.7	Very low	130 Å²	130	140.3 Å²	140.3	91%	0.909	78%	0.784	S	S	*	*			trans	91.6	147	153	77.3	0	0	0	0	119.8
1305	Q	26.8	Very low	28.5	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	79%	0.786	S	S	*	*			trans	-111.1	149.9	-164.9	-50.4	160.7	-74.1	0	0	110.8
1306	I	26.6	Very low	28.4	Very low	165 Å²	165	142.5 Å²	142.5	85%	0.846	80%	0.795	S	S	*	*			trans	-140.9	128.1	152.1	-63.1	-174.4	0	0	0	108.8
1307	E	23.7	Very low	28.4	Very low	179 Å²	179	141 Å²	141	84%	0.836	81%	0.805	S	S	*	*			trans	-86.7	151.7	165.6	-55.7	175.4	110.9	0	0	110.4
1308	L	26.1	Very low	28.3	Very low	158 Å²	158	145 Å²	145	83%	0.827	82%	0.816	S	S	*	*			trans	-155.2	97	155.4	-107.9	178	0	0	0	113.5
1309	T	25.6	Very low	28.6	Very low	129 Å²	129	142.2 Å²	142.2	79%	0.791	81%	0.811	S	S	*	*			trans	25.6	151	145.4	54.7	0	0	0	0	124.2
1310	T	38.4	Very low	28.6	Very low	106 Å²	106	143.8 Å²	143.8	65%	0.65	82%	0.821	S	S	*	*			trans	-79.9	166.4	-172	56.9	0	0	0	0	116.8
1311	K	30.9	Very low	28.6	Very low	195 Å²	195	144.5 Å²	144.5	85%	0.848	82%	0.82	S	S	*	*	S	Bend	trans	-121.4	148	134.7	-82.3	-173.8	175.6	178.3	0	109.6
1312	N	35.2	Very low	28.5	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	82%	0.816	S	S	*	*	S	Bend	trans	69.7	88.2	177	-56	-2.1	0	0	0	115.3	S1314	N1312-S1314 PolarHBondContact O-N 2.89Å
1313	N	30.6	Very low	28.3	Very low	140 Å²	140	145.3 Å²	145.3	75%	0.749	81%	0.809	S	S	*	*			trans	-66.1	124	171.5	-61.8	-21.1	0	0	0	112
1314	S	34.8	Very low	28.4	Very low	123 Å²	123	153 Å²	153	86%	0.86	82%	0.821	S	S	*	*			trans	-177.6	148.6	131.7	33.6	0	0	0	0	110.9	N1312	N1312-S1314 PolarHBondContact O-N 2.89Å
1315	T	26.5	Very low	28.5	Very low	133 Å²	133	155 Å²	155	82%	0.816	82%	0.82	S	S	*	*			trans	-122.6	129.6	-176.5	36.4	0	0	0	0	110.8
1316	L	25.6	Very low	28.6	Very low	178 Å²	178	151.4 Å²	151.4	93%	0.932	81%	0.81	S	S	*	*			trans	176.4	117.9	137	-118	74	0	0	0	108.6
1317	S	25.5	Very low	29	Very low	124 Å²	124	150.3 Å²	150.3	87%	0.867	81%	0.812	S	S	*	*			trans	-97.8	125.9	178.7	48	0	0	0	0	112.4
1318	K	25.1	Very low	29.3	Very low	206 Å²	206	145.2 Å²	145.2	90%	0.896	81%	0.807	S	S	*	*			trans	-97.9	178	162.3	-78.1	-173.6	174	-175.8	0	110.2
1319	S	33.5	Very low	29.8	Very low	105 Å²	105	143.5 Å²	143.5	73%	0.734	81%	0.805	S	S	*	*			trans	-69	151.5	172.1	51.4	0	0	0	0	114.1
1320	C	25.6	Very low	30.1	Very low	122 Å²	122	146.1 Å²	146.1	82%	0.824	81%	0.811	S	S	*	*			trans	-160	140.8	154	-98.7	0	0	0	0	104.9
1321	D	27	Very low	29.6	Very low	140 Å²	140	147.9 Å²	147.9	75%	0.749	82%	0.816	S	S	*	*			cis	62	102.9	17.6	-63.2	-25.9	0	0	0	116.1
1322	E	27.1	Very low	29.5	Very low	181 Å²	181	145.6 Å²	145.6	85%	0.846	81%	0.813	S	S	*	*			trans	65.9	166.4	162.1	-59.4	-146.1	130	0	0	121.9
1323	L	25.3	Very low	29.1	Very low	138 Å²	138	142.7 Å²	142.7	72%	0.723	81%	0.805	S	S	*	*			trans	78	96.8	161	-67.7	168.9	0	0	0	121.1
1324	R	28.5	Very low	28.8	Very low	215 Å²	215	141.4 Å²	141.4	81%	0.811	81%	0.806	S	S	*	*				38	126.2	123.7	-70.5	179.1	170.1	163.4	-2.5	119.7
1325	I	29.5	Very low	28.4	Very low	173 Å²	173	141.2 Å²	141.2	89%	0.887	80%	0.799	S	S	*	*			trans	-116.5	144.1	140	-66.2	-178.5	0	0	0	108.5
1326	V	28.8	Very low	28.4	Very low	114 Å²	114	142.7 Å²	142.7	69%	0.691	80%	0.797	S	S	*	*			trans	-113.6	135.2	-171.9	174.7	0	0	0	0	111.1
1327	T	36.3	Very low	28.4	Very low	142 Å²	142	140.9 Å²	140.9	87%	0.871	79%	0.788	S	S	*	*			trans	-134	146.7	154.6	46.4	0	0	0	0	109.5
1328	G	28.6	Very low	28.5	Very low	71 Å²	71	143.8 Å²	143.8	73%	0.732	79%	0.788	S	S	*	*			trans	-95.3	-176	-155	0	0	0	0	0	118.1
1329	P	37.6	Very low	28.8	Very low	122 Å²	122	140.1 Å²	140.1	79%	0.792	78%	0.783	S	S	*	*			trans	-109.9	152.5	-159.8	39.3	-33.5	0	0	0	116.2
1330	M	31.9	Very low	28.6	Very low	185 Å²	185	141.9 Å²	141.9	91%	0.911	79%	0.789	S	S	*	*			trans	-146.9	120.3	142.4	-69.2	-163.8	173.8	0	0	106.9
1331	N	27.6	Very low	28.8	Very low	142 Å²	142	141.5 Å²	141.5	76%	0.759	79%	0.786	S	S	*	*				66.7	124	73	-91.4	10.8	0	0	0	115.7
1332	N	28.9	Very low	28.9	Very low	147 Å²	147	140 Å²	140	79%	0.786	79%	0.786	S	S	*	*			trans	68.5	146.6	160.6	-61.1	-7.1	0	0	0	117.2
1333	S	26.1	Very low	29	Very low	95 Å²	95	142.6 Å²	142.6	66%	0.664	79%	0.79	S	S	*	*			cis	-174.7	162.3	-13.1	48.8	0	0	0	0	110
1334	C	24.8	Very low	29.2	Very low	113 Å²	113	144.7 Å²	144.7	76%	0.764	80%	0.796	S	S	*	*			trans	71.9	122.8	159.1	-71.3	0	0	0	0	116.7
1335	V	26.5	Very low	29.2	Very low	120 Å²	120	143.5 Å²	143.5	73%	0.727	80%	0.799	S	S	*	*				67.8	122.1	89.1	172	0	0	0	0	110.9
1336	Q	26.9	Very low	29.2	Very low	164 Å²	164	144.5 Å²	144.5	77%	0.766	80%	0.8	S	S	*	*			cis	-158	160.1	44.3	-151.1	150.6	47.7	0	0	114.6
1337	N	25.8	Very low	29.2	Very low	140 Å²	140	147.1 Å²	147.1	75%	0.749	81%	0.808	S	S	*	*			trans	4.8	130.7	157.8	-53.7	-9.6	0	0	0	120.7
1338	Q	27.7	Very low	28.8	Very low	185 Å²	185	144.5 Å²	144.5	86%	0.864	80%	0.802	S	S	*	*				-166.7	122.9	109.4	-105.8	169.2	17.8	0	0	114.9
1339	T	30.1	Very low	28.9	Very low	129 Å²	129	149.2 Å²	149.2	79%	0.791	81%	0.809	S	S	*	*			trans	34.7	113.7	148.1	53.6	0	0	0	0	121.4
1340	T	30.3	Very low	28.6	Very low	141 Å²	141	151.1 Å²	151.1	87%	0.865	81%	0.812	S	S	*	*			trans	-71.4	157.5	155.8	47	0	0	0	0	112.7
1341	P	30	Very low	28.4	Very low	115 Å²	115	148.6 Å²	148.6	75%	0.747	81%	0.808	S	S	*	*			trans	-136.7	143.7	133.4	37.1	-26.3	0	0	0	115.3
1342	S	28.9	Very low	28.5	Very low	108 Å²	108	149.3 Å²	149.3	76%	0.755	81%	0.811	S	S	*	*			trans	40	119.6	152.3	53.8	0	0	0	0	122.2	E1344	S1342-E1344 PolarHBondContact O-N 3.1Å
1343	Y	29.4	Very low	28.7	Very low	236 Å²	236	150.4 Å²	150.4	93%	0.925	81%	0.812	S	S	*	*	S	Bend	trans	-77.5	77.9	173.3	175.1	-98.1	0	0	0	112.5
1344	E	28.5	Very low	29	Very low	181 Å²	181	154 Å²	154	85%	0.846	82%	0.823	S	S	*	*			trans	-149.1	-14.2	178.1	-129.1	159.7	-151.7	0	0	119.2	S1342	S1342-E1344 PolarHBondContact O-N 3.1Å
1345	E	29.2	Very low	29.4	Very low	190 Å²	190	159.6 Å²	159.6	89%	0.888	83%	0.829	S	S	*	*	S	Bend	trans	-128.3	48.5	-175.9	-69.9	-161	128.1	0	0	116.2
1346	Q	30.3	Very low	29.5	Very low	194 Å²	194	157.1 Å²	157.1	91%	0.907	82%	0.821	S	S	*	*			trans	-132.1	17.4	166.2	-70.8	-163.3	-0.6	0	0	115.7	A1348	Q1346-A1348 PolarHBondContact O-N 3.12Å
1347	I	28.5	Very low	29.7	Very low	169 Å²	169	157.3 Å²	157.3	87%	0.867	82%	0.824	S	S	*	*			trans	-93.9	65.4	173.2	-49.9	-179.6	0	0	0	110.1
1348	A	28.1	Very low	30	Very low	88 Å²	88	159.2 Å²	159.2	73%	0.727	83%	0.826	S	S	*	*	S	Bend	trans	-156.7	31.1	-176.2	0	0	0	0	0	116.6	Q1346	Q1346-A1348 PolarHBondContact O-N 3.12Å
1349	L	29.3	Very low	30.2	Very low	170 Å²	170	155.6 Å²	155.6	89%	0.89	82%	0.819	S	S	*	*	S	Bend	trans	-163.5	60.7	175.6	-115.2	162.5	0	0	0	114.2
1350	N	31.3	Very low	30.3	Very low	161 Å²	161	157.1 Å²	157.1	86%	0.861	82%	0.818	S	S	*	*			trans	-155.3	45.4	172.1	-116.4	-26.7	0	0	0	115.8
1351	T	28.9	Very low	30.7	Very low	132 Å²	132	155.3 Å²	155.3	81%	0.81	81%	0.807	S	S	*	*	S	Bend	trans	-134.5	90.7	172.6	51.2	0	0	0	0	110.3
1352	D	29.4	Very low	31.1	Very low	157 Å²	157	155.8 Å²	155.8	84%	0.84	80%	0.802	S	S	*	*	S	Bend	trans	-177.5	-5.4	157.2	-103.1	-19	0	0	0	115.1
1353	H	33.1	Very low	31.4	Very low	171 Å²	171	157.8 Å²	157.8	79%	0.792	80%	0.797	S	S	*	*	S	Bend	trans	-101.9	-3.8	-161.5	-118.2	-74.2	0	0	0	119.1
1354	L	33.2	Very low	31.8	Very low	171 Å²	171	150 Å²	150	90%	0.895	78%	0.777	S	S	*	*	S	Bend	trans	-113.3	-6.4	-175.9	-145.3	70.8	0	0	0	116.1
1355	Y	31.2	Very low	32.3	Very low	230 Å²	230	148.7 Å²	148.7	90%	0.902	77%	0.768	S	S	*	*	S	Bend	trans	-101	-5.5	174.8	-113.1	-102.4	0	0	0	114.4
1356	A	30.6	Very low	32.7	Very low	67 Å²	67	148.4 Å²	148.4	55%	0.554	76%	0.76	S	S	*	*	S	Bend	trans	-82.8	-25.5	-178.8	0	0	0	0	0	114.4	K1358	A1356-K1358 VanDerWaalsContact C-N 3.27Å; A1356-K1358 PolarHBondContact O-N 3.42Å; A1356-K1358 VanDerWaalsContact O-N 3.14Å
1357	M	30.9	Very low	32.9	Very low	169 Å²	169	144.8 Å²	144.8	83%	0.833	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	15.3	-170.3	-100.8	-175	169.9	0	0	116.2
1358	K	31.8	Very low	33.3	Very low	180 Å²	180	144.3 Å²	144.3	78%	0.783	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	0.8	173.3	-83.2	176	177.1	168.2	0	115	A1356	A1356-K1358 VanDerWaalsContact C-N 3.27Å; A1356-K1358 PolarHBondContact O-N 3.42Å; A1356-K1358 VanDerWaalsContact O-N 3.14Å
1359	C	30.6	Very low	33.8	Very low	108 Å²	108	148 Å²	148	73%	0.73	74%	0.744	S	S	*	*	S	Bend	trans	-109.7	9.8	-175	-72.7	0	0	0	0	116.2
1360	Q	33.5	Very low	34	Very low	162 Å²	162	145.6 Å²	145.6	76%	0.757	73%	0.732	S	S	*	*	S	Bend	trans	-106	-30.4	174.1	-77.6	179	-33.3	0	0	114	I1362 K1363	Q1360-I1362 VanDerWaalsContact C-N 3.3Å; Q1360-I1362 PolarHBondContact O-N 3.25Å; Q1360-K1363 PolarHBondContact O-N 2.05Å
1361	T	37.2	Very low	34.1	Very low	103 Å²	103	144.2 Å²	144.2	63%	0.632	73%	0.725	S	S	*	*	H	α-helix	trans	-75.7	-11.2	-174.4	-23.2	0	0	0	0	115	S1364	T1361-S1364 PolarHBondContact O-OG 3.18Å
1362	I	38.4	Very low	34.3	Very low	125 Å²	125	147.5 Å²	147.5	64%	0.641	73%	0.728	S	S	*	*	H	α-helix	trans	-92.2	-27.6	176.7	-64.8	176.1	0	0	0	111.1	Q1360 K1365 Y1366	Q1360-I1362 VanDerWaalsContact C-N 3.3Å; Q1360-I1362 PolarHBondContact O-N 3.25Å; I1362-K1365 PolarHBondContact O-N 2.96Å; I1362-Y1366 PolarHBondContact O-N 2.74Å
1363	K	35.1	Very low	34.5	Very low	150 Å²	150	147.9 Å²	147.9	65%	0.652	72%	0.724	S	S	*	*	H	α-helix	trans	-71.7	-36.8	-177.6	-158.9	170.6	-175.9	178.5	0	112.2	Q1360	Q1360-K1363 PolarHBondContact O-N 2.05Å
1364	S	38	Very low	34.3	Very low	72 Å²	72	147.3 Å²	147.3	50%	0.503	73%	0.727	S	S	.	*	H	α-helix	trans	-64.8	-40.1	173.3	48.9	0	0	0	0	112.8	T1361 Y1366 Q1367	T1361-S1364 PolarHBondContact O-OG 3.18Å; S1364-Y1366 PolarHBondContact O-N 2.82Å; S1364-Q1367 PolarHBondContact O-N 3.09Å
1365	K	40.6	Very low	34.2	Very low	154 Å²	154	146.8 Å²	146.8	67%	0.67	73%	0.726	S	S	*	*	H	α-helix	trans	-79.6	-10.8	-177.4	-111.8	170.3	-178.3	167.7	0	115.8	I1362	I1362-K1365 PolarHBondContact O-N 2.96Å
1366	Y	37.1	Very low	34.2	Very low	183 Å²	183	142.6 Å²	142.6	72%	0.718	72%	0.718	S	S	*	*	H	α-helix	trans	-93.3	-11.8	172.9	-139.1	-89.7	0	0	0	113.4	I1362 S1364	I1362-Y1366 PolarHBondContact O-N 2.74Å; S1364-Y1366 PolarHBondContact O-N 2.82Å
1367	Q	34.8	Very low	34	Very low	118 Å²	118	147.1 Å²	147.1	55%	0.551	73%	0.732	S	S	*	*	H	α-helix	trans	-99.2	-17.5	178.3	-65.7	-173.1	-106.2	0	0	113.2	S1364	S1364-Q1367 PolarHBondContact O-N 3.09Å
1368	E	36.7	Very low	34	Very low	160 Å²	160	146.2 Å²	146.2	75%	0.748	73%	0.729	S	S	*	*	S	Bend	trans	-83.6	-20.4	-177.2	-159.7	166.8	-134.9	0	0	113.8
1369	L	38	Very low	33.8	Very low	166 Å²	166	142.1 Å²	142.1	87%	0.869	72%	0.724	S	S	*	*	S	Bend	trans	-94.7	-4.5	175.4	-86.1	165.9	0	0	0	114.3
1370	N	34.2	Very low	33.6	Very low	119 Å²	119	143.9 Å²	143.9	64%	0.636	73%	0.726	S	S	*	*	S	Bend	trans	-121.7	16.7	-164.3	-136.6	5.2	0	0	0	114.1
1371	N	32.2	Very low	33.4	Very low	132 Å²	132	144.3 Å²	144.3	71%	0.706	73%	0.728	S	S	*	*			trans	-143.4	36.1	-174	-96.4	-38.8	0	0	0	115.3
1372	K	33.7	Very low	33	Very low	200 Å²	200	150.3 Å²	150.3	87%	0.87	74%	0.74	S	S	*	*	S	Bend	trans	-99.8	84.4	145.5	-81.3	-171.8	175.6	-178.1	0	107.2
1373	Q	32.7	Very low	32.5	Very low	165 Å²	165	150.6 Å²	150.6	77%	0.771	74%	0.743	S	S	*	*				97.1	88.4	91.1	-93.4	-175.3	-36.1	0	0	110.6
1374	N	28.9	Very low	32.2	Very low	160 Å²	160	150 Å²	150	86%	0.856	75%	0.747	S	S	*	*			trans	-59.1	135.2	153.5	-76.1	-28.1	0	0	0	109
1375	N	32.7	Very low	31.8	Very low	160 Å²	160	154.7 Å²	154.7	86%	0.856	76%	0.761	S	S	*	*			trans	-149.2	148.5	142.1	-115.5	-24.3	0	0	0	109.9
1376	N	30.3	Very low	31.3	Very low	141 Å²	141	154.1 Å²	154.1	75%	0.754	77%	0.765	S	S	*	*			trans	-91.7	175	-167.6	-66.4	-57.8	0	0	0	113.2
1377	L	27.3	Very low	30.9	Very low	162 Å²	162	152.4 Å²	152.4	85%	0.848	77%	0.768	S	S	*	*			trans	84.6	153.8	146.5	-79.2	154.9	0	0	0	119.7
1378	I	30.9	Very low	30.8	Very low	150 Å²	150	152 Å²	152	77%	0.769	77%	0.77	S	S	*	*			trans	87.3	85.1	166.2	-61	149.7	0	0	0	116.7
1379	S	27.8	Very low	30.4	Very low	95 Å²	95	151.5 Å²	151.5	66%	0.664	77%	0.765	S	S	*	*			trans	55.1	132.4	131	68.8	0	0	0	0	123.2
1380	N	26.2	Very low	29.9	Very low	144 Å²	144	150.4 Å²	150.4	77%	0.77	76%	0.76	S	S	*	*				31.2	154.2	122.5	-58.3	3.5	0	0	0	122
1381	E	27.9	Very low	29.6	Very low	171 Å²	171	153.2 Å²	153.2	80%	0.799	77%	0.77	S	S	*	*			trans	70.9	103.9	169.9	-62.5	168.6	-153.4	0	0	113.4
1382	Y	30.4	Very low	29.4	Very low	229 Å²	229	154.7 Å²	154.7	90%	0.898	77%	0.772	S	S	*	*				-136.6	151.5	63.4	-115.4	-103.8	0	0	0	114.7
1383	N	27.4	Very low	29.2	Very low	131 Å²	131	156.7 Å²	156.7	70%	0.701	77%	0.774	S	S	*	*			trans	-127.7	151.7	-177.8	-149.4	-3.9	0	0	0	109.8
1384	N	28.1	Very low	29.1	Very low	137 Å²	137	155.8 Å²	155.8	73%	0.733	77%	0.773	S	S	*	*			trans	63.7	125.3	176	-48.7	-49.1	0	0	0	117.7
1385	Q	29.7	Very low	29.1	Very low	172 Å²	172	158.9 Å²	158.9	80%	0.804	77%	0.773	S	S	*	*				-168.1	136.4	96.4	-104.4	-173.2	6.6	0	0	113.3
1386	L	31.1	Very low	28.9	Very low	142 Å²	142	156.1 Å²	156.1	74%	0.743	76%	0.757	S	S	*	*			trans	63	128.1	171.2	-75.9	76.9	0	0	0	114.9
1387	N	27.9	Very low	28.7	Very low	146 Å²	146	156.3 Å²	156.3	78%	0.781	76%	0.758	S	S	*	*			cis	61.1	139.7	49.4	-59.7	-10	0	0	0	112.3
1388	D	32.5	Very low	28.7	Very low	111 Å²	111	152.2 Å²	152.2	59%	0.594	74%	0.743	S	S	*	*			cis	-150.6	160.7	25.7	-152.9	11.8	0	0	0	113.1
1389	K	27.9	Very low	28.5	Very low	148 Å²	148	151 Å²	151	64%	0.643	74%	0.738	S	S	*	*			trans	27	135.7	155.8	-72.9	165.3	-163.2	74	0	122.1
1390	N	27.6	Very low	28.7	Very low	143 Å²	143	154.9 Å²	154.9	77%	0.765	75%	0.745	S	S	*	*				16.3	132.5	118.4	-46.4	-14.4	0	0	0	117.3
1391	E	28.6	Very low	28.7	Very low	179 Å²	179	156 Å²	156	84%	0.836	74%	0.743	S	S	*	*				-157.9	158.5	94.8	-118	177.4	-148.8	0	0	115.7
1392	Q	28.9	Very low	28.6	Very low	162 Å²	162	155.5 Å²	155.5	76%	0.757	74%	0.741	S	S	*	*			trans	-61.1	156.3	179.3	-54.3	154.4	-1.1	0	0	111.9
1393	R	29.2	Very low	28.5	Very low	243 Å²	243	150.5 Å²	150.5	92%	0.917	73%	0.729	S	S	*	*				-157.4	122	114.9	-111.4	161.2	-167.7	-171.5	2.7	114.6
1394	I	30.6	Very low	28.5	Very low	146 Å²	146	149.3 Å²	149.3	75%	0.749	72%	0.722	S	S	*	*			trans	-63.7	141.6	161.6	-62.6	159.3	0	0	0	108.6
1395	W	28.6	Very low	28.5	Very low	224 Å²	224	150.6 Å²	150.6	85%	0.848	72%	0.721	S	S	*	*			trans	174.8	131.9	146.6	-102.5	38.6	0	0	0	106.2
1396	L	28	Very low	28.5	Very low	102 Å²	102	148.3 Å²	148.3	53%	0.534	71%	0.714	S	S	.	*			cis	-156.7	163.5	10.1	-102.7	-162.7	0	0	0	113.6
1397	L	27.2	Very low	28.4	Very low	145 Å²	145	147.6 Å²	147.6	76%	0.759	71%	0.711	S	S	*	*			trans	15.5	152.1	130.5	-69	175.8	0	0	0	120.4
1398	S	26.2	Very low	28.5	Very low	77 Å²	77	149.4 Å²	149.4	54%	0.538	71%	0.712	S	S	.	*			cis	-179	174.8	-7	-172.3	0	0	0	0	110.4
1399	N	26.4	Very low	28.6	Very low	124 Å²	124	149.4 Å²	149.4	66%	0.663	72%	0.718	S	S	*	*			trans	30.2	115.4	148.2	-65.4	-14.6	0	0	0	118.5
1400	H	32.8	Very low	28.6	Very low	177 Å²	177	145.3 Å²	145.3	82%	0.819	72%	0.718	S	S	*	*				-162.9	110.6	97.5	-100.6	-82.1	0	0	0	107.2
1401	K	25.6	Very low	28.7	Very low	168 Å²	168	145.7 Å²	145.7	73%	0.73	72%	0.719	S	S	*	*				46	118.9	76.2	-93.4	-160.8	175.5	-172.5	0	113.7
1402	H	26.6	Very low	28.6	Very low	160 Å²	160	143.9 Å²	143.9	74%	0.741	71%	0.714	S	S	*	*			trans	45	104.5	133.3	-87	-85.1	0	0	0	117.4
1403	D	27.5	Very low	28.6	Very low	124 Å²	124	143.6 Å²	143.6	66%	0.663	72%	0.716	S	S	*	*				167	166.2	91.5	-98	0.2	0	0	0	109.5
1404	I	28	Very low	28.6	Very low	106 Å²	106	136.8 Å²	136.8	54%	0.544	71%	0.706	S	S	.	*			cis	169.7	145.2	-20.4	-154.5	173.8	0	0	0	102.8
1405	K	28.1	Very low	28.7	Very low	164 Å²	164	134.6 Å²	134.6	71%	0.713	70%	0.701	S	S	*	*			trans	65.2	146.9	168.3	-59.7	163.6	-163.2	157.5	0	116
1406	N	29.4	Very low	28.7	Very low	123 Å²	123	130.5 Å²	130.5	66%	0.658	70%	0.696	S	S	*	*			cis	-172.4	165.1	-7.4	-109.2	-6.2	0	0	0	109.2
1407	N	29.6	Very low	28.8	Very low	127 Å²	127	132 Å²	132	68%	0.679	70%	0.704	S	S	*	*			trans	70.8	141	145.8	-70.6	-16.5	0	0	0	120.4
1408	K	29.1	Very low	28.8	Very low	184 Å²	184	130.7 Å²	130.7	80%	0.8	70%	0.697	S	S	*	*			cis	-163.8	179.6	-22.5	-122.8	-170.6	-175.5	-174.3	0	108.3
1409	P	34.6	Very low	28.9	Very low	111 Å²	111	132 Å²	132	72%	0.721	71%	0.706	S	S	*	*				-128.1	179.2	-128.9	40.5	-21	0	0	0	116.2
1410	G	29.4	Very low	29	Very low	63 Å²	63	133 Å²	133	65%	0.649	71%	0.711	S	S	*	*			trans	-127	136.6	146.9	0	0	0	0	0	109.1
1411	I	27.8	Very low	28.8	Very low	151 Å²	151	133.2 Å²	133.2	77%	0.774	71%	0.706	S	S	*	*				71.3	103.6	59.8	-65.8	170.3	0	0	0	108.3
1412	L	28.4	Very low	29	Very low	141 Å²	141	131.5 Å²	131.5	74%	0.738	70%	0.701	S	S	*	*			cis	-152	154.2	15	-79	140.3	0	0	0	113.7
1413	I	28.4	Very low	29	Very low	156 Å²	156	130 Å²	130	80%	0.8	70%	0.697	S	S	*	*			trans	52.5	122.6	135.7	-60.1	175.6	0	0	0	121
1414	S	28.3	Very low	29.1	Very low	100 Å²	100	131 Å²	131	70%	0.699	70%	0.701	S	S	*	*			trans	-113.4	-174	145	65.3	0	0	0	0	108
1415	P	33.6	Very low	29.1	Very low	100 Å²	100	133.2 Å²	133.2	65%	0.649	71%	0.709	S	S	*	*			cis	-128.6	-111.4	-2.4	35.7	-12.7	0	0	0	112.8
1416	D	28.3	Very low	29	Very low	137 Å²	137	132.1 Å²	132.1	73%	0.733	71%	0.706	S	S	*	*			trans	66	140.4	173.1	-42.3	-27.5	0	0	0	117
1417	D	29.5	Very low	29	Very low	133 Å²	133	134.8 Å²	134.8	71%	0.711	72%	0.717	S	S	*	*			cis	-148.8	137.1	-8.9	-129.6	-17.8	0	0	0	112.2
1418	I	28	Very low	28.9	Very low	119 Å²	119	137.6 Å²	137.6	61%	0.61	72%	0.723	S	S	*	*			trans	20.4	141.6	138.3	-64	174.5	0	0	0	121.7	V658	V658-I1418 HydrophobicContact CG2-CD1 3.55Å
1419	S	27.7	Very low	28.9	Very low	103 Å²	103	138.8 Å²	138.8	72%	0.72	72%	0.724	S	S	*	*			trans	-71.4	157.2	177.3	57.1	0	0	0	0	116.3
1420	D	29.1	Very low	28.9	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	72%	0.72	S	S	*	*			trans	-128.6	121.7	158.3	-123.4	-14.3	0	0	0	112
1421	Y	28.9	Very low	28.7	Very low	183 Å²	183	139.9 Å²	139.9	72%	0.718	72%	0.722	S	S	*	*			trans	39.1	142	133	-78.1	-116.6	0	0	0	122.1
1422	Q	28.4	Very low	28.6	Very low	132 Å²	132	139.5 Å²	139.5	62%	0.617	72%	0.72	S	S	*	*			cis	-175.2	159.2	-13.2	-124.6	-168.8	-2	0	0	112.2
1423	I	28	Very low	28.4	Very low	129 Å²	129	139 Å²	139	66%	0.662	72%	0.718	S	S	*	*			trans	79.6	148.1	141.5	-77.8	176	0	0	0	123.1
1424	L	29.4	Very low	28.2	Very low	145 Å²	145	142.6 Å²	142.6	76%	0.759	72%	0.721	S	S	*	*			trans	69	108.3	175.5	-73.8	158.3	0	0	0	116.2
1425	E	26.3	Very low	27.9	Very low	151 Å²	151	147.1 Å²	147.1	71%	0.706	73%	0.728	S	S	*	*			cis	61	120.3	41.7	-58.6	-154.2	90.1	0	0	114.1
1426	H	27.8	Very low	27.6	Very low	141 Å²	141	147 Å²	147	65%	0.653	73%	0.73	S	S	*	*				-169.2	179.1	54.6	-95.6	-39.8	0	0	0	112.7
1427	M	28.7	Very low	27.6	Very low	179 Å²	179	149 Å²	149	88%	0.882	74%	0.735	S	S	*	*			trans	70.3	108	167.4	-43.9	-163.7	-170.9	0	0	116
1428	K	27.5	Very low	27.4	Very low	186 Å²	186	147.7 Å²	147.7	81%	0.809	73%	0.734	S	S	*	*			cis	82	102.6	40.5	-71.3	-166.6	173.6	177.7	0	117.3
1429	Y	28.9	Very low	27.4	Very low	209 Å²	209	151.5 Å²	151.5	82%	0.82	74%	0.743	S	S	*	*			trans	71.2	169.8	142.7	-68.7	-63.7	0	0	0	118
1430	P	34.5	Very low	27.5	Very low	99 Å²	99	153.9 Å²	153.9	64%	0.643	74%	0.743	S	S	*	*				-143.5	165	-84.9	38.7	-17.6	0	0	0	118.2
1431	S	26.1	Very low	27.5	Very low	98 Å²	98	154.7 Å²	154.7	69%	0.685	75%	0.745	S	S	*	*			trans	68.5	176	145.1	76	0	0	0	0	120.7
1432	I	24.6	Very low	27.5	Very low	143 Å²	143	153.1 Å²	153.1	73%	0.733	75%	0.746	S	S	*	*			trans	80.8	98.8	160.1	-68.2	169.1	0	0	0	119.3
1433	L	23.7	Very low	27.6	Very low	132 Å²	132	152 Å²	152	69%	0.691	75%	0.751	S	S	*	*				56.7	132.4	128.5	-65.1	173.2	0	0	0	124.2
1434	R	24.5	Very low	27.7	Very low	231 Å²	231	152 Å²	152	87%	0.872	75%	0.752	S	S	*	*			trans	84.5	178.4	134.8	-75.3	172.5	-177.5	-176.7	2.4	119.9
1435	K	23.5	Very low	27.6	Very low	195 Å²	195	150.2 Å²	150.2	85%	0.848	75%	0.751	S	S	*	*			trans	-98.4	174	-162.4	-68.4	-179.9	172.2	-178.6	0	112.9
1436	S	25.4	Very low	27.9	Very low	97 Å²	97	148.1 Å²	148.1	68%	0.678	75%	0.751	S	S	*	*			trans	78.7	114.7	147.8	56	0	0	0	0	121.1
1437	E	28.6	Very low	28	Very low	180 Å²	180	150.5 Å²	150.5	84%	0.841	76%	0.759	S	S	*	*				63.4	125.2	127.2	-60.5	167.2	-167.6	0	0	118.5
1438	C	26.6	Very low	28	Very low	104 Å²	104	148.4 Å²	148.4	70%	0.703	75%	0.752	S	S	*	*				-175.4	152	80.9	-91.2	0	0	0	0	113.3
1439	Y	27.8	Very low	28.2	Very low	200 Å²	200	144.8 Å²	144.8	78%	0.784	74%	0.741	S	S	*	*			trans	29.9	148.6	141.5	-65.4	-87.9	0	0	0	122.1
1440	E	28.2	Very low	28.4	Very low	153 Å²	153	139.8 Å²	139.8	72%	0.715	73%	0.729	S	S	*	*			cis	-154.3	170.1	1	-139.1	155.9	-152	0	0	106.9
1441	I	29.5	Very low	28.2	Very low	161 Å²	161	139.7 Å²	139.7	83%	0.826	72%	0.723	S	S	*	*				-155.4	154.2	58.3	-71.3	178.2	0	0	0	110.9
1442	M	29.1	Very low	28.5	Very low	150 Å²	150	140.1 Å²	140.1	74%	0.739	72%	0.717	S	S	*	*			trans	-83	180	-176.2	-89.9	-165.4	-176.3	0	0	114.4
1443	P	31.5	Very low	28.8	Very low	110 Å²	110	136 Å²	136	71%	0.714	71%	0.705	S	S	*	*			cis	-149.8	155.2	28	40.8	-17.8	0	0	0	122.8
1444	N	29.2	Very low	29.1	Very low	128 Å²	128	135.5 Å²	135.5	68%	0.684	70%	0.703	S	S	*	*			trans	65	92	134.3	-61.2	-11.6	0	0	0	124.9
1445	S	28.5	Very low	29.3	Very low	107 Å²	107	130.6 Å²	130.6	75%	0.748	69%	0.688	S	S	*	*				60.9	172.1	110.1	85	0	0	0	0	122.5
1446	P	32.1	Very low	29.6	Very low	108 Å²	108	124.9 Å²	124.9	70%	0.701	67%	0.667	S	S	*	*			cis	-130.6	166.7	-17.4	31.4	-11.3	0	0	0	115.9
1447	K	28.8	Very low	29.9	Very low	190 Å²	190	128 Å²	128	83%	0.826	68%	0.676	S	S	*	*			trans	9.2	139.6	146.1	-53	172.6	-175.5	174.8	0	118.5
1448	N	29.4	Very low	29.9	Very low	135 Å²	135	123.6 Å²	123.6	72%	0.722	66%	0.658	S	S	*	*				-166.3	134.5	66.8	-132.4	6.5	0	0	0	116.4
1449	N	31	Very low	29.9	Very low	110 Å²	110	125.1 Å²	125.1	59%	0.588	66%	0.658	S	S	*	*			trans	32.8	136.2	134.9	-71.4	21.9	0	0	0	125.3
1450	N	33.1	Very low	29.9	Very low	104 Å²	104	118.4 Å²	118.4	56%	0.556	63%	0.633	S	S	*	*			trans	76	135	135.2	-70.9	53	0	0	0	119.2	Q1279	Q1279-N1450 VanDerWaalsContact OE1-CA 3.28Å
1451	N	31.2	Very low	29.7	Very low	98 Å²	98	117.8 Å²	117.8	52%	0.524	63%	0.631	S	S	.	*			cis	-151.9	161.9	24.7	-85.2	-46.4	0	0	0	115.6
1452	N	31.9	Very low	29.5	Very low	107 Å²	107	117 Å²	117	57%	0.572	62%	0.623	S	S	*	*			trans	7	153.5	142.7	-54.2	-6	0	0	0	124.8
1453	A	31.1	Very low	29.3	Very low	56 Å²	56	116.7 Å²	116.7	46%	0.463	62%	0.62	S	S	.	*			trans	140	103.9	132.9	0	0	0	0	0	116.6	Y1276 M1277	Y1276-A1453 CarbonylContact C-O 3.53Å; Y1276-A1453 VanDerWaalsContact C-O 3.22Å; Y1276-A1453 WeakPolarHBondContact CB-O 3.07Å; Y1276-A1453 CarbonylContact O-C 3.6Å; M1277-A1453 PolarHBondContact O-N 2.9Å
1454	N	30.8	Very low	29.1	Very low	122 Å²	122	117 Å²	117	65%	0.652	62%	0.616	S	S	*	*			trans	26.4	135.3	149.3	-58.9	-5.1	0	0	0	123.1	K1275 Y1276	K1275-N1454 CarbonylContact C-O 3.45Å; K1275-N1454 VanDerWaalsContact C-O 3.26Å; Y1276-N1454 PolarHBondContact N-O 3.17Å; Y1276-N1454 VanDerWaalsContact N-O 3.12Å; Y1276-N1454 CarbonylContact O-C 3.59Å; Y1276-N1454 WeakPolarHBondContact O-CA 3.44Å; Y1276-N1454 PolarHBondContact O-N 3.13Å; Y1276-N1454 VanDerWaalsContact O-N 3.15Å
1455	F	28.3	Very low	28.9	Very low	128 Å²	128	118.9 Å²	118.9	56%	0.561	62%	0.62	S	S	*	*				159.6	166.9	117.8	-98	-91.6	0	0	0	113.3	V1274 K1275 Y1276	V1274-F1455 VanDerWaalsContact C-CB 3.41Å; V1274-F1455 HydrophobicContact CB-CB 4.01Å; V1274-F1455 HydrophobicContact CB-CD1 3.87Å; V1274-F1455 HydrophobicContact CB-CG 4.03Å; V1274-F1455 HydrophobicContact CG1-CB 3.91Å; V1274-F1455 HydrophobicContact CG1-CD1 4.2Å; V1274-F1455 HydrophobicContact CG1-CD2 4.28Å; V1274-F1455 HydrophobicContact CG1-CG 3.91Å; V1274-F1455 CarbonylContact O-C 3.59Å; K1275-F1455 WeakPolarHBondContact CA-O 3.32Å; Y1276-F1455 PolarHBondContact N-O 2.9Å; Y1276-F1455 PolarHBondContact O-N 3.18Å
1456	N	29.9	Very low	28.9	Very low	75 Å²	75	118.7 Å²	118.7	40%	0.401	62%	0.619	S	S	.	*			trans	-35.6	161.5	-167.6	-43.8	-14.9	0	0	0	123.2	V1274	V1274-N1456 CarbonylContact O-C 3.58Å; V1274-N1456 WeakPolarHBondContact O-CA 2.89Å; V1274-N1456 WeakPolarHBondContact O-CB 3.44Å; V1274-N1456 PolarHBondContact O-N 3.18Å; V1274-N1456 VanDerWaalsContact O-O 3.08Å
1457	N	30.7	Very low	29	Very low	163 Å²	163	121.7 Å²	121.7	87%	0.872	62%	0.621	S	S	*	*			trans	-137.2	147.3	143.6	-106.7	-9.7	0	0	0	108.7
1458	L	28.3	Very low	29	Very low	87 Å²	87	119.1 Å²	119.1	46%	0.455	62%	0.615	S	S	.	*			trans	-157.5	118.8	-170.2	-168.1	155.1	0	0	0	111.1	Y1271	Y1271-L1458 HydrophobicContact CD2-CD2 4.09Å; Y1271-L1458 WeakPolarHBondContact CE2-O 3.13Å; Y1271-L1458 VanDerWaalsContact CZ-O 3.26Å; Y1271-L1458 PolarHBondContact OH-O 2.7Å
1459	L	26.8	Very low	29.3	Very low	136 Å²	136	119.1 Å²	119.1	71%	0.712	62%	0.62	S	S	*	*			trans	56.3	-155.2	164.4	-146.2	62.6	0	0	0	118.9	Y1271	Y1271-L1459 HydrophobicContact CD2-CB 4.34Å; Y1271-L1459 HydrophobicContact CE2-CB 3.93Å; Y1271-L1459 PolarHBondContact OH-O 3.41Å
1460	H	27.9	Very low	29.4	Very low	58 Å²	58	121 Å²	121	27%	0.269	63%	0.625	S	S	.	*			trans	16.3	140.6	177.1	-63.7	-75.3	0	0	0	121.7	Y1271	Y1271-H1460 HydrophobicContact CD2-CB 4.18Å; Y1271-H1460 AromaticContact CD2-CD2 3.53Å; Y1271-H1460 HydrophobicContact CE2-CB 3.47Å; Y1271-H1460 VanDerWaalsContact CE2-CB 3.47Å; Y1271-H1460 AromaticContact CE2-CD2 3.65Å; Y1271-H1460 AromaticContact CE2-CG 3.97Å; Y1271-H1460 PolarHBondContact OH-O 3.11Å
1461	E	25	Very low	29.2	Very low	140 Å²	140	124.2 Å²	124.2	65%	0.654	63%	0.634	S	S	*	*			cis	92.2	125.5	35.9	-170	-179.4	-114.5	0	0	114.6
1462	Q	25.3	Very low	29	Very low	145 Å²	145	126.6 Å²	126.6	68%	0.678	65%	0.646	S	S	*	*			trans	56.7	121.3	157.9	-72.5	173.5	4.1	0	0	123.2
1463	Q	25.1	Very low	29	Very low	144 Å²	144	128.1 Å²	128.1	67%	0.673	66%	0.659	S	S	*	*				76.5	137.2	124	-73.2	179.6	-106.3	0	0	123.9
1464	D	25.8	Very low	28.8	Very low	116 Å²	116	128.8 Å²	128.8	62%	0.62	67%	0.672	S	S	*	*			trans	71.8	115.2	133.4	-62.6	-20.6	0	0	0	124.1
1465	H	26.6	Very low	28.6	Very low	167 Å²	167	133.9 Å²	133.9	77%	0.773	68%	0.683	S	S	*	*			trans	73.7	123.7	130.1	-85.1	-86.2	0	0	0	122.7
1466	S	28.4	Very low	29	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	69%	0.694	S	S	*	*			trans	77.9	142.4	150.5	81.7	0	0	0	0	116.4
1467	K	33	Very low	29.1	Very low	171 Å²	171	137 Å²	137	74%	0.743	71%	0.706	S	S	*	*			cis	-146.5	145.5	38	-74.4	174.1	179.3	165.4	0	114.8
1468	I	29.4	Very low	29	Very low	137 Å²	137	134.8 Å²	134.8	70%	0.703	69%	0.69	S	S	*	*				49	116	127.4	-50.4	168	0	0	0	115.8
1469	T	36.4	Very low	29	Very low	134 Å²	134	134 Å²	134	82%	0.822	69%	0.692	S	S	*	*				-151.1	118.3	77.3	-58.8	0	0	0	0	115.2
1470	Q	32	Very low	29.1	Very low	151 Å²	151	132.3 Å²	132.3	71%	0.706	69%	0.688	S	S	*	*			trans	5.7	126.1	158.2	-60.5	-168	11.4	0	0	123.5
1471	K	29.3	Very low	29	Very low	171 Å²	171	135 Å²	135	74%	0.743	71%	0.708	S	S	*	*				93.9	114.5	120.4	-83.7	-177.9	170	177.9	0	122.6
1472	L	26.3	Very low	29.1	Very low	148 Å²	148	135.4 Å²	135.4	78%	0.775	71%	0.714	S	S	*	*			trans	94.7	145.6	134.7	-66.5	165.5	0	0	0	119.9
1473	T	32.3	Very low	29.2	Very low	139 Å²	139	135.9 Å²	135.9	85%	0.853	72%	0.721	S	S	*	*			trans	58.9	101.7	176.1	50.3	0	0	0	0	118.3
1474	G	28.2	Very low	29.3	Very low	70 Å²	70	133.9 Å²	133.9	72%	0.722	72%	0.722	S	S	*	*			trans	-79.3	-173.2	147.9	0	0	0	0	0	110.7
1475	Y	26.3	Very low	29.5	Very low	229 Å²	229	134.6 Å²	134.6	90%	0.898	73%	0.731	S	S	*	*			cis	-143	145.4	16.2	-110.8	-105.7	0	0	0	108.2
1476	N	36.3	Very low	29.6	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	74%	0.736	S	S	*	*			trans	-164	132.5	168.3	-99.2	-26.4	0	0	0	113.6
1477	N	32.3	Very low	29.5	Very low	122 Å²	122	135.6 Å²	135.6	65%	0.652	74%	0.735	S	S	*	*				61.9	144	128.6	-57.2	5	0	0	0	120.3
1478	Q	28.1	Very low	29.3	Very low	117 Å²	117	134.8 Å²	134.8	55%	0.547	74%	0.738	S	S	.	*				60.9	138.5	53.5	-79.7	176.6	-33	0	0	112.3	S1131	S1131-Q1478 PolarHBondContact O-NE2 2.84Å
1479	S	27.7	Very low	29.2	Very low	70 Å²	70	137 Å²	137	49%	0.49	74%	0.743	S	S	.	*			cis	-157.7	-144.4	1.1	50.9	0	0	0	0	110.9	E1130	E1130-S1479 PolarHBondContact OE2-OG 3.2Å
1480	T	29	Very low	28.6	Very low	102 Å²	102	135.8 Å²	135.8	63%	0.626	74%	0.739	S	S	*	*			trans	61.5	96.4	162.1	56.4	0	0	0	0	121.9
1481	T	26.3	Very low	28.3	Very low	113 Å²	113	136.1 Å²	136.1	69%	0.693	74%	0.744	S	S	*	*				29.2	149.7	111.4	46.4	0	0	0	0	124.1
1482	L	26.8	Very low	28.2	Very low	149 Å²	149	134 Å²	134	78%	0.78	74%	0.741	S	S	*	*			trans	80.6	125.8	147.1	-75.9	158.9	0	0	0	121.5
1483	L	26.8	Very low	28.3	Very low	156 Å²	156	133.4 Å²	133.4	82%	0.817	74%	0.743	S	S	*	*			trans	58	113.9	151.7	-62.4	163.9	0	0	0	117
1484	S	28.3	Very low	27.9	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	74%	0.736	S	S	*	*				-173.6	179.8	59.5	50.3	0	0	0	0	114.6
1485	T	28.8	Very low	27.9	Very low	131 Å²	131	140.1 Å²	140.1	80%	0.804	74%	0.743	S	S	*	*			trans	70.8	76.9	169.2	62.4	0	0	0	0	119.3
1486	H	28.9	Very low	27.9	Very low	191 Å²	191	132.8 Å²	132.8	88%	0.884	73%	0.726	S	S	*	*			trans	-53.3	149.4	142.2	-81.1	-64.7	0	0	0	110.1
1487	S	27.8	Very low	27.3	Very low	99 Å²	99	134.6 Å²	134.6	69%	0.692	73%	0.727	S	S	*	*				172.7	168.6	83.1	48.7	0	0	0	0	112.7
1488	L	27.8	Very low	27.2	Very low	155 Å²	155	137.5 Å²	137.5	81%	0.812	75%	0.749	S	S	*	*			trans	65.1	113.6	-175	-63	109.3	0	0	0	114.8
1489	K	27.2	Very low	27.1	Very low	182 Å²	182	138.6 Å²	138.6	79%	0.791	76%	0.759	S	S	*	*			cis	93	122.1	40	-76.1	-169.5	173	-174.2	0	114
1490	C	24.4	Very low	27.1	Very low	109 Å²	109	142.2 Å²	142.2	74%	0.736	77%	0.773	S	S	*	*			trans	37.3	118.5	137.9	-42.9	0	0	0	0	119
1491	L	24.8	Very low	27	Very low	158 Å²	158	144.4 Å²	144.4	83%	0.827	78%	0.781	S	S	*	*				-164.4	179.6	96	-136	62.2	0	0	0	112.9
1492	N	27.9	Very low	27	Very low	126 Å²	126	146.2 Å²	146.2	67%	0.674	79%	0.786	S	S	*	*			trans	74	70.5	162.6	-67.2	22.3	0	0	0	119.9
1493	V	27.7	Very low	27.1	Very low	136 Å²	136	146.1 Å²	146.1	82%	0.824	79%	0.787	S	S	*	*				-57.9	150.2	120.9	174.5	0	0	0	0	108.8
1494	Q	25.2	Very low	27.1	Very low	148 Å²	148	145.4 Å²	145.4	69%	0.692	79%	0.785	S	S	*	*			trans	80.2	93.7	-168.8	-52.8	-176	-61.9	0	0	115.5
1495	K	28.1	Very low	27	Very low	203 Å²	203	148.5 Å²	148.5	88%	0.883	79%	0.79	S	S	*	*				-97.6	117	86.8	-80.1	-165.6	172.7	-167.9	0	106.8
1496	S	25.8	Very low	26.9	Very low	75 Å²	75	149.8 Å²	149.8	52%	0.524	79%	0.789	S	S	.	*				64.3	98.8	73.1	77.4	0	0	0	0	109.8
1497	F	24.7	Very low	26.7	Very low	182 Å²	182	146.4 Å²	146.4	80%	0.798	78%	0.781	S	S	*	*				62.2	108.1	86.1	-86.8	-102.9	0	0	0	111
1498	V	29	Very low	26.6	Very low	184 Å²	184	150.7 Å²	150.7	100%	1.115	79%	0.789	S	S	*	*				-67.3	0	104.5	179.5	0	0	0	0	105.7

Retrieved 1,498 of 1,498 residues in 1070.8 ms (Link to these results)

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