A0A087YME0_POEFO Loading...

Zinc finger protein 516

AlphaFold DB , UniProt , Accession A0A087YME0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,096 aa.

						>A0A087YME0_POEFO|A0A087YME0
MNPRDSVEVMETQEKLTGKKANTEKEFEGEDDKIPEAYNCNICGRSFPFLSSFSQHMRRHTGARPYKCPYCDHRASQKGNLKVHIRSHKLGTLSSHHSNEDEEGGAEEEEMKVSEGLDGGTSPTKSSSACNKMVNGDVGEESRRKMPARSMKREKSVSNQRPYCCRLCGYEALREDQLLSHIEKVHITADAEEDTVTVKEEVITEPDTVQPQSDGTFPCETCGQVFSQAWFLKSHMKKHAGILDHCCRICGRRFREAWFLKSHMKTHNTRSRSRSKADSAEPPTTINDVAQDPDITTTSVTSVYQMCSKCGNLFHSKESLRAHDKVHSPNCGRKSPVHCRSTDDEDSPAAKRRLLEYFNLQCVEGKTPGEEEDREKRTLGQRIPELDPVCSYQAWQLATKGRVVEPVEPSYKASYSGGSMEDEALTDAAVVYEKENSRYVLQGQEKRSSGRRSSSGLGSHTSSGDRTPESFSDSEYRPSSRQDKRRPSQSSSKGKECFECGKMFRSRHQMIVHQRVHRKDGGRAPAGDKERTGRDDQWGPTSDPESGSPSRPSTPGYGDSPPASTLGDQASEMGTSNSGEIADEKPYICSLCDFVTAESQAYFTHVRVQHQAASKDRPSPVPSPSSSSDRGFLSSYPKLKKAFTPGLKTSPNAYLSARPSSSDPTMIPMDLCVRANGIRGVASITLDKKNLPSHKCSFCSHSTRYPEVLWMHQTVAHRINSSSSNLAPKWAVKNNSKTSRDNSSSSKRRTGPPPVLEGKECQPLPPTVRSQRTRPPTCTSEVVKKSRPVSHAVTPSSSSTPCTPSSRISSSASGKQVGRVPVRPVSSSSTSKRMEDQSQRFRPKAEIYPRVSTQAPSGSSEKNTGSRSRPPASGLSSSTASRMADRYMMPQEGLGFMLTNQHSLSEYSRARGSSHQPLPSSQIHSRPNPSRPNAINHCLPTTHSYGISQTQGAVAQASSSPSSSSIPSESRRDVKQEPIGETPDMSTDVLGYLKKYNPHDLAPFYHHWGAANSLMDPTGMLRSLMRPGQCFCRECGKSFSQPSHLRTHMRSHTVGFDYNGLHRGTDAHTTASEAPKQGKGHSAASSAHTEHLRKGT
					

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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	26.6	Very low	31	Very low	245 Å²	245	146 Å²	146	100%	1.207	76%	0.756	S	S	*	*				0	155.4	0	-64	166.1	83.2	0	0	107.8
2	N	34.2	Very low	31	Very low	153 Å²	153	142.1 Å²	142.1	82%	0.818	74%	0.743	S	S	*	*			trans	-67.7	165.9	163.5	-124.1	-7.2	0	0	0	108.7
3	P	46.6	Very low	31	Very low	97 Å²	97	143.2 Å²	143.2	63%	0.63	74%	0.742	S	S	*	*			cis	-151.5	178.2	45.5	45.1	-25.4	0	0	0	117.7
4	R	30.6	Very low	31.3	Very low	219 Å²	219	142 Å²	142	83%	0.826	73%	0.732	S	S	*	*			trans	54.2	162	132.4	-76.5	173.6	178.7	173.4	-0.2	121.2
5	D	32.6	Very low	31.7	Very low	124 Å²	124	142.5 Å²	142.5	66%	0.663	73%	0.726	S	S	*	*			cis	-175.4	143.7	-38	-126.7	-65.1	0	0	0	108.3
6	S	29.9	Very low	31.8	Very low	98 Å²	98	142.2 Å²	142.2	69%	0.685	73%	0.726	S	S	*	*			trans	55.7	179.2	145.8	-64.4	0	0	0	0	120.2
7	V	27.9	Very low	31.8	Very low	133 Å²	133	141.5 Å²	141.5	81%	0.806	73%	0.73	S	S	*	*			trans	69.7	137.8	166	-171.9	0	0	0	0	117.2
8	E	28.7	Very low	31.7	Very low	166 Å²	166	137.7 Å²	137.7	78%	0.776	73%	0.732	S	S	*	*			cis	-169	-162.5	-35.7	-148.4	173.5	-174	0	0	107.9
9	V	25.8	Very low	32	Very low	95 Å²	95	141.7 Å²	141.7	58%	0.576	74%	0.742	S	S	*	*			trans	67.6	106.3	137.8	156.5	0	0	0	0	119.8
10	M	25.7	Very low	32.2	Very low	141 Å²	141	144.9 Å²	144.9	70%	0.695	75%	0.749	S	S	*	*			trans	57.6	-176.5	132.8	-43.2	-166.4	-63.6	0	0	117.4
11	E	32.3	Very low	32.1	Very low	135 Å²	135	142.6 Å²	142.6	63%	0.631	75%	0.752	S	S	*	*			cis	-142.5	117.6	-7	-141.4	143.4	-170.8	0	0	106.3
12	T	30.5	Very low	32.5	Very low	99 Å²	99	138.1 Å²	138.1	61%	0.607	73%	0.733	S	S	*	*				84.1	159	108.4	61.2	0	0	0	0	116.7
13	Q	31.3	Very low	32.3	Very low	156 Å²	156	136.1 Å²	136.1	73%	0.729	73%	0.726	S	S	*	*			trans	65.7	145.9	146.2	-77.3	170.3	-72.8	0	0	118.9
14	E	35.3	Very low	31.6	Very low	127 Å²	127	140.1 Å²	140.1	59%	0.593	74%	0.736	S	S	*	*			cis	-167.5	171.8	-15.3	-124.4	-179.3	147.5	0	0	107.1
15	K	36.9	Very low	32.3	Very low	150 Å²	150	138.9 Å²	138.9	65%	0.652	74%	0.737	S	S	*	*			cis	-163.4	175.3	-5.6	-156.1	176.6	-165.8	136.4	0	107.7
16	L	33.5	Very low	32.2	Very low	137 Å²	137	142.7 Å²	142.7	72%	0.717	75%	0.751	S	S	*	*			trans	67.5	153.3	157.8	-56.6	-179.9	0	0	0	119
17	T	31.3	Very low	33	Very low	131 Å²	131	147.4 Å²	147.4	80%	0.804	76%	0.76	S	S	*	*				178.1	139.6	-75.9	42.4	0	0	0	0	109.7
18	G	30.3	Very low	33.3	Very low	73 Å²	73	150.2 Å²	150.2	75%	0.753	76%	0.764	S	S	*	*			trans	133.5	140.2	159.4	0	0	0	0	0	114.1
19	K	37.4	Very low	33.7	Very low	214 Å²	214	145.4 Å²	145.4	93%	0.93	76%	0.758	S	S	*	*			cis	-152.7	178.3	-14.5	-133.9	167.5	-175.4	176.4	0	109.3
20	K	36.4	Very low	34.8	Very low	205 Å²	205	150.4 Å²	150.4	89%	0.891	78%	0.776	S	S	*	*			trans	-70.3	169.4	-173.4	-59.2	-179.6	-179.1	179.6	0	111.6
21	A	30.5	Very low	35.5	Very low	97 Å²	97	150.8 Å²	150.8	80%	0.802	78%	0.781	S	S	*	*			cis	-156.4	-175.1	28	0	0	0	0	0	115.5
22	N	34.9	Very low	36.6	Very low	151 Å²	151	152.3 Å²	152.3	81%	0.807	79%	0.793	S	S	*	*			trans	-61.4	166.9	170.1	-68.6	-17.8	0	0	0	112.6
23	T	30.2	Very low	37.6	Very low	111 Å²	111	154.9 Å²	154.9	68%	0.681	80%	0.796	S	S	*	*				179	156.8	105	-87	0	0	0	0	113.6
24	E	31.8	Very low	38.7	Very low	180 Å²	180	154.2 Å²	154.2	84%	0.841	80%	0.796	S	S	*	*			trans	63.7	153.3	171.4	-100.7	90.5	-103.8	0	0	121.5
25	K	44.3	Very low	39.7	Very low	194 Å²	194	153.3 Å²	153.3	84%	0.843	80%	0.801	S	S	*	*			trans	-98.7	153.4	161.9	-45.1	157.8	177.3	169.1	0	107
26	E	31.6	Very low	41.5	Very low	204 Å²	204	152.5 Å²	152.5	95%	0.953	80%	0.8	S	S	*	*			trans	-134.7	165.6	136	-72	-156.1	124.6	0	0	110.2
27	F	46.5	Very low	43.8	Very low	197 Å²	197	148.4 Å²	148.4	86%	0.864	79%	0.785	S	S	*	*			trans	-122.4	125.5	-173.1	147.3	-83.8	0	0	0	107.4
28	E	34.9	Very low	46.5	Very low	192 Å²	192	146.6 Å²	146.6	90%	0.897	77%	0.765	S	S	*	*			trans	-157.5	160.4	164	-79.8	-142	146.2	0	0	111.3
29	G	35.9	Very low	49.4	Very low	64 Å²	64	147.5 Å²	147.5	66%	0.66	75%	0.752	S	S	*	*			trans	76.5	76.5	153.5	0	0	0	0	0	118.6	D31	G29-D31 PolarHBondContact O-N 3.43Å
30	E	48.9	Very low	52	Low	201 Å²	201	137.4 Å²	137.4	94%	0.939	71%	0.708	S	S	*	*			trans	-87.8	82.8	153.4	-166.6	171.8	-153.1	0	0	109.1
31	D	41.1	Very low	54.3	Low	149 Å²	149	135.1 Å²	135.1	80%	0.797	71%	0.706	S	S	*	*			trans	-71.8	135.7	177.1	-91.9	-53.3	0	0	0	112.4	G29 K33	G29-D31 PolarHBondContact O-N 3.43Å; D31-K33 VanDerWaalsContact C-N 3.29Å; D31-K33 PolarHBondContact O-N 3.42Å
32	D	54.8	Low	56.9	Low	166 Å²	166	135.4 Å²	135.4	89%	0.888	69%	0.693	S	S	*	*			trans	-70.8	76.3	-177.3	-124.5	-39	0	0	0	111.5	I34	D32-I34 PolarHBondContact O-N 3.22Å
33	K	51.2	Low	59.4	Low	153 Å²	153	130.7 Å²	130.7	67%	0.665	67%	0.671	S	S	*	*			trans	-66.9	97	-174.7	-166.7	-178.5	-172.9	-56.9	0	111.3	D31 E36	D31-K33 VanDerWaalsContact C-N 3.29Å; D31-K33 PolarHBondContact O-N 3.42Å; K33-E36 IonicContact NZ-OE2 3.83Å; K33-E36 PolarHBondContact NZ-OE2 3.41Å
34	I	54.5	Low	62.1	Low	142 Å²	142	128.7 Å²	128.7	73%	0.728	67%	0.673	S	S	*	*			trans	-39.6	125.6	175.2	-58.9	173	0	0	0	110.5	D32 E36	D32-I34 PolarHBondContact O-N 3.22Å; I34-E36 PolarHBondContact O-N 3.14Å
35	P	55.9	Low	64.7	Low	109 Å²	109	127.7 Å²	127.7	71%	0.708	66%	0.661	S	S	*	*			trans	-68.5	107.4	-174.8	25.9	-33.9	0	0	0	111.1	A37	P35-A37 PolarHBondContact O-N 3.13Å; P35-A37 VanDerWaalsContact O-N 3.16Å
36	E	74.8	Confident	66.9	Low	133 Å²	133	122.1 Å²	122.1	62%	0.621	65%	0.646	S	S	*	*			trans	-52.3	118.1	-179.9	-85.9	171.3	80.2	0	0	111.9	K33 I34 Y38	K33-E36 IonicContact NZ-OE2 3.83Å; K33-E36 PolarHBondContact NZ-OE2 3.41Å; I34-E36 PolarHBondContact O-N 3.14Å; E36-Y38 WeakPolarHBondContact O-CD2 3.33Å; E36-Y38 VanDerWaalsContact O-CE2 3.31Å; E36-Y38 WeakPolarHBondContact O-CE2 3.4Å
37	A	82.8	Confident	69.7	Low	51 Å²	51	114.2 Å²	114.2	42%	0.421	61%	0.609	S	S	.	*			trans	-77	127.1	178.7	0	0	0	0	0	110.7	P35 N39	P35-A37 PolarHBondContact O-N 3.13Å; P35-A37 VanDerWaalsContact O-N 3.16Å; A37-N39 PolarHBondContact O-N 3.18Å
38	Y	87.6	Confident	71.7	Confident	93 Å²	93	109 Å²	109	37%	0.365	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.4	108.3	-176.3	-64	-90.7	0	0	0	110.2	E36 S46 F47 L50 F53	E36-Y38 WeakPolarHBondContact O-CD2 3.33Å; E36-Y38 VanDerWaalsContact O-CE2 3.31Å; E36-Y38 WeakPolarHBondContact O-CE2 3.4Å; Y38-S46 CarbonylContact O-C 3.57Å; Y38-F47 PolarHBondContact N-O 2.92Å; Y38-F47 PolarHBondContact O-N 3.28Å; Y38-L50 HydrophobicContact CD1-CB 4.12Å; Y38-L50 HydrophobicContact CD1-CD1 3.73Å; Y38-L50 HydrophobicContact CD1-CG 4.49Å; Y38-L50 HydrophobicContact CD2-CB 4.27Å; Y38-L50 VanDerWaalsContact CD2-N 3.34Å; Y38-L50 HydrophobicContact CE1-CB 3.83Å; Y38-L50 HydrophobicContact CE1-CD1 3.79Å; Y38-L50 HydrophobicContact CE1-CD2 4.48Å; Y38-L50 HydrophobicContact CE1-CG 4.23Å; Y38-L50 HydrophobicContact CE2-CB 4.02Å; Y38-L50 HydrophobicContact CG-CB 4.33Å; Y38-L50 HydrophobicContact CG-CD1 4.48Å; Y38-F53 HydrophobicContact CD1-CD1 4.42Å; Y38-F53 HydrophobicContact CG-CB 4.43Å; Y38-F53 HydrophobicContact CG-CD1 4.5Å
39	N	90.3	Very high	74.2	Confident	92 Å²	92	106 Å²	106	49%	0.492	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.7	141.3	-173.3	-64.5	-37.8	0	0	0	112.7	A37 S46 F53	A37-N39 PolarHBondContact O-N 3.18Å; N39-S46 VanDerWaalsContact OD1-CA 3.28Å; N39-S46 WeakPolarHBondContact OD1-CA 3.45Å; N39-S46 WeakPolarHBondContact OD1-CB 3.47Å; N39-F53 WeakPolarHBondContact O-CE2 3.41Å; N39-F53 WeakPolarHBondContact O-CZ 3.23Å
40	C	92.6	Very high	76.8	Confident	1 Å²	1	107.7 Å²	107.7	1%	0.007	57%	0.572	C	S	.	*			trans	-91.8	106.2	175.3	-178.3	0	0	0	0	112.5	I42 C43 G44 R45 F53 H56 M57	C40-I42 PolarHBondContact O-N 3.39Å; C40-C43 PolarHBondContact O-N 3.3Å; C40-C43 VanDerWaalsContact O-N 3.1Å; C40-G44 WeakPolarHBondContact O-CA 3.34Å; C40-G44 PolarHBondContact O-N 3.41Å; C40-R45 WeakPolarHBondContact CB-O 3.48Å; C40-R45 PolarHBondContact N-O 2.88Å; C40-F53 HydrophobicContact CB-CD2 4.43Å; C40-F53 HydrophobicContact CB-CE2 3.85Å; C40-H56 WeakPolarHBondContact CB-NE2 3.26Å; C40-H56 PolarHBondContact SG-NE2 3.28Å; C40-M57 HydrophobicContact CB-SD 4.46Å
41	N	85	Confident	78.6	Confident	158 Å²	158	102 Å²	102	85%	0.845	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-6.6	177.6	-56.5	3.5	0	0	0	114.5
42	I	85	Confident	80.9	Confident	102 Å²	102	97 Å²	97	52%	0.523	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-15.5	-179.4	-47.4	173.8	0	0	0	112.1	C40 M57 H60	C40-I42 PolarHBondContact O-N 3.39Å; I42-M57 HydrophobicContact CD1-CE 3.82Å; I42-H60 HydrophobicContact CD1-CB 3.72Å; I42-H60 VanDerWaalsContact CG2-ND1 3.28Å; I42-H60 WeakPolarHBondContact CG2-ND1 3.18Å
43	C	88.4	Confident	82.6	Confident	53 Å²	53	91 Å²	91	36%	0.358	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.6	15.5	176.2	73.1	0	0	0	0	116.3	C40 R45 H56 H60	C40-C43 PolarHBondContact O-N 3.3Å; C40-C43 VanDerWaalsContact O-N 3.1Å; C43-R45 PolarHBondContact O-N 3.31Å; C43-R45 VanDerWaalsContact O-N 3.07Å; C43-H56 PolarHBondContact SG-CE1 3.35Å; C43-H56 PolarHBondContact SG-NE2 2.87Å; C43-H60 PolarHBondContact SG-NE2 3.5Å; C43-H60 VanDerWaalsContact SG-NE2 3.44Å
44	G	85.6	Confident	84.3	Confident	69 Å²	69	86.1 Å²	86.1	71%	0.711	48%	0.483	S	S	*	.			trans	68.3	2.5	175.4	0	0	0	0	0	115.9	C40 S46	C40-G44 WeakPolarHBondContact O-CA 3.34Å; C40-G44 PolarHBondContact O-N 3.41Å; G44-S46 PolarHBondContact O-N 3.09Å
45	R	87	Confident	85.9	Confident	159 Å²	159	83.4 Å²	83.4	60%	0.6	47%	0.467	S	S	*	.			trans	-77.5	123.7	-176.4	-69.8	-176.3	-179.7	-149.4	-4.3	112	C40 C43 F47	C40-R45 WeakPolarHBondContact CB-O 3.48Å; C40-R45 PolarHBondContact N-O 2.88Å; C43-R45 PolarHBondContact O-N 3.31Å; C43-R45 VanDerWaalsContact O-N 3.07Å; R45-F47 HydrophobicContact CB-CE2 3.62Å; R45-F47 HydrophobicContact CB-CZ 3.84Å; R45-F47 WeakPolarHBondContact O-CD2 3.46Å; R45-F47 WeakPolarHBondContact O-CE2 3.24Å
46	S	90.3	Very high	87.4	Confident	76 Å²	76	79.5 Å²	79.5	53%	0.531	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	150.2	168.9	59.6	0	0	0	0	111.7	Y38 N39 G44	Y38-S46 CarbonylContact O-C 3.57Å; N39-S46 VanDerWaalsContact OD1-CA 3.28Å; N39-S46 WeakPolarHBondContact OD1-CA 3.45Å; N39-S46 WeakPolarHBondContact OD1-CB 3.47Å; G44-S46 PolarHBondContact O-N 3.09Å
47	F	91.5	Very high	88	Confident	39 Å²	39	75.3 Å²	75.3	17%	0.171	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	133.6	174.9	-62.4	-88.6	0	0	0	110.4	Y38 R45 F49 F53 H56	Y38-F47 PolarHBondContact N-O 2.92Å; Y38-F47 PolarHBondContact O-N 3.28Å; R45-F47 HydrophobicContact CB-CE2 3.62Å; R45-F47 HydrophobicContact CB-CZ 3.84Å; R45-F47 WeakPolarHBondContact O-CD2 3.46Å; R45-F47 WeakPolarHBondContact O-CE2 3.24Å; F47-F49 PolarHBondContact O-N 3.46Å; F47-F49 VanDerWaalsContact O-N 3.12Å; F47-F53 HydrophobicContact CB-CB 4.14Å; F47-F53 HydrophobicContact CD2-CB 4.17Å; F47-F53 AromaticContact CD2-CD2 3.99Å; F47-F53 HydrophobicContact CD2-CD2 3.99Å; F47-F53 HydrophobicContact CE2-CD2 4.4Å; F47-F53 HydrophobicContact CG-CB 4.34Å; F47-H56 HydrophobicContact CE1-CB 4Å; F47-H56 HydrophobicContact CE2-CB 3.84Å; F47-H56 AromaticContact CE2-CD2 3.25Å; F47-H56 WeakPolarHBondContact CE2-CD2 3.04Å; F47-H56 AromaticContact CE2-CG 3.48Å; F47-H56 VanDerWaalsContact CE2-CG 3.48Å; F47-H56 AromaticContact CE2-NE2 3.88Å; F47-H56 HydrophobicContact CZ-CB 3.51Å; F47-H56 AromaticContact CZ-CD2 3.55Å; F47-H56 AromaticContact CZ-CG 3.25Å; F47-H56 AromaticContact CZ-ND1 3.68Å
48	P	87.3	Confident	88.2	Confident	88 Å²	88	75.8 Å²	75.8	57%	0.571	41%	0.411	S	S	*	.	S	Bend	trans	-70.5	-7.5	-179.4	28.8	-35.9	0	0	0	114
49	F	88.9	Confident	87.9	Confident	129 Å²	129	81.7 Å²	81.7	57%	0.566	43%	0.433	S	S	*	.	S	Bend	trans	-139.5	134.8	-178.1	-54.6	-63.3	0	0	0	111.9	F47 S51 S52 F53	F47-F49 PolarHBondContact O-N 3.46Å; F47-F49 VanDerWaalsContact O-N 3.12Å; F49-S51 PolarHBondContact O-N 3.14Å; F49-S51 VanDerWaalsContact O-N 3.15Å; F49-S52 WeakPolarHBondContact O-CB 3.38Å; F49-S52 PolarHBondContact O-N 3.41Å; F49-F53 PolarHBondContact O-N 2.99Å
50	L	88.9	Confident	87.7	Confident	98 Å²	98	80.6 Å²	80.6	51%	0.513	43%	0.425	S	S	.	.	H	α-helix	trans	-54.7	-30.8	173.5	-179.4	60.2	0	0	0	112.8	Y38 F53 S54	Y38-L50 HydrophobicContact CD1-CB 4.12Å; Y38-L50 HydrophobicContact CD1-CD1 3.73Å; Y38-L50 HydrophobicContact CD1-CG 4.49Å; Y38-L50 HydrophobicContact CD2-CB 4.27Å; Y38-L50 VanDerWaalsContact CD2-N 3.34Å; Y38-L50 HydrophobicContact CE1-CB 3.83Å; Y38-L50 HydrophobicContact CE1-CD1 3.79Å; Y38-L50 HydrophobicContact CE1-CD2 4.48Å; Y38-L50 HydrophobicContact CE1-CG 4.23Å; Y38-L50 HydrophobicContact CE2-CB 4.02Å; Y38-L50 HydrophobicContact CG-CB 4.33Å; Y38-L50 HydrophobicContact CG-CD1 4.48Å; L50-F53 HydrophobicContact CD1-CD1 4.17Å; L50-S54 WeakPolarHBondContact O-CB 3.45Å; L50-S54 PolarHBondContact O-N 3.32Å
51	S	87.3	Confident	87.1	Confident	83 Å²	83	85 Å²	85	58%	0.58	45%	0.452	S	S	*	.	H	α-helix	trans	-66.7	-44.2	175.8	55.5	0	0	0	0	112.5	F49 Q55	F49-S51 PolarHBondContact O-N 3.14Å; F49-S51 VanDerWaalsContact O-N 3.15Å; S51-Q55 VanDerWaalsContact O-CB 3.29Å; S51-Q55 WeakPolarHBondContact O-CB 3.44Å; S51-Q55 PolarHBondContact O-N 3.06Å
52	S	88.5	Confident	87	Confident	44 Å²	44	79.9 Å²	79.9	31%	0.308	44%	0.437	S	S	.	.	H	α-helix	trans	-66.2	-42.3	173.8	-62.4	0	0	0	0	111.3	F49 Q55 H56	F49-S52 WeakPolarHBondContact O-CB 3.38Å; F49-S52 PolarHBondContact O-N 3.41Å; S52-Q55 PolarHBondContact O-N 3.16Å; S52-H56 WeakPolarHBondContact O-CB 3.5Å; S52-H56 PolarHBondContact O-N 2.87Å
53	F	91.6	Very high	86.9	Confident	40 Å²	40	76.9 Å²	76.9	18%	0.175	43%	0.427	C	S	.	.	H	α-helix	trans	-62.7	-49.4	174.9	176.3	-126.7	0	0	0	112.4	Y38 N39 C40 F47 F49 L50 Q55 H56 M57	Y38-F53 HydrophobicContact CD1-CD1 4.42Å; Y38-F53 HydrophobicContact CG-CB 4.43Å; Y38-F53 HydrophobicContact CG-CD1 4.5Å; N39-F53 WeakPolarHBondContact O-CE2 3.41Å; N39-F53 WeakPolarHBondContact O-CZ 3.23Å; C40-F53 HydrophobicContact CB-CD2 4.43Å; C40-F53 HydrophobicContact CB-CE2 3.85Å; F47-F53 HydrophobicContact CB-CB 4.14Å; F47-F53 HydrophobicContact CD2-CB 4.17Å; F47-F53 AromaticContact CD2-CD2 3.99Å; F47-F53 HydrophobicContact CD2-CD2 3.99Å; F47-F53 HydrophobicContact CE2-CD2 4.4Å; F47-F53 HydrophobicContact CG-CB 4.34Å; F49-F53 PolarHBondContact O-N 2.99Å; L50-F53 HydrophobicContact CD1-CD1 4.17Å; F53-Q55 VanDerWaalsContact C-N 3.26Å; F53-Q55 PolarHBondContact O-N 2.66Å; F53-H56 CarbonylContact O-C 3.55Å; F53-H56 WeakPolarHBondContact O-CB 3.4Å; F53-H56 PolarHBondContact O-N 2.86Å; F53-M57 HydrophobicContact CD2-CG 3.9Å; F53-M57 HydrophobicContact CD2-SD 4.47Å; F53-M57 HydrophobicContact CE1-CG 4.21Å; F53-M57 HydrophobicContact CE2-CG 3.35Å; F53-M57 HydrophobicContact CE2-SD 3.51Å; F53-M57 VanDerWaalsContact CE2-SD 3.51Å; F53-M57 HydrophobicContact CG-CG 4.49Å; F53-M57 HydrophobicContact CZ-CG 3.55Å; F53-M57 HydrophobicContact CZ-SD 3.79Å; F53-M57 WeakPolarHBondContact O-CG 3.37Å; F53-M57 PolarHBondContact O-N 2.95Å
54	S	87.4	Confident	86.7	Confident	49 Å²	49	80.1 Å²	80.1	34%	0.343	43%	0.432	S	S	.	.	H	α-helix	trans	-58.6	-36.3	174.5	176.7	0	0	0	0	112.5	L50 R58	L50-S54 WeakPolarHBondContact O-CB 3.45Å; L50-S54 PolarHBondContact O-N 3.32Å; S54-R58 WeakPolarHBondContact O-CG 3.13Å; S54-R58 PolarHBondContact O-NE 3.26Å; S54-R58 PolarHBondContact OG-NH2 3.38Å; S54-R58 VanDerWaalsContact OG-NH2 3.15Å
55	Q	87.9	Confident	86.6	Confident	86 Å²	86	80.4 Å²	80.4	40%	0.402	42%	0.421	S	S	.	.	H	α-helix	trans	-69.1	-40.3	174.7	-174.3	-176	106.3	0	0	111.8	S51 S52 F53 Q77	S51-Q55 VanDerWaalsContact O-CB 3.29Å; S51-Q55 WeakPolarHBondContact O-CB 3.44Å; S51-Q55 PolarHBondContact O-N 3.06Å; S52-Q55 PolarHBondContact O-N 3.16Å; F53-Q55 VanDerWaalsContact C-N 3.26Å; F53-Q55 PolarHBondContact O-N 2.66Å; Q55-Q77 VanDerWaalsContact CD-CD 3.41Å; Q55-Q77 HydrophobicContact CG-CG 3.96Å
56	H	87.6	Confident	86.6	Confident	26 Å²	26	76.7 Å²	76.7	12%	0.12	41%	0.408	C	S	.	.	H	α-helix	trans	-66.9	-43.7	176.7	165.5	67.3	0	0	0	112.4	C40 C43 F47 S52 F53 R58 R59 H60	C40-H56 WeakPolarHBondContact CB-NE2 3.26Å; C40-H56 PolarHBondContact SG-NE2 3.28Å; C43-H56 PolarHBondContact SG-CE1 3.35Å; C43-H56 PolarHBondContact SG-NE2 2.87Å; F47-H56 HydrophobicContact CE1-CB 4Å; F47-H56 HydrophobicContact CE2-CB 3.84Å; F47-H56 AromaticContact CE2-CD2 3.25Å; F47-H56 WeakPolarHBondContact CE2-CD2 3.04Å; F47-H56 AromaticContact CE2-CG 3.48Å; F47-H56 VanDerWaalsContact CE2-CG 3.48Å; F47-H56 AromaticContact CE2-NE2 3.88Å; F47-H56 HydrophobicContact CZ-CB 3.51Å; F47-H56 AromaticContact CZ-CD2 3.55Å; F47-H56 AromaticContact CZ-CG 3.25Å; F47-H56 AromaticContact CZ-ND1 3.68Å; S52-H56 WeakPolarHBondContact O-CB 3.5Å; S52-H56 PolarHBondContact O-N 2.87Å; F53-H56 CarbonylContact O-C 3.55Å; F53-H56 WeakPolarHBondContact O-CB 3.4Å; F53-H56 PolarHBondContact O-N 2.86Å; H56-R58 PolarHBondContact O-N 3.33Å; H56-R58 VanDerWaalsContact O-N 3.13Å; H56-R59 WeakPolarHBondContact O-CB 3.44Å; H56-R59 PolarHBondContact O-N 2.99Å; H56-H60 AromaticContact CE1-CD2 3.8Å; H56-H60 AromaticContact CE1-NE2 3.33Å; H56-H60 PolarHBondContact CE1-NE2 3.24Å; H56-H60 VanDerWaalsContact CE1-NE2 3.33Å; H56-H60 AromaticContact NE2-CD2 3.66Å; H56-H60 AromaticContact NE2-NE2 3.37Å; H56-H60 PolarHBondContact NE2-NE2 3.36Å
57	M	87.2	Confident	86.7	Confident	46 Å²	46	78.5 Å²	78.5	23%	0.227	41%	0.406	C	S	.	.	H	α-helix	trans	-58.5	-27.8	178.8	-74	-60	-71.9	0	0	113.4	C40 I42 F53 R59 H60 T61	C40-M57 HydrophobicContact CB-SD 4.46Å; I42-M57 HydrophobicContact CD1-CE 3.82Å; F53-M57 HydrophobicContact CD2-CG 3.9Å; F53-M57 HydrophobicContact CD2-SD 4.47Å; F53-M57 HydrophobicContact CE1-CG 4.21Å; F53-M57 HydrophobicContact CE2-CG 3.35Å; F53-M57 HydrophobicContact CE2-SD 3.51Å; F53-M57 VanDerWaalsContact CE2-SD 3.51Å; F53-M57 HydrophobicContact CG-CG 4.49Å; F53-M57 HydrophobicContact CZ-CG 3.55Å; F53-M57 HydrophobicContact CZ-SD 3.79Å; F53-M57 WeakPolarHBondContact O-CG 3.37Å; F53-M57 PolarHBondContact O-N 2.95Å; M57-R59 PolarHBondContact O-N 3.21Å; M57-H60 PolarHBondContact O-N 3.07Å; M57-T61 PolarHBondContact O-N 3.48Å; M57-T61 PolarHBondContact O-OG1 3.36Å
58	R	86.8	Confident	86.8	Confident	60 Å²	60	76.8 Å²	76.8	23%	0.226	40%	0.398	C	S	.	.	H	α-helix	trans	-63.8	-16.7	172.7	-64.2	165.9	-146.5	-163.1	-1.8	113.9	S54 H56 G62 A63 S76	S54-R58 WeakPolarHBondContact O-CG 3.13Å; S54-R58 PolarHBondContact O-NE 3.26Å; S54-R58 PolarHBondContact OG-NH2 3.38Å; S54-R58 VanDerWaalsContact OG-NH2 3.15Å; H56-R58 PolarHBondContact O-N 3.33Å; H56-R58 VanDerWaalsContact O-N 3.13Å; R58-G62 CarbonylContact O-C 3.45Å; R58-G62 PolarHBondContact O-N 3.16Å; R58-A63 HydrophobicContact CB-CB 4.39Å; R58-A63 HydrophobicContact CG-CB 4.23Å; R58-A63 PolarHBondContact O-N 3.17Å; R58-S76 WeakPolarHBondContact CD-O 3.18Å; R58-S76 PolarHBondContact NH1-O 3.14Å
59	R	81.8	Confident	86.8	Confident	218 Å²	218	77.2 Å²	77.2	82%	0.823	40%	0.401	S	S	*	.	H	α-helix	trans	-74.4	-34.9	169.8	-172.4	178.5	175.4	111.6	4.3	111.5	H56 M57	H56-R59 WeakPolarHBondContact O-CB 3.44Å; H56-R59 PolarHBondContact O-N 2.99Å; M57-R59 PolarHBondContact O-N 3.21Å
60	H	84.4	Confident	86.8	Confident	68 Å²	68	77.4 Å²	77.4	32%	0.315	40%	0.399	S	S	.	.	H	α-helix	trans	-81.2	-43.2	178.4	-68.1	-77.2	0	0	0	112	I42 C43 H56 M57 G62	I42-H60 HydrophobicContact CD1-CB 3.72Å; I42-H60 VanDerWaalsContact CG2-ND1 3.28Å; I42-H60 WeakPolarHBondContact CG2-ND1 3.18Å; C43-H60 PolarHBondContact SG-NE2 3.5Å; C43-H60 VanDerWaalsContact SG-NE2 3.44Å; H56-H60 AromaticContact CE1-CD2 3.8Å; H56-H60 AromaticContact CE1-NE2 3.33Å; H56-H60 PolarHBondContact CE1-NE2 3.24Å; H56-H60 VanDerWaalsContact CE1-NE2 3.33Å; H56-H60 AromaticContact NE2-CD2 3.66Å; H56-H60 AromaticContact NE2-NE2 3.37Å; H56-H60 PolarHBondContact NE2-NE2 3.36Å; M57-H60 PolarHBondContact O-N 3.07Å; H60-G62 PolarHBondContact O-N 3Å
61	T	81.9	Confident	86.9	Confident	94 Å²	94	75 Å²	75	58%	0.577	39%	0.39	S	S	*	.	S	Bend	trans	-81.2	2.4	179.6	61.1	0	0	0	0	114.3	M57 A63	M57-T61 PolarHBondContact O-N 3.48Å; M57-T61 PolarHBondContact O-OG1 3.36Å; T61-A63 PolarHBondContact O-N 3.41Å; T61-A63 WeakPolarHBondContact OG1-CB 3.41Å
62	G	81.9	Confident	87	Confident	51 Å²	51	77 Å²	77	53%	0.526	39%	0.394	S	S	.	.			trans	60.5	6.1	-173.9	0	0	0	0	0	115	R58 H60 R64	R58-G62 CarbonylContact O-C 3.45Å; R58-G62 PolarHBondContact O-N 3.16Å; H60-G62 PolarHBondContact O-N 3Å; G62-R64 WeakPolarHBondContact O-CG 3.47Å; G62-R64 PolarHBondContact O-N 2.92Å; G62-R64 VanDerWaalsContact O-N 3.09Å
63	A	82.4	Confident	87	Confident	39 Å²	39	78.6 Å²	78.6	32%	0.322	40%	0.397	S	S	.	.			trans	-68.3	109.1	-166.5	0	0	0	0	0	112.3	R58 T61 P65	R58-A63 HydrophobicContact CB-CB 4.39Å; R58-A63 HydrophobicContact CG-CB 4.23Å; R58-A63 PolarHBondContact O-N 3.17Å; T61-A63 PolarHBondContact O-N 3.41Å; T61-A63 WeakPolarHBondContact OG1-CB 3.41Å; A63-P65 WeakPolarHBondContact O-CD 3.07Å
64	R	84.4	Confident	86.9	Confident	121 Å²	121	82.9 Å²	82.9	46%	0.457	41%	0.412	S	S	.	.			trans	-111.5	71.4	178.4	-65.1	163.7	80	157.4	1.8	110.3	G62 Y66 R74 A75	G62-R64 WeakPolarHBondContact O-CG 3.47Å; G62-R64 PolarHBondContact O-N 2.92Å; G62-R64 VanDerWaalsContact O-N 3.09Å; R64-Y66 VanDerWaalsContact C-N 3.27Å; R64-Y66 PolarHBondContact O-N 2.63Å; R64-R74 HydrophobicContact CB-CB 3.63Å; R64-R74 PolarHBondContact NE-O 3.48Å; R64-R74 PolarHBondContact NH2-O 3.36Å; R64-R74 VanDerWaalsContact O-CZ 3.32Å; R64-R74 PolarHBondContact O-NE 2.99Å; R64-R74 PolarHBondContact O-NH2 3.35Å; R64-R74 VanDerWaalsContact O-NH2 3.09Å; R64-A75 CarbonylContact C-O 3.48Å; R64-A75 VanDerWaalsContact CA-O 3.28Å; R64-A75 WeakPolarHBondContact CA-O 3.41Å
65	P	83.8	Confident	87	Confident	75 Å²	75	80.9 Å²	80.9	49%	0.487	40%	0.398	S	S	.	.			trans	-68.4	-20.9	-171.7	27.4	-35.9	0	0	0	114.2	A63 K67	A63-P65 WeakPolarHBondContact O-CD 3.07Å; P65-K67 PolarHBondContact O-N 3.31Å
66	Y	87.7	Confident	86.9	Confident	81 Å²	81	78.4 Å²	78.4	32%	0.318	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	91.7	-176.4	-51.5	-74.4	0	0	0	110.8	R64 R74 A75 S76 K78	R64-Y66 VanDerWaalsContact C-N 3.27Å; R64-Y66 PolarHBondContact O-N 2.63Å; Y66-R74 CarbonylContact O-C 3.57Å; Y66-R74 WeakPolarHBondContact O-CA 3.44Å; Y66-A75 WeakPolarHBondContact CD2-O 3.39Å; Y66-A75 PolarHBondContact N-O 3.46Å; Y66-A75 VanDerWaalsContact N-O 3.11Å; Y66-A75 PolarHBondContact O-N 3.03Å; Y66-S76 WeakPolarHBondContact CE2-O 3.31Å; Y66-K78 HydrophobicContact CD1-CB 4.36Å; Y66-K78 HydrophobicContact CE1-CB 4.1Å; Y66-K78 HydrophobicContact CE2-CB 4.4Å
67	K	90.6	Very high	86.9	Confident	113 Å²	113	79.7 Å²	79.7	49%	0.491	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	145	170.5	-163.1	-169.7	178	179.1	0	110.4	P65 D72 R74 L81	P65-K67 PolarHBondContact O-N 3.31Å; K67-D72 WeakPolarHBondContact CE-OD1 3.21Å; K67-D72 IonicContact NZ-OD1 2.91Å; K67-D72 PolarHBondContact NZ-OD1 2.99Å; K67-R74 HydrophobicContact CB-CG 4.21Å; K67-R74 HydrophobicContact CG-CG 4.04Å; K67-L81 WeakPolarHBondContact O-CD2 3.43Å
68	C	93.7	Very high	86.9	Confident	3 Å²	3	85 Å²	85	2%	0.02	42%	0.418	C	S	.	.			trans	-73.2	140.9	166.3	-168.9	0	0	0	0	111.1	Y70 C71 H73 L81 H84	C68-Y70 PolarHBondContact O-N 3.44Å; C68-Y70 PolarHBondContact SG-N 3.31Å; C68-C71 WeakPolarHBondContact CB-O 3.44Å; C68-H73 WeakPolarHBondContact CB-O 3.49Å; C68-H73 PolarHBondContact N-O 3.37Å; C68-L81 HydrophobicContact CB-CD1 3.77Å; C68-H84 VanDerWaalsContact SG-CD2 3.53Å
69	P	89.1	Confident	87.1	Confident	97 Å²	97	84.3 Å²	84.3	63%	0.63	43%	0.43	S	S	*	.	S	Bend	trans	-76.2	-10.4	172.3	30.7	-35.5	0	0	0	113.5	I85	P69-I85 HydrophobicContact CG-CD1 4.36Å
70	Y	86.9	Confident	87.4	Confident	134 Å²	134	77.8 Å²	77.8	53%	0.525	41%	0.411	S	S	.	.	S	Bend	trans	-109.8	-9.3	-174.8	-54.8	-64.2	0	0	0	114.4	C68 I85 H88	C68-Y70 PolarHBondContact O-N 3.44Å; C68-Y70 PolarHBondContact SG-N 3.31Å; Y70-I85 HydrophobicContact CD2-CG1 4.46Å; Y70-I85 HydrophobicContact CE2-CG2 4.07Å; Y70-H88 HydrophobicContact CD2-CB 4.02Å; Y70-H88 HydrophobicContact CG-CB 4.32Å
71	C	92.1	Very high	87.7	Confident	46 Å²	46	75.6 Å²	75.6	31%	0.311	40%	0.401	S	S	.	.	S	Bend	trans	-166.3	175.2	169.8	69.7	0	0	0	0	111	C68 H73 H84 H88	C68-C71 WeakPolarHBondContact CB-O 3.44Å; C71-H73 PolarHBondContact O-N 3.44Å; C71-H73 VanDerWaalsContact O-N 3.09Å; C71-H73 VanDerWaalsContact SG-CB 3.58Å; C71-H84 PolarHBondContact SG-NE2 3.42Å; C71-H84 VanDerWaalsContact SG-NE2 3.38Å; C71-H88 VanDerWaalsContact SG-CE1 3.56Å; C71-H88 PolarHBondContact SG-NE2 3.32Å
72	D	89.3	Confident	88.2	Confident	125 Å²	125	78.5 Å²	78.5	67%	0.668	41%	0.406	S	S	*	.	S	Bend	trans	-73.2	5.5	-179.7	-68.6	-75.1	0	0	0	116	K67 R74	K67-D72 WeakPolarHBondContact CE-OD1 3.21Å; K67-D72 IonicContact NZ-OD1 2.91Å; K67-D72 PolarHBondContact NZ-OD1 2.99Å; D72-R74 PolarHBondContact O-N 3.37Å
73	H	87.9	Confident	88.6	Confident	79 Å²	79	79.9 Å²	79.9	37%	0.366	40%	0.404	S	S	.	.			trans	-62.7	122.9	173.2	-172.1	93.3	0	0	0	111.5	C68 C71 H84	C68-H73 WeakPolarHBondContact CB-O 3.49Å; C68-H73 PolarHBondContact N-O 3.37Å; C71-H73 PolarHBondContact O-N 3.44Å; C71-H73 VanDerWaalsContact O-N 3.09Å; C71-H73 VanDerWaalsContact SG-CB 3.58Å; H73-H84 WeakPolarHBondContact CB-NE2 3.42Å; H73-H84 AromaticContact CD2-CD2 3.79Å; H73-H84 AromaticContact CD2-CG 3.82Å; H73-H84 AromaticContact CD2-NE2 3.99Å; H73-H84 AromaticContact CG-CE1 3.73Å; H73-H84 AromaticContact CG-NE2 3.76Å
74	R	90.6	Very high	88.9	Confident	130 Å²	130	79.7 Å²	79.7	49%	0.491	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	144.3	175.3	-59.5	176	66.9	178.9	6.6	111.1	R64 Y66 K67 D72	R64-R74 HydrophobicContact CB-CB 3.63Å; R64-R74 PolarHBondContact NE-O 3.48Å; R64-R74 PolarHBondContact NH2-O 3.36Å; R64-R74 VanDerWaalsContact O-CZ 3.32Å; R64-R74 PolarHBondContact O-NE 2.99Å; R64-R74 PolarHBondContact O-NH2 3.35Å; R64-R74 VanDerWaalsContact O-NH2 3.09Å; Y66-R74 CarbonylContact O-C 3.57Å; Y66-R74 WeakPolarHBondContact O-CA 3.44Å; K67-R74 HydrophobicContact CB-CG 4.21Å; K67-R74 HydrophobicContact CG-CG 4.04Å; D72-R74 PolarHBondContact O-N 3.37Å
75	A	88	Confident	89.2	Confident	6 Å²	6	75.8 Å²	75.8	5%	0.05	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.7	175.3	0	0	0	0	0	112.4	R64 Y66 Q77 N80 L81	R64-A75 CarbonylContact C-O 3.48Å; R64-A75 VanDerWaalsContact CA-O 3.28Å; R64-A75 WeakPolarHBondContact CA-O 3.41Å; Y66-A75 WeakPolarHBondContact CD2-O 3.39Å; Y66-A75 PolarHBondContact N-O 3.46Å; Y66-A75 VanDerWaalsContact N-O 3.11Å; Y66-A75 PolarHBondContact O-N 3.03Å; A75-Q77 VanDerWaalsContact C-N 3.3Å; A75-N80 HydrophobicContact CB-CB 4.23Å; A75-L81 HydrophobicContact CB-CB 4.09Å
76	S	87.1	Confident	89.4	Confident	34 Å²	34	78.4 Å²	78.4	24%	0.238	38%	0.384	C	S	.	.	S	Bend	trans	-76.4	-16.3	171.1	51.5	0	0	0	0	113.4	R58 Y66	R58-S76 WeakPolarHBondContact CD-O 3.18Å; R58-S76 PolarHBondContact NH1-O 3.14Å; Y66-S76 WeakPolarHBondContact CE2-O 3.31Å
77	Q	86.9	Confident	89.4	Confident	53 Å²	53	77.7 Å²	77.7	25%	0.248	39%	0.391	C	S	.	.	S	Bend	trans	-136.7	141	-175.4	-52.8	-172.7	11.3	0	0	112.7	Q55 A75 G79 N80 L81	Q55-Q77 VanDerWaalsContact CD-CD 3.41Å; Q55-Q77 HydrophobicContact CG-CG 3.96Å; A75-Q77 VanDerWaalsContact C-N 3.3Å; Q77-G79 VanDerWaalsContact C-N 3.3Å; Q77-G79 PolarHBondContact O-N 3.17Å; Q77-N80 HydrophobicContact CB-CB 4.42Å; Q77-N80 PolarHBondContact O-N 3.03Å; Q77-L81 PolarHBondContact O-N 3.16Å; Q77-L81 VanDerWaalsContact O-N 3.17Å
78	K	88.2	Confident	89	Confident	158 Å²	158	74.9 Å²	74.9	69%	0.687	38%	0.38	S	S	*	.	H	α-helix	trans	-62	-34.3	177.6	-173.2	176.2	-179.5	177.7	0	112.9	Y66 L81 K82	Y66-K78 HydrophobicContact CD1-CB 4.36Å; Y66-K78 HydrophobicContact CE1-CB 4.1Å; Y66-K78 HydrophobicContact CE2-CB 4.4Å; K78-L81 PolarHBondContact O-N 2.91Å; K78-K82 PolarHBondContact O-N 3.44Å
79	G	89.6	Confident	88	Confident	46 Å²	46	82 Å²	82	47%	0.474	41%	0.41	S	S	.	.	H	α-helix	trans	-61	-51.3	175.1	0	0	0	0	0	111.9	Q77 L81 K82 V83	Q77-G79 VanDerWaalsContact C-N 3.3Å; Q77-G79 PolarHBondContact O-N 3.17Å; G79-L81 VanDerWaalsContact C-N 3.3Å; G79-L81 PolarHBondContact O-N 2.97Å; G79-K82 CarbonylContact O-C 3.25Å; G79-K82 WeakPolarHBondContact O-CA 3.38Å; G79-K82 WeakPolarHBondContact O-CB 3.17Å; G79-K82 PolarHBondContact O-N 3.44Å; G79-V83 PolarHBondContact O-N 2.77Å
80	N	88.1	Confident	87.3	Confident	81 Å²	81	84.6 Å²	84.6	43%	0.433	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-38.4	178.8	-61.5	2.2	0	0	0	111.6	A75 Q77 V83 H84	A75-N80 HydrophobicContact CB-CB 4.23Å; Q77-N80 HydrophobicContact CB-CB 4.42Å; Q77-N80 PolarHBondContact O-N 3.03Å; N80-V83 WeakPolarHBondContact O-CB 3.36Å; N80-V83 PolarHBondContact O-N 2.99Å; N80-H84 PolarHBondContact O-N 3.04Å
81	L	92.2	Very high	85.5	Confident	21 Å²	21	80.1 Å²	80.1	11%	0.11	41%	0.413	C	S	.	.	H	α-helix	trans	-62.8	-40.6	171.2	178.7	59.5	0	0	0	112.2	K67 C68 A75 Q77 K78 G79 V83 H84 I85	K67-L81 WeakPolarHBondContact O-CD2 3.43Å; C68-L81 HydrophobicContact CB-CD1 3.77Å; A75-L81 HydrophobicContact CB-CB 4.09Å; Q77-L81 PolarHBondContact O-N 3.16Å; Q77-L81 VanDerWaalsContact O-N 3.17Å; K78-L81 PolarHBondContact O-N 2.91Å; G79-L81 VanDerWaalsContact C-N 3.3Å; G79-L81 PolarHBondContact O-N 2.97Å; L81-V83 VanDerWaalsContact C-N 3.28Å; L81-V83 PolarHBondContact O-N 2.97Å; L81-H84 PolarHBondContact O-N 3.16Å; L81-I85 HydrophobicContact CD1-CD1 3.86Å; L81-I85 HydrophobicContact CD1-CG1 3.86Å; L81-I85 HydrophobicContact CD2-CD1 4.22Å; L81-I85 HydrophobicContact CG-CD1 3.74Å; L81-I85 HydrophobicContact CG-CG1 4.21Å; L81-I85 WeakPolarHBondContact O-CB 3.43Å; L81-I85 WeakPolarHBondContact O-CG1 3.37Å; L81-I85 PolarHBondContact O-N 2.77Å
82	K	91.4	Very high	83.3	Confident	155 Å²	155	84.4 Å²	84.4	67%	0.674	44%	0.438	S	S	*	.	H	α-helix	trans	-67	-25.9	175.2	-169.8	176.6	179.2	-176.6	0	112.8	K78 G79 R86	K78-K82 PolarHBondContact O-N 3.44Å; G79-K82 CarbonylContact O-C 3.25Å; G79-K82 WeakPolarHBondContact O-CA 3.38Å; G79-K82 WeakPolarHBondContact O-CB 3.17Å; G79-K82 PolarHBondContact O-N 3.44Å; K82-R86 WeakPolarHBondContact O-CG 3.44Å; K82-R86 PolarHBondContact O-NE 3.1Å
83	V	89.8	Confident	81.3	Confident	80 Å²	80	85.9 Å²	85.9	49%	0.485	45%	0.445	S	S	.	.	H	α-helix	trans	-69.8	-50.3	168.8	-179.5	0	0	0	0	110.1	G79 N80 L81 I85 R86 S87	G79-V83 PolarHBondContact O-N 2.77Å; N80-V83 WeakPolarHBondContact O-CB 3.36Å; N80-V83 PolarHBondContact O-N 2.99Å; L81-V83 VanDerWaalsContact C-N 3.28Å; L81-V83 PolarHBondContact O-N 2.97Å; V83-I85 PolarHBondContact O-N 3.18Å; V83-R86 WeakPolarHBondContact O-CB 3.37Å; V83-R86 PolarHBondContact O-N 2.85Å; V83-S87 PolarHBondContact O-N 2.92Å
84	H	89.6	Confident	78.9	Confident	35 Å²	35	88.1 Å²	88.1	16%	0.162	47%	0.469	C	S	.	.	H	α-helix	trans	-65.2	-36.5	-179.2	173.9	71.6	0	0	0	113.7	C68 C71 H73 N80 L81 R86 S87 H88	C68-H84 VanDerWaalsContact SG-CD2 3.53Å; C71-H84 PolarHBondContact SG-NE2 3.42Å; C71-H84 VanDerWaalsContact SG-NE2 3.38Å; H73-H84 WeakPolarHBondContact CB-NE2 3.42Å; H73-H84 AromaticContact CD2-CD2 3.79Å; H73-H84 AromaticContact CD2-CG 3.82Å; H73-H84 AromaticContact CD2-NE2 3.99Å; H73-H84 AromaticContact CG-CE1 3.73Å; H73-H84 AromaticContact CG-NE2 3.76Å; N80-H84 PolarHBondContact O-N 3.04Å; L81-H84 PolarHBondContact O-N 3.16Å; H84-R86 PolarHBondContact O-N 3.38Å; H84-S87 PolarHBondContact O-N 2.8Å; H84-S87 VanDerWaalsContact O-N 3.11Å; H84-S87 PolarHBondContact O-OG 3.48Å; H84-H88 AromaticContact CD2-CD2 3.98Å; H84-H88 AromaticContact CD2-NE2 3.86Å; H84-H88 AromaticContact CE1-CD2 3.93Å; H84-H88 AromaticContact CE1-NE2 3.36Å; H84-H88 PolarHBondContact CE1-NE2 3.3Å; H84-H88 AromaticContact NE2-CD2 3.53Å; H84-H88 AromaticContact NE2-NE2 2.97Å; H84-H88 PolarHBondContact NE2-NE2 3Å; H84-H88 PolarHBondContact O-CD2 3.06Å; H84-H88 PolarHBondContact O-N 3.39Å
85	I	90.1	Very high	76.1	Confident	39 Å²	39	84.9 Å²	84.9	20%	0.2	47%	0.467	C	S	.	.	H	α-helix	trans	-62.5	-26.8	172	-74.2	171.1	0	0	0	111.5	P69 Y70 L81 V83 H88 K89	P69-I85 HydrophobicContact CG-CD1 4.36Å; Y70-I85 HydrophobicContact CD2-CG1 4.46Å; Y70-I85 HydrophobicContact CE2-CG2 4.07Å; L81-I85 HydrophobicContact CD1-CD1 3.86Å; L81-I85 HydrophobicContact CD1-CG1 3.86Å; L81-I85 HydrophobicContact CD2-CD1 4.22Å; L81-I85 HydrophobicContact CG-CD1 3.74Å; L81-I85 HydrophobicContact CG-CG1 4.21Å; L81-I85 WeakPolarHBondContact O-CB 3.43Å; L81-I85 WeakPolarHBondContact O-CG1 3.37Å; L81-I85 PolarHBondContact O-N 2.77Å; V83-I85 PolarHBondContact O-N 3.18Å; I85-H88 PolarHBondContact O-N 3.28Å; I85-K89 PolarHBondContact O-N 3.12Å
86	R	89.5	Confident	73.6	Confident	130 Å²	130	93.6 Å²	93.6	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-74.1	-26.1	174.4	-71.9	-178.2	-64.5	119.2	-8.1	113.4	K82 V83 H84 K89 L90	K82-R86 WeakPolarHBondContact O-CG 3.44Å; K82-R86 PolarHBondContact O-NE 3.1Å; V83-R86 WeakPolarHBondContact O-CB 3.37Å; V83-R86 PolarHBondContact O-N 2.85Å; H84-R86 PolarHBondContact O-N 3.38Å; R86-K89 PolarHBondContact O-N 3.36Å; R86-L90 WeakPolarHBondContact O-CB 3.46Å; R86-L90 WeakPolarHBondContact O-CD1 3.29Å; R86-L90 WeakPolarHBondContact O-CG 3.4Å; R86-L90 PolarHBondContact O-N 2.95Å; R86-L90 VanDerWaalsContact O-N 3.08Å
87	S	85.8	Confident	71.1	Confident	66 Å²	66	98.9 Å²	98.9	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-68	-38.7	170.9	46.2	0	0	0	0	111.6	V83 H84 K89 L90 G91	V83-S87 PolarHBondContact O-N 2.92Å; H84-S87 PolarHBondContact O-N 2.8Å; H84-S87 VanDerWaalsContact O-N 3.11Å; H84-S87 PolarHBondContact O-OG 3.48Å; S87-K89 PolarHBondContact O-N 2.98Å; S87-L90 PolarHBondContact O-N 3.08Å; S87-L90 VanDerWaalsContact O-N 3.14Å; S87-G91 PolarHBondContact O-N 3.19Å
88	H	82.4	Confident	68.6	Low	55 Å²	55	101.9 Å²	101.9	26%	0.255	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-27.2	171.8	-69.6	-74.2	0	0	0	113.9	Y70 C71 H84 I85	Y70-H88 HydrophobicContact CD2-CB 4.02Å; Y70-H88 HydrophobicContact CG-CB 4.32Å; C71-H88 VanDerWaalsContact SG-CE1 3.56Å; C71-H88 PolarHBondContact SG-NE2 3.32Å; H84-H88 AromaticContact CD2-CD2 3.98Å; H84-H88 AromaticContact CD2-NE2 3.86Å; H84-H88 AromaticContact CE1-CD2 3.93Å; H84-H88 AromaticContact CE1-NE2 3.36Å; H84-H88 PolarHBondContact CE1-NE2 3.3Å; H84-H88 AromaticContact NE2-CD2 3.53Å; H84-H88 AromaticContact NE2-NE2 2.97Å; H84-H88 PolarHBondContact NE2-NE2 3Å; H84-H88 PolarHBondContact O-CD2 3.06Å; H84-H88 PolarHBondContact O-N 3.39Å; I85-H88 PolarHBondContact O-N 3.28Å
89	K	72.9	Confident	65.7	Low	152 Å²	152	100.5 Å²	100.5	66%	0.661	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-7.2	175.7	-67.9	-166.9	174.2	-152.3	0	114.5	I85 R86 S87	I85-K89 PolarHBondContact O-N 3.12Å; R86-K89 PolarHBondContact O-N 3.36Å; S87-K89 PolarHBondContact O-N 2.98Å
90	L	74.5	Confident	63	Low	151 Å²	151	107.1 Å²	107.1	79%	0.791	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	-12.5	-179	-72.9	167.4	0	0	0	113	R86 S87	R86-L90 WeakPolarHBondContact O-CB 3.46Å; R86-L90 WeakPolarHBondContact O-CD1 3.29Å; R86-L90 WeakPolarHBondContact O-CG 3.4Å; R86-L90 PolarHBondContact O-N 2.95Å; R86-L90 VanDerWaalsContact O-N 3.08Å; S87-L90 PolarHBondContact O-N 3.08Å; S87-L90 VanDerWaalsContact O-N 3.14Å
91	G	49.6	Very low	60.4	Low	40 Å²	40	109.7 Å²	109.7	41%	0.412	59%	0.586	S	S	.	*	S	Bend	trans	-134	114.1	168.1	0	0	0	0	0	108.9	S87 L93	S87-G91 PolarHBondContact O-N 3.19Å; G91-L93 PolarHBondContact O-N 3.29Å
92	T	46.6	Very low	57.8	Low	136 Å²	136	116 Å²	116	83%	0.834	62%	0.615	S	S	*	*			trans	-61.6	123	176.6	43.8	0	0	0	0	110.9
93	L	46	Very low	55.3	Low	156 Å²	156	117.7 Å²	117.7	82%	0.817	63%	0.625	S	S	*	*			trans	44	78.1	157.4	-57	178	0	0	0	116.1	G91 S95	G91-L93 PolarHBondContact O-N 3.29Å; L93-S95 PolarHBondContact O-N 3.17Å
94	S	37.8	Very low	52.5	Low	126 Å²	126	117.3 Å²	117.3	88%	0.881	64%	0.637	S	S	*	*			trans	-72.5	65.1	142.2	-63.9	0	0	0	0	109.3
95	S	32.8	Very low	49.8	Very low	63 Å²	63	119.2 Å²	119.2	44%	0.441	67%	0.667	S	S	.	*			trans	-77.9	117.8	166.2	-169.8	0	0	0	0	107.4	L93 H97	L93-S95 PolarHBondContact O-N 3.17Å; S95-H97 VanDerWaalsContact C-N 3.26Å; S95-H97 PolarHBondContact O-N 2.84Å; S95-H97 PolarHBondContact OG-CD2 3.21Å; S95-H97 PolarHBondContact OG-NE2 3.12Å
96	H	35.7	Very low	47.2	Very low	189 Å²	189	121.4 Å²	121.4	88%	0.875	69%	0.69	S	S	*	*			trans	-72.9	89.5	162.9	-89.7	-101.9	0	0	0	107.5	S98	H96-S98 PolarHBondContact O-N 3.33Å
97	H	32.8	Very low	44.5	Very low	145 Å²	145	123.9 Å²	123.9	67%	0.671	71%	0.708	S	S	*	*			trans	-76.7	106.4	156.6	-76.2	-86.5	0	0	0	107.6	S95 N99	S95-H97 VanDerWaalsContact C-N 3.26Å; S95-H97 PolarHBondContact O-N 2.84Å; S95-H97 PolarHBondContact OG-CD2 3.21Å; S95-H97 PolarHBondContact OG-NE2 3.12Å; H97-N99 PolarHBondContact O-N 3.12Å
98	S	34.7	Very low	42	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	73%	0.727	S	S	*	*			trans	-64.9	105.3	152	47.5	0	0	0	0	107	H96	H96-S98 PolarHBondContact O-N 3.33Å
99	N	28.3	Very low	39.8	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	76%	0.755	S	S	*	*			trans	-94.1	120.1	167	-73.8	4.5	0	0	0	107.8	H97	H97-N99 PolarHBondContact O-N 3.12Å
100	E	33.2	Very low	37.8	Very low	186 Å²	186	135.9 Å²	135.9	87%	0.869	76%	0.759	S	S	*	*			trans	-113.3	85.6	153.2	-68.8	-179.2	153.9	0	0	105.4
101	D	32.2	Very low	35.6	Very low	134 Å²	134	136.4 Å²	136.4	72%	0.717	76%	0.759	S	S	*	*			trans	58.9	161.5	142.4	-48.8	-36.4	0	0	0	123.5
102	E	37.5	Very low	34.5	Very low	155 Å²	155	143.1 Å²	143.1	72%	0.724	78%	0.777	S	S	*	*			trans	73.8	88.1	165.4	-51.5	-44.1	115.2	0	0	123.1
103	E	38.8	Very low	33.6	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	77%	0.771	S	S	*	*				55.6	134.2	113.1	-167.7	166	-111	0	0	123.6
104	G	32.3	Very low	33.1	Very low	72 Å²	72	139.4 Å²	139.4	74%	0.742	76%	0.764	S	S	*	*			trans	143.4	109.2	145.2	0	0	0	0	0	119.7
105	G	31.5	Very low	32.9	Very low	75 Å²	75	142.3 Å²	142.3	77%	0.773	76%	0.764	S	S	*	*			trans	71.6	138	157.9	0	0	0	0	0	118
106	A	36.1	Very low	32.9	Very low	85 Å²	85	142.6 Å²	142.6	70%	0.702	78%	0.777	S	S	*	*			cis	72.6	115.1	29.9	0	0	0	0	0	114.5
107	E	33.5	Very low	32.8	Very low	182 Å²	182	142 Å²	142	85%	0.85	78%	0.779	S	S	*	*			cis	-124.2	-100.6	-10.1	-68.4	-74.6	60	0	0	113.6
108	E	33.8	Very low	32.7	Very low	188 Å²	188	143.3 Å²	143.3	88%	0.879	79%	0.791	S	S	*	*			cis	-151.2	177.1	4.3	-70.1	-174.7	-87.1	0	0	112
109	E	36	Very low	32.5	Very low	179 Å²	179	141.4 Å²	141.4	84%	0.836	79%	0.79	S	S	*	*			trans	-66.7	174.7	171.9	-67	-100.2	118.2	0	0	114.5
110	E	30.2	Very low	32.5	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.734	79%	0.793	S	S	*	*			cis	-167.9	-161.8	-37.7	-148.6	-137.5	-148.2	0	0	108.6
111	M	28	Very low	32.4	Very low	162 Å²	162	136.6 Å²	136.6	80%	0.798	79%	0.793	S	S	*	*			trans	89.4	73.2	157.6	-147.8	169.1	-139.3	0	0	125
112	K	27.3	Very low	32.6	Very low	182 Å²	182	135.7 Å²	135.7	79%	0.791	80%	0.797	S	S	*	*				55.9	151.1	106	-145.3	-167.8	174.7	-176	0	125.2
113	V	26.9	Very low	33.3	Very low	117 Å²	117	133.8 Å²	133.8	71%	0.709	80%	0.798	S	S	*	*			trans	82.9	142.9	161.5	-173.8	0	0	0	0	116.3
114	S	36	Very low	33	Very low	97 Å²	97	131.7 Å²	131.7	68%	0.678	80%	0.798	S	S	*	*			cis	-130.6	150.5	6.6	39.7	0	0	0	0	111.6
115	E	32.7	Very low	33.3	Very low	186 Å²	186	137.4 Å²	137.4	87%	0.869	80%	0.803	S	S	*	*				56.6	134.3	71	-55	179.1	165.9	0	0	114.6
116	G	33.3	Very low	33.3	Very low	70 Å²	70	138.8 Å²	138.8	72%	0.722	80%	0.801	S	S	*	*			cis	-135	-158.1	-6.3	0	0	0	0	0	111.1
117	L	34.5	Very low	33.4	Very low	176 Å²	176	139.7 Å²	139.7	92%	0.921	80%	0.802	S	S	*	*			cis	-152.2	174	21.1	-71.1	169.1	0	0	0	111.6
118	D	30	Very low	33.7	Very low	172 Å²	172	135.8 Å²	135.8	92%	0.92	80%	0.795	S	S	*	*			trans	-73.5	162.7	-171.3	-77.5	-74.1	0	0	0	118.7
119	G	30.8	Very low	33.7	Very low	76 Å²	76	131.7 Å²	131.7	78%	0.784	79%	0.793	S	S	*	*			trans	-175.8	66.3	172.1	0	0	0	0	0	114.2
120	G	28.7	Very low	33.4	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	80%	0.796	S	S	*	*			trans	-59.2	151.7	173.6	0	0	0	0	0	112.7
121	T	31.2	Very low	33.5	Very low	141 Å²	141	128.9 Å²	128.9	87%	0.865	80%	0.798	S	S	*	*				-139	167.4	77.6	49.9	0	0	0	0	115.8
122	S	36	Very low	33.8	Very low	116 Å²	116	130 Å²	130	81%	0.811	80%	0.798	S	S	*	*			trans	-151.2	-174.9	168.4	-68.9	0	0	0	0	106.1
123	P	52.3	Low	33.9	Very low	114 Å²	114	129.5 Å²	129.5	74%	0.74	80%	0.801	S	S	*	*			cis	-132.9	-173.8	-6.3	42.7	-27.5	0	0	0	113.6
124	T	32.4	Very low	34	Very low	146 Å²	146	129.1 Å²	129.1	90%	0.896	80%	0.798	S	S	*	*			trans	-161.5	152.7	131.7	2.5	0	0	0	0	113
125	K	38.4	Very low	33.5	Very low	192 Å²	192	132.2 Å²	132.2	84%	0.835	81%	0.807	S	S	*	*			trans	-86.4	174.5	176.2	-69.1	179.2	175.2	175.9	0	110.2
126	S	31.6	Very low	33.3	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	80%	0.8	S	S	*	*			cis	-153	158	32.2	-58.6	0	0	0	0	110.4
127	S	37.4	Very low	33	Very low	103 Å²	103	129.4 Å²	129.4	72%	0.72	80%	0.798	S	S	*	*			cis	66.5	130.4	45.6	-140.9	0	0	0	0	113
128	S	39.6	Very low	32.7	Very low	101 Å²	101	127.3 Å²	127.3	71%	0.706	79%	0.792	S	S	*	*			cis	-172.5	151.4	-8.9	33.3	0	0	0	0	112.4
129	A	34.9	Very low	32.7	Very low	102 Å²	102	122.6 Å²	122.6	84%	0.843	79%	0.785	S	S	*	*			trans	41.3	135.7	143.7	0	0	0	0	0	123.4
130	C	29.1	Very low	32.7	Very low	134 Å²	134	126.7 Å²	126.7	91%	0.905	78%	0.783	S	S	*	*			trans	-151.1	161.7	144.2	63.5	0	0	0	0	110.7
131	N	31.6	Very low	32.7	Very low	142 Å²	142	128.2 Å²	128.2	76%	0.759	77%	0.771	S	S	*	*			trans	-155.5	118.5	-166.9	-163.7	6.4	0	0	0	112.8
132	K	35	Very low	32.7	Very low	185 Å²	185	124 Å²	124	80%	0.804	75%	0.748	S	S	*	*			trans	54.5	128.2	164.4	-67	171.7	-177.6	-176.5	0	121.2
133	M	29	Very low	32.6	Very low	172 Å²	172	125.9 Å²	125.9	85%	0.847	74%	0.737	S	S	*	*				168.2	119.9	116.9	-89.1	177.6	72.6	0	0	110
134	V	28.7	Very low	31.7	Very low	109 Å²	109	128.1 Å²	128.1	66%	0.661	73%	0.731	S	S	*	*				101.4	124.9	97.4	166.8	0	0	0	0	113.7
135	N	26.5	Very low	31.7	Very low	162 Å²	162	131.1 Å²	131.1	87%	0.866	73%	0.731	S	S	*	*			trans	28.9	144	158.4	-52.4	2.8	0	0	0	122
136	G	29	Very low	31.4	Very low	70 Å²	70	130.8 Å²	130.8	72%	0.722	74%	0.735	S	S	*	*			cis	166.9	168.5	-3.2	0	0	0	0	0	113.7
137	D	25.6	Very low	31.7	Very low	127 Å²	127	131.7 Å²	131.7	68%	0.679	74%	0.739	S	S	*	*			trans	60.6	151.3	175	-108.6	-26.6	0	0	0	117.7	Y411	D137-Y411 PolarHBondContact OD1-OH 3.05Å; D137-Y411 PolarHBondContact OD2-OH 2.87Å; D137-Y411 VanDerWaalsContact OD2-OH 3.12Å
138	V	30	Very low	31.2	Very low	132 Å²	132	131.7 Å²	131.7	80%	0.8	74%	0.744	S	S	*	*			cis	-135.2	148.8	-0.9	-174.8	0	0	0	0	108.4
139	G	28.3	Very low	30.7	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	76%	0.756	S	S	*	*			trans	168.8	143.3	167.4	0	0	0	0	0	116.2
140	E	30.5	Very low	30.3	Very low	161 Å²	161	139.7 Å²	139.7	75%	0.752	76%	0.756	S	S	*	*			trans	-86.8	162.8	-163.1	-75.2	-155.8	80.8	0	0	119.2	S414	E140-S414 VanDerWaalsContact OE1-CB 3.3Å; E140-S414 WeakPolarHBondContact OE1-CB 3.4Å; E140-S414 PolarHBondContact OE1-OG 3.12Å
141	E	29.5	Very low	30.6	Very low	104 Å²	104	141.3 Å²	141.3	49%	0.486	75%	0.752	S	S	.	*			trans	75.9	133.5	140.2	-174	164.9	-145.7	0	0	122.7	S414 Y415 S416	E141-S414 PolarHBondContact N-OG 2.83Å; E141-Y415 WeakPolarHBondContact OE1-CB 3.36Å; E141-S416 WeakPolarHBondContact OE1-CB 3.37Å; E141-S416 PolarHBondContact OE1-OG 3.2Å; E141-S416 VanDerWaalsContact OE1-OG 3.06Å
142	S	30.4	Very low	31	Very low	53 Å²	53	143.4 Å²	143.4	37%	0.371	76%	0.755	S	S	.	*			trans	77.6	126.1	149.5	-88.2	0	0	0	0	123.8	S414 Y415 S416	S142-S414 PolarHBondContact N-O 3.3Å; S142-Y415 PolarHBondContact OG-O 3.29Å; S142-S416 PolarHBondContact OG-O 3.06Å
143	R	35.7	Very low	30.7	Very low	156 Å²	156	144.9 Å²	144.9	59%	0.589	76%	0.755	S	S	*	*			trans	83.8	112.8	138.1	-68.4	174.9	-166.1	-171.1	6.3	122.1	S416 G417	R143-S416 PolarHBondContact NE-O 3.23Å; R143-S416 PolarHBondContact NH2-O 3.32Å; R143-S416 VanDerWaalsContact NH2-O 3.07Å; R143-G417 PolarHBondContact NE-O 2.99Å; R143-G417 VanDerWaalsContact NE-O 3.15Å
144	R	32.2	Very low	31	Very low	160 Å²	160	143.5 Å²	143.5	60%	0.604	75%	0.747	S	S	*	*				59.7	113.5	124	-61	173.5	-174.6	-102.7	-14.4	118.8	G417 G418 S419	R144-G417 VanDerWaalsContact CZ-O 3.23Å; R144-G417 PolarHBondContact NE-O 3.28Å; R144-G417 PolarHBondContact NH2-O 3.32Å; R144-G418 WeakPolarHBondContact CD-O 3.49Å; R144-G418 VanDerWaalsContact CZ-C 3.5Å; R144-G418 PolarHBondContact NE-O 2.85Å; R144-G418 PolarHBondContact NH1-O 3.12Å; R144-S419 PolarHBondContact NH1-O 2.96Å
145	K	31.8	Very low	31.2	Very low	209 Å²	209	148.2 Å²	148.2	91%	0.909	76%	0.758	S	S	*	*			trans	-142.6	140.2	156.1	-99.7	156.8	-173.8	164.5	0	111.5
146	M	33	Very low	31.3	Very low	185 Å²	185	145.1 Å²	145.1	91%	0.911	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-79.5	143	170.5	-65.9	-74.3	-166.8	0	0	110.5
147	P	37.2	Very low	31.6	Very low	125 Å²	125	148.1 Å²	148.1	81%	0.812	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-97.1	131.8	168.6	34.2	-29.6	0	0	0	112.3
148	A	27.3	Very low	32.4	Very low	102 Å²	102	146.6 Å²	146.6	84%	0.843	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-76.4	159.7	167.4	0	0	0	0	0	111.7
149	R	29.1	Very low	32.6	Very low	250 Å²	250	148 Å²	148	94%	0.943	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-79	138.3	168.3	-79.5	178.9	166.9	171.8	-4.3	110.9
150	S	27.3	Very low	33.5	Very low	122 Å²	122	153.8 Å²	153.8	85%	0.853	76%	0.763	S	S	*	*			trans	-144.7	163.4	150.3	-166.2	0	0	0	0	110.2
151	M	34.9	Very low	34.6	Very low	167 Å²	167	157 Å²	157	82%	0.823	77%	0.768	S	S	*	*			trans	-121	128.8	-170.1	-73.8	-89.2	-84.3	0	0	112.1
152	K	40.7	Very low	36.3	Very low	187 Å²	187	154.1 Å²	154.1	81%	0.813	76%	0.759	S	S	*	*			trans	63.7	135	132.9	-169	175.6	-179.1	-173.3	0	120.6
153	R	27.6	Very low	38.6	Very low	215 Å²	215	156.4 Å²	156.4	81%	0.811	76%	0.76	S	S	*	*			trans	-121.7	-172.3	148.7	-149.9	172.1	175.4	-178.4	-0.9	110.8
154	E	35.5	Very low	40.4	Very low	144 Å²	144	151.7 Å²	151.7	67%	0.673	75%	0.75	S	S	*	*			trans	-117.7	-166.5	-135.1	-54.8	153.7	90.8	0	0	116.7
155	K	34.1	Very low	42.7	Very low	208 Å²	208	144.3 Å²	144.3	90%	0.904	72%	0.723	S	S	*	*			trans	71.2	146.8	-176	-107.5	104.9	176	-175.9	0	115.3
156	S	28.2	Very low	44.7	Very low	97 Å²	97	146 Å²	146	68%	0.678	72%	0.723	S	S	*	*			cis	-154	144.6	-4.6	46.4	0	0	0	0	112.6
157	V	35.6	Very low	46.6	Very low	133 Å²	133	142.9 Å²	142.9	81%	0.806	71%	0.71	S	S	*	*			trans	49.3	138	143.1	-172	0	0	0	0	121.7
158	S	41	Very low	48.4	Very low	94 Å²	94	140.3 Å²	140.3	66%	0.657	69%	0.694	S	S	*	*			trans	45.2	110	161.8	66.6	0	0	0	0	120.2
159	N	34	Very low	50.6	Low	162 Å²	162	137.5 Å²	137.5	87%	0.866	68%	0.675	S	S	*	*				-174.2	124.9	122.9	-95.5	-35.5	0	0	0	109.3
160	Q	48.8	Very low	53	Low	196 Å²	196	130.8 Å²	130.8	92%	0.916	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-71.3	140.3	167.2	-63.6	-164.2	60	0	0	108.4
161	R	52	Low	55.4	Low	228 Å²	228	130.9 Å²	130.9	86%	0.86	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-89.2	130.2	-179.3	-103.4	-179.7	167	173	-6.7	110.4
162	P	65.4	Low	57.5	Low	44 Å²	44	123 Å²	123	29%	0.286	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-57.7	152.2	169.2	-24.7	34.9	0	0	0	112.8	C164 E171 A172	P162-C164 PolarHBondContact O-N 3.39Å; P162-E171 HydrophobicContact CB-CB 3.89Å; P162-E171 HydrophobicContact CB-CG 4.48Å; P162-A172 CarbonylContact C-O 3.51Å; P162-A172 WeakPolarHBondContact CA-O 3.37Å
163	Y	78.3	Confident	59.3	Low	101 Å²	101	120.9 Å²	120.9	40%	0.396	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.1	94.1	172	-67.7	-96.3	0	0	0	108.6	A172 R174 E175	Y163-A172 PolarHBondContact N-O 3.41Å; Y163-A172 PolarHBondContact O-N 3.44Å; Y163-R174 VanDerWaalsContact CD2-C 3.5Å; Y163-E175 HydrophobicContact CD1-CB 3.78Å; Y163-E175 HydrophobicContact CD1-CG 3.99Å; Y163-E175 HydrophobicContact CE1-CB 3.65Å; Y163-E175 HydrophobicContact CE1-CG 3.99Å; Y163-E175 HydrophobicContact CG-CB 4.3Å
164	C	74.9	Confident	61.3	Low	57 Å²	57	117.6 Å²	117.6	39%	0.385	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.2	132.6	-176.6	-36	0	0	0	0	112.2	P162 R166 Y170 E171	P162-C164 PolarHBondContact O-N 3.39Å; C164-R166 PolarHBondContact O-N 3.49Å; C164-Y170 CarbonylContact C-O 3.33Å; C164-Y170 WeakPolarHBondContact CA-O 3.37Å; C164-E171 HydrophobicContact CB-CG 4.25Å; C164-E171 PolarHBondContact SG-OE1 3.3Å
165	C	80.9	Confident	63.3	Low	4 Å²	4	116.1 Å²	116.1	3%	0.027	58%	0.576	C	S	.	*			trans	-67	125.2	171.6	-175.2	0	0	0	0	110.7	L167 G169 Y170 L178 H181	C165-L167 PolarHBondContact O-N 2.8Å; C165-G169 WeakPolarHBondContact O-CA 3.36Å; C165-G169 PolarHBondContact O-N 2.86Å; C165-Y170 PolarHBondContact N-O 3.25Å; C165-L178 VanDerWaalsContact CA-CD1 3.42Å; C165-L178 HydrophobicContact CB-CD1 3.48Å; C165-L178 VanDerWaalsContact CB-CD1 3.48Å; C165-H181 PolarHBondContact SG-NE2 3.05Å
166	R	73.1	Confident	65.4	Low	244 Å²	244	109.9 Å²	109.9	92%	0.921	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-3.8	-179.4	-72.7	-179.1	-73.7	-169.5	-4.9	114.2	C164	C164-R166 PolarHBondContact O-N 3.49Å
167	L	72.9	Confident	67.7	Low	121 Å²	121	109.6 Å²	109.6	63%	0.634	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-41.5	179.9	-60.1	176.1	0	0	0	111.9	C165 H186	C165-L167 PolarHBondContact O-N 2.8Å; L167-H186 HydrophobicContact CD1-CB 3.64Å
168	C	75.6	Confident	70.2	Confident	71 Å²	71	104.2 Å²	104.2	48%	0.48	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.3	-9.3	179	69.1	0	0	0	0	116	H181 H186	C168-H181 PolarHBondContact SG-CE1 2.96Å; C168-H181 PolarHBondContact SG-NE2 3.17Å; C168-H186 PolarHBondContact SG-NE2 3.31Å; C168-H186 VanDerWaalsContact SG-NE2 3.4Å
169	G	72.2	Confident	72.2	Confident	43 Å²	43	104.7 Å²	104.7	44%	0.443	50%	0.502	S	S	.	.			trans	91.8	-2.8	-179.3	0	0	0	0	0	116.6	C165 E171	C165-G169 WeakPolarHBondContact O-CA 3.36Å; C165-G169 PolarHBondContact O-N 2.86Å; G169-E171 PolarHBondContact O-N 3.43Å
170	Y	80.7	Confident	74.4	Confident	108 Å²	108	98.7 Å²	98.7	42%	0.424	47%	0.473	S	S	.	.			trans	-50.8	121.2	178.3	176.1	-102.4	0	0	0	112.7	C164 C165 A172 H181	C164-Y170 CarbonylContact C-O 3.33Å; C164-Y170 WeakPolarHBondContact CA-O 3.37Å; C165-Y170 PolarHBondContact N-O 3.25Å; Y170-A172 HydrophobicContact CD1-CB 4.45Å; Y170-A172 HydrophobicContact CE1-CB 3.96Å; Y170-H181 HydrophobicContact CD1-CB 3.75Å; Y170-H181 AromaticContact CD1-CD2 3.63Å; Y170-H181 AromaticContact CD1-CG 3.36Å; Y170-H181 AromaticContact CD1-ND1 3.73Å; Y170-H181 HydrophobicContact CE1-CB 3.75Å; Y170-H181 AromaticContact CE1-CG 3.86Å; Y170-H181 AromaticContact CG-CE1 3.89Å; Y170-H181 AromaticContact CG-CG 3.85Å; Y170-H181 AromaticContact CG-ND1 3.75Å
171	E	77.3	Confident	76	Confident	124 Å²	124	90.5 Å²	90.5	58%	0.579	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	107.3	-178.4	-61.1	-154	146.5	0	0	111.5	P162 C164 G169	P162-E171 HydrophobicContact CB-CB 3.89Å; P162-E171 HydrophobicContact CB-CG 4.48Å; C164-E171 HydrophobicContact CB-CG 4.25Å; C164-E171 PolarHBondContact SG-OE1 3.3Å; G169-E171 PolarHBondContact O-N 3.43Å
172	A	79.4	Confident	77.4	Confident	1 Å²	1	81.7 Å²	81.7	1%	0.008	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	147.8	173.5	0	0	0	0	0	111.4	P162 Y163 Y170 R174 Q177 L178	P162-A172 CarbonylContact C-O 3.51Å; P162-A172 WeakPolarHBondContact CA-O 3.37Å; Y163-A172 PolarHBondContact N-O 3.41Å; Y163-A172 PolarHBondContact O-N 3.44Å; Y170-A172 HydrophobicContact CD1-CB 4.45Å; Y170-A172 HydrophobicContact CE1-CB 3.96Å; A172-R174 VanDerWaalsContact C-N 3.27Å; A172-R174 WeakPolarHBondContact CB-O 3.36Å; A172-R174 PolarHBondContact O-N 3.3Å; A172-Q177 HydrophobicContact CB-CB 3.75Å; A172-L178 HydrophobicContact CB-CB 3.91Å
173	L	77.1	Confident	77.9	Confident	144 Å²	144	84.9 Å²	84.9	75%	0.754	42%	0.415	S	S	*	.	S	Bend	trans	-79.3	-12.1	174.5	-67.2	175.1	0	0	0	112.9
174	R	70.2	Confident	77.4	Confident	145 Å²	145	86.6 Å²	86.6	55%	0.547	43%	0.425	S	S	.	.	S	Bend	trans	-139.3	156.5	179.3	-65.5	165.5	54.2	118	-6.6	111.3	Y163 A172 D176 L178	Y163-R174 VanDerWaalsContact CD2-C 3.5Å; A172-R174 VanDerWaalsContact C-N 3.27Å; A172-R174 WeakPolarHBondContact CB-O 3.36Å; A172-R174 PolarHBondContact O-N 3.3Å; R174-D176 WeakPolarHBondContact CB-OD1 3.37Å; R174-D176 IonicContact CZ-OD1 3.88Å; R174-D176 IonicContact CZ-OD2 2.97Å; R174-D176 IonicContact NE-OD1 3.58Å; R174-D176 PolarHBondContact NE-OD1 3.27Å; R174-D176 IonicContact NE-OD2 2.96Å; R174-D176 PolarHBondContact NE-OD2 2.82Å; R174-D176 IonicContact NH2-OD1 2.63Å; R174-D176 IonicContact NH2-OD2 3.32Å; R174-D176 PolarHBondContact NH2-OD2 3.5Å; R174-L178 PolarHBondContact O-N 2.7Å
175	E	77.6	Confident	77.1	Confident	113 Å²	113	88 Å²	88	53%	0.528	43%	0.431	S	S	.	.	H	α-helix	trans	-68.7	-33.1	-178.5	-165.1	164.2	-163.6	0	0	113	Y163 L178 L179	Y163-E175 HydrophobicContact CD1-CB 3.78Å; Y163-E175 HydrophobicContact CD1-CG 3.99Å; Y163-E175 HydrophobicContact CE1-CB 3.65Å; Y163-E175 HydrophobicContact CE1-CG 3.99Å; Y163-E175 HydrophobicContact CG-CB 4.3Å; E175-L178 PolarHBondContact O-N 3.41Å; E175-L179 HydrophobicContact CG-CD1 4.29Å; E175-L179 VanDerWaalsContact O-CG 3.32Å; E175-L179 WeakPolarHBondContact O-CG 3.19Å; E175-L179 PolarHBondContact O-N 3.17Å
176	D	78	Confident	76.7	Confident	78 Å²	78	91 Å²	91	42%	0.417	45%	0.445	S	S	.	.	H	α-helix	trans	-67.5	-41.9	177.8	58.2	-12.3	0	0	0	113	R174 L178 L179 S180	R174-D176 WeakPolarHBondContact CB-OD1 3.37Å; R174-D176 IonicContact CZ-OD1 3.88Å; R174-D176 IonicContact CZ-OD2 2.97Å; R174-D176 IonicContact NE-OD1 3.58Å; R174-D176 PolarHBondContact NE-OD1 3.27Å; R174-D176 IonicContact NE-OD2 2.96Å; R174-D176 PolarHBondContact NE-OD2 2.82Å; R174-D176 IonicContact NH2-OD1 2.63Å; R174-D176 IonicContact NH2-OD2 3.32Å; R174-D176 PolarHBondContact NH2-OD2 3.5Å; D176-L178 VanDerWaalsContact C-N 3.32Å; D176-L178 PolarHBondContact O-N 3.14Å; D176-L179 PolarHBondContact O-N 2.91Å; D176-S180 PolarHBondContact O-N 3.47Å
177	Q	77.6	Confident	76	Confident	90 Å²	90	84.9 Å²	84.9	42%	0.421	43%	0.429	S	S	.	.	H	α-helix	trans	-60.6	-40.6	171.1	-75.9	179	-15.7	0	0	111.8	A172 H181	A172-Q177 HydrophobicContact CB-CB 3.75Å; Q177-H181 VanDerWaalsContact O-CB 3.32Å; Q177-H181 WeakPolarHBondContact O-CB 3.36Å; Q177-H181 PolarHBondContact O-N 2.85Å
178	L	86.3	Confident	74.9	Confident	21 Å²	21	83.5 Å²	83.5	11%	0.11	43%	0.426	C	S	.	.	H	α-helix	trans	-64.4	-44.7	174.7	172	59.7	0	0	0	111.7	C165 A172 R174 E175 D176 H181 I182	C165-L178 VanDerWaalsContact CA-CD1 3.42Å; C165-L178 HydrophobicContact CB-CD1 3.48Å; C165-L178 VanDerWaalsContact CB-CD1 3.48Å; A172-L178 HydrophobicContact CB-CB 3.91Å; R174-L178 PolarHBondContact O-N 2.7Å; E175-L178 PolarHBondContact O-N 3.41Å; D176-L178 VanDerWaalsContact C-N 3.32Å; D176-L178 PolarHBondContact O-N 3.14Å; L178-H181 WeakPolarHBondContact O-CB 3.44Å; L178-H181 PolarHBondContact O-N 3.41Å; L178-I182 HydrophobicContact CD1-CD1 3.87Å; L178-I182 HydrophobicContact CD1-CG1 4.07Å; L178-I182 HydrophobicContact CG-CD1 3.94Å; L178-I182 WeakPolarHBondContact O-CG1 3.42Å; L178-I182 PolarHBondContact O-N 3.29Å
179	L	83.3	Confident	73.2	Confident	103 Å²	103	84.1 Å²	84.1	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-65.3	-44.3	-179	-71.4	168.9	0	0	0	111.7	E175 D176 H181 I182 E183	E175-L179 HydrophobicContact CG-CD1 4.29Å; E175-L179 VanDerWaalsContact O-CG 3.32Å; E175-L179 WeakPolarHBondContact O-CG 3.19Å; E175-L179 PolarHBondContact O-N 3.17Å; D176-L179 PolarHBondContact O-N 2.91Å; L179-H181 VanDerWaalsContact C-N 3.29Å; L179-H181 PolarHBondContact O-N 3.42Å; L179-I182 PolarHBondContact O-N 3Å; L179-E183 WeakPolarHBondContact O-CB 3.46Å; L179-E183 PolarHBondContact O-N 3.42Å
180	S	80.1	Confident	71.5	Confident	37 Å²	37	89.8 Å²	89.8	26%	0.259	46%	0.456	S	S	.	.	H	α-helix	trans	-66.9	-29.9	175.8	-162.7	0	0	0	0	112.7	D176 K184	D176-S180 PolarHBondContact O-N 3.47Å; S180-K184 WeakPolarHBondContact O-CB 3.32Å; S180-K184 WeakPolarHBondContact O-CD 3.25Å; S180-K184 WeakPolarHBondContact O-CG 3.34Å; S180-K184 PolarHBondContact O-N 3.25Å; S180-K184 WeakPolarHBondContact OG-CE 3.27Å; S180-K184 PolarHBondContact OG-NZ 3.12Å
181	H	84.2	Confident	69.8	Low	24 Å²	24	88.4 Å²	88.4	11%	0.111	47%	0.467	C	S	.	.	H	α-helix	trans	-66.1	-46	169.5	159.5	77.2	0	0	0	112	C165 C168 Y170 Q177 L178 L179 E183 K184 V185 H186	C165-H181 PolarHBondContact SG-NE2 3.05Å; C168-H181 PolarHBondContact SG-CE1 2.96Å; C168-H181 PolarHBondContact SG-NE2 3.17Å; Y170-H181 HydrophobicContact CD1-CB 3.75Å; Y170-H181 AromaticContact CD1-CD2 3.63Å; Y170-H181 AromaticContact CD1-CG 3.36Å; Y170-H181 AromaticContact CD1-ND1 3.73Å; Y170-H181 HydrophobicContact CE1-CB 3.75Å; Y170-H181 AromaticContact CE1-CG 3.86Å; Y170-H181 AromaticContact CG-CE1 3.89Å; Y170-H181 AromaticContact CG-CG 3.85Å; Y170-H181 AromaticContact CG-ND1 3.75Å; Q177-H181 VanDerWaalsContact O-CB 3.32Å; Q177-H181 WeakPolarHBondContact O-CB 3.36Å; Q177-H181 PolarHBondContact O-N 2.85Å; L178-H181 WeakPolarHBondContact O-CB 3.44Å; L178-H181 PolarHBondContact O-N 3.41Å; L179-H181 VanDerWaalsContact C-N 3.29Å; L179-H181 PolarHBondContact O-N 3.42Å; H181-E183 VanDerWaalsContact C-N 3.3Å; H181-E183 PolarHBondContact O-N 3.06Å; H181-K184 PolarHBondContact O-N 3.23Å; H181-V185 VanDerWaalsContact O-CB 3.27Å; H181-V185 WeakPolarHBondContact O-CB 3.46Å; H181-V185 WeakPolarHBondContact O-CG2 3.48Å; H181-V185 PolarHBondContact O-N 3.04Å; H181-H186 AromaticContact NE2-CD2 3.94Å; H181-H186 AromaticContact NE2-NE2 3.61Å
182	I	80.9	Confident	68.1	Low	42 Å²	42	91.2 Å²	91.2	22%	0.215	48%	0.48	C	S	.	.	H	α-helix	trans	-60.3	-43.6	176.7	-69.8	166.3	0	0	0	110.2	L178 L179 H186 I187	L178-I182 HydrophobicContact CD1-CD1 3.87Å; L178-I182 HydrophobicContact CD1-CG1 4.07Å; L178-I182 HydrophobicContact CG-CD1 3.94Å; L178-I182 WeakPolarHBondContact O-CG1 3.42Å; L178-I182 PolarHBondContact O-N 3.29Å; L179-I182 PolarHBondContact O-N 3Å; I182-H186 CarbonylContact O-C 3.56Å; I182-H186 VanDerWaalsContact O-CA 3.32Å; I182-H186 WeakPolarHBondContact O-CA 3.41Å; I182-H186 VanDerWaalsContact O-CB 3.32Å; I182-H186 WeakPolarHBondContact O-CB 3.27Å; I182-H186 PolarHBondContact O-N 2.76Å; I182-I187 HydrophobicContact CG2-CD1 4.2Å; I182-I187 HydrophobicContact CG2-CG1 4.46Å; I182-I187 PolarHBondContact O-N 3.23Å
183	E	75	Confident	66	Low	111 Å²	111	100.5 Å²	100.5	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-59.1	-53.1	177.1	-169.3	170.8	-134.5	0	0	111.9	L179 H181 I187 T188	L179-E183 WeakPolarHBondContact O-CB 3.46Å; L179-E183 PolarHBondContact O-N 3.42Å; H181-E183 VanDerWaalsContact C-N 3.3Å; H181-E183 PolarHBondContact O-N 3.06Å; E183-I187 WeakPolarHBondContact O-CB 3.08Å; E183-I187 PolarHBondContact O-N 3.34Å; E183-T188 PolarHBondContact O-N 3.06Å; E183-T188 PolarHBondContact O-OG1 2.91Å
184	K	68.5	Low	64	Low	137 Å²	137	100.3 Å²	100.3	60%	0.596	52%	0.523	S	S	*	.	H	α-helix	trans	-79.3	-16	-174.1	-69.6	167.4	178.1	155.6	0	116	S180 H181 T188	S180-K184 WeakPolarHBondContact O-CB 3.32Å; S180-K184 WeakPolarHBondContact O-CD 3.25Å; S180-K184 WeakPolarHBondContact O-CG 3.34Å; S180-K184 PolarHBondContact O-N 3.25Å; S180-K184 WeakPolarHBondContact OG-CE 3.27Å; S180-K184 PolarHBondContact OG-NZ 3.12Å; H181-K184 PolarHBondContact O-N 3.23Å; K184-T188 WeakPolarHBondContact CA-OG1 3.46Å; K184-T188 PolarHBondContact O-OG1 3.01Å; K184-T188 VanDerWaalsContact O-OG1 3.12Å
185	V	67.6	Low	62	Low	86 Å²	86	99.1 Å²	99.1	52%	0.521	53%	0.532	S	S	.	.	H	α-helix	trans	-119.9	-16.7	-174.4	-172.1	0	0	0	0	112.1	H181	H181-V185 VanDerWaalsContact O-CB 3.27Å; H181-V185 WeakPolarHBondContact O-CB 3.46Å; H181-V185 WeakPolarHBondContact O-CG2 3.48Å; H181-V185 PolarHBondContact O-N 3.04Å
186	H	72.2	Confident	59.7	Low	67 Å²	67	100.8 Å²	100.8	31%	0.31	55%	0.55	S	S	.	.	H	α-helix	trans	-135.5	2.9	-176	-55.9	-46.9	0	0	0	114.8	L167 C168 H181 I182	L167-H186 HydrophobicContact CD1-CB 3.64Å; C168-H186 PolarHBondContact SG-NE2 3.31Å; C168-H186 VanDerWaalsContact SG-NE2 3.4Å; H181-H186 AromaticContact NE2-CD2 3.94Å; H181-H186 AromaticContact NE2-NE2 3.61Å; I182-H186 CarbonylContact O-C 3.56Å; I182-H186 VanDerWaalsContact O-CA 3.32Å; I182-H186 WeakPolarHBondContact O-CA 3.41Å; I182-H186 VanDerWaalsContact O-CB 3.32Å; I182-H186 WeakPolarHBondContact O-CB 3.27Å; I182-H186 PolarHBondContact O-N 2.76Å
187	I	59.6	Low	57.3	Low	116 Å²	116	103 Å²	103	60%	0.595	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128	-39.5	175.3	-55.3	-179.8	0	0	0	111.6	I182 E183 A189	I182-I187 HydrophobicContact CG2-CD1 4.2Å; I182-I187 HydrophobicContact CG2-CG1 4.46Å; I182-I187 PolarHBondContact O-N 3.23Å; E183-I187 WeakPolarHBondContact O-CB 3.08Å; E183-I187 PolarHBondContact O-N 3.34Å; I187-A189 PolarHBondContact O-N 2.96Å
188	T	49.1	Very low	55	Low	92 Å²	92	104.6 Å²	104.6	56%	0.564	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	84.7	172.1	54.9	0	0	0	0	111.6	E183 K184	E183-T188 PolarHBondContact O-N 3.06Å; E183-T188 PolarHBondContact O-OG1 2.91Å; K184-T188 WeakPolarHBondContact CA-OG1 3.46Å; K184-T188 PolarHBondContact O-OG1 3.01Å; K184-T188 VanDerWaalsContact O-OG1 3.12Å
189	A	39.8	Very low	52.3	Low	84 Å²	84	112.8 Å²	112.8	69%	0.694	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	-14.4	168.3	0	0	0	0	0	113.8	I187	I187-A189 PolarHBondContact O-N 2.96Å
190	D	36.5	Very low	49.8	Very low	162 Å²	162	116.2 Å²	116.2	87%	0.866	63%	0.63	S	S	*	*	S	Bend	trans	-108.8	33.2	-175.2	-59.6	-57.5	0	0	0	113
191	A	45.8	Very low	47.2	Very low	79 Å²	79	124 Å²	124	65%	0.653	66%	0.662	S	S	*	*			trans	-160.4	132.9	167.2	0	0	0	0	0	106.5
192	E	40.9	Very low	44.6	Very low	184 Å²	184	128.8 Å²	128.8	86%	0.86	69%	0.693	S	S	*	*			cis	-139.6	142.2	13.1	-59.1	167.2	-167.2	0	0	108.9
193	E	36.5	Very low	42.2	Very low	196 Å²	196	134.8 Å²	134.8	92%	0.916	72%	0.724	S	S	*	*			trans	-153.5	142.9	159.2	-90.7	-54.1	160.9	0	0	108.8
194	D	34.7	Very low	39.9	Very low	139 Å²	139	135.3 Å²	135.3	74%	0.743	74%	0.735	S	S	*	*			trans	-125.5	151.9	-164.6	-144.8	-11.8	0	0	0	113.2
195	T	27.9	Very low	38.2	Very low	120 Å²	120	137 Å²	137	74%	0.736	74%	0.744	S	S	*	*			trans	36.2	101.9	164.8	57.4	0	0	0	0	120.8
196	V	28.9	Very low	36.5	Very low	149 Å²	149	137.8 Å²	137.8	90%	0.903	75%	0.752	S	S	*	*			trans	-139	131.3	134.2	-179.5	0	0	0	0	109.5
197	T	27.1	Very low	34.5	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	78%	0.778	S	S	*	*			trans	-96.8	152	172	49.5	0	0	0	0	111.1
198	V	30.4	Very low	33	Very low	123 Å²	123	142.7 Å²	142.7	75%	0.745	79%	0.786	S	S	*	*			trans	157.8	133.2	131.4	158.4	0	0	0	0	112.5
199	K	29	Very low	32.1	Very low	194 Å²	194	144.1 Å²	144.1	84%	0.843	79%	0.794	S	S	*	*			trans	74	126.4	163.5	-82.2	166.6	-176.2	-175.6	0	120.7
200	E	30.1	Very low	31.7	Very low	174 Å²	174	149 Å²	149	81%	0.813	80%	0.803	S	S	*	*			trans	-71.5	161.6	159.6	-53	141.6	106.6	0	0	111
201	E	27.5	Very low	31.7	Very low	202 Å²	202	146.5 Å²	146.5	94%	0.944	80%	0.795	S	S	*	*				-150.1	160.7	118.2	-127.7	172	-138.7	0	0	110.3
202	V	29.3	Very low	31.7	Very low	123 Å²	123	152.1 Å²	152.1	75%	0.745	81%	0.808	S	S	*	*			trans	-115.2	127.4	-162.4	173.8	0	0	0	0	111.4
203	I	29.4	Very low	31.5	Very low	169 Å²	169	148.2 Å²	148.2	87%	0.867	80%	0.801	S	S	*	*			trans	-130.5	121.4	163.4	-57.1	-176.9	0	0	0	110.9
204	T	27.3	Very low	32.1	Very low	122 Å²	122	145.2 Å²	145.2	75%	0.748	79%	0.791	S	S	*	*			trans	-37.5	141.9	176.5	-21.6	0	0	0	0	118
205	E	32.6	Very low	33.2	Very low	171 Å²	171	141 Å²	141	80%	0.799	78%	0.78	S	S	*	*			trans	-56.4	159	153.4	-70.8	-73.4	150.6	0	0	111.8
206	P	32.9	Very low	35	Very low	104 Å²	104	138.6 Å²	138.6	68%	0.675	77%	0.766	S	S	*	*				-141.3	150.9	115.8	37.9	-27	0	0	0	115.9	T208	P206-T208 PolarHBondContact O-N 3.4Å
207	D	29.1	Very low	37.7	Very low	161 Å²	161	135.1 Å²	135.1	86%	0.861	74%	0.738	S	S	*	*			trans	-38.2	126.8	164.3	-115.7	-47.3	0	0	0	113.2
208	T	27.8	Very low	40	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	73%	0.725	S	S	*	*			trans	-143.9	102.8	162	8.1	0	0	0	0	112.7	P206	P206-T208 PolarHBondContact O-N 3.4Å
209	V	29.9	Very low	42.7	Very low	122 Å²	122	127 Å²	127	74%	0.739	69%	0.691	S	S	*	*			trans	19.6	109	139.8	-174.8	0	0	0	0	115.4	P211	V209-P211 WeakPolarHBondContact O-CD 3.41Å
210	Q	33.1	Very low	45	Very low	187 Å²	187	126.7 Å²	126.7	87%	0.874	69%	0.692	S	S	*	*			trans	-58.5	119.4	161.5	-76.3	-167.1	-39.1	0	0	109.8
211	P	35	Very low	46.7	Very low	109 Å²	109	122.5 Å²	122.5	71%	0.708	68%	0.679	S	S	*	*			trans	-70.7	133.7	163.1	-9.6	27.6	0	0	0	107.8	V209 S213	V209-P211 WeakPolarHBondContact O-CD 3.41Å; P211-S213 PolarHBondContact O-N 3.43Å
212	Q	46.4	Very low	49.1	Very low	198 Å²	198	115.9 Å²	115.9	93%	0.925	65%	0.654	S	S	*	*			trans	-69	86.3	160.7	-67.7	-178	-70.4	0	0	107.7	D214	Q212-D214 PolarHBondContact O-N 2.93Å
213	S	37	Very low	51.2	Low	102 Å²	102	112.8 Å²	112.8	71%	0.713	65%	0.646	S	S	*	*			trans	-62.1	127.2	172.5	59.9	0	0	0	0	108.8	P211	P211-S213 PolarHBondContact O-N 3.43Å
214	D	48.8	Very low	53.5	Low	132 Å²	132	109.7 Å²	109.7	71%	0.706	63%	0.628	S	S	*	*			trans	-46.9	158.3	172.9	-62.7	-75.8	0	0	0	112	Q212 T216	Q212-D214 PolarHBondContact O-N 2.93Å; D214-T216 WeakPolarHBondContact O-CA 3.49Å; D214-T216 WeakPolarHBondContact O-CB 3.33Å; D214-T216 PolarHBondContact O-N 2.92Å; D214-T216 PolarHBondContact O-OG1 3.4Å
215	G	58	Low	56	Low	50 Å²	50	108.2 Å²	108.2	52%	0.515	62%	0.619	S	S	.	*	S	Bend	trans	-63.8	66	-175	0	0	0	0	0	114.9	S227	G215-S227 CarbonylContact O-C 3.51Å; G215-S227 WeakPolarHBondContact O-CA 3.44Å
216	T	65.9	Low	58.5	Low	70 Å²	70	102 Å²	102	43%	0.429	59%	0.59	S	S	.	*			trans	-145.2	105.1	-150.3	-61.2	0	0	0	0	107.6	D214 P218 V225	D214-T216 WeakPolarHBondContact O-CA 3.49Å; D214-T216 WeakPolarHBondContact O-CB 3.33Å; D214-T216 PolarHBondContact O-N 2.92Å; D214-T216 PolarHBondContact O-OG1 3.4Å; T216-P218 WeakPolarHBondContact O-CD 3.27Å; T216-V225 HydrophobicContact CG2-CG1 3.31Å
217	F	84.3	Confident	60.7	Low	76 Å²	76	101.1 Å²	101.1	33%	0.333	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.2	89.4	-166.3	-62.2	-87.4	0	0	0	109.6	F226 Q228 A229 L232	F217-F226 HydrophobicContact CB-CB 4.47Å; F217-F226 WeakPolarHBondContact CB-O 3.34Å; F217-F226 WeakPolarHBondContact CD2-O 3.38Å; F217-F226 PolarHBondContact N-O 2.62Å; F217-F226 PolarHBondContact O-N 2.83Å; F217-Q228 VanDerWaalsContact CD2-C 3.43Å; F217-A229 HydrophobicContact CD1-CB 3.82Å; F217-A229 HydrophobicContact CD2-CB 4.47Å; F217-A229 VanDerWaalsContact CD2-N 3.29Å; F217-A229 HydrophobicContact CE1-CB 3.65Å; F217-A229 HydrophobicContact CE2-CB 4.32Å; F217-A229 HydrophobicContact CG-CB 4.23Å; F217-A229 HydrophobicContact CZ-CB 3.92Å; F217-L232 HydrophobicContact CB-CB 3.83Å; F217-L232 HydrophobicContact CB-CD2 3.75Å; F217-L232 HydrophobicContact CB-CG 4.38Å
218	P	77.1	Confident	63.1	Low	75 Å²	75	98 Å²	98	49%	0.487	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.1	147.2	178	29.5	-35.8	0	0	0	111.9	T216 Q224 V225 L232	T216-P218 WeakPolarHBondContact O-CD 3.27Å; P218-Q224 CarbonylContact C-O 3.59Å; P218-V225 HydrophobicContact CB-CG2 4.37Å; P218-L232 WeakPolarHBondContact O-CD2 3.26Å
219	C	85.6	Confident	65.3	Low	2 Å²	2	94.5 Å²	94.5	1%	0.014	55%	0.55	C	S	.	.			trans	-89.9	111.2	171.4	176.4	0	0	0	0	111	T221 C222 G223 Q224 F226 L232 H235 H239	C219-T221 PolarHBondContact O-N 2.87Å; C219-T221 VanDerWaalsContact O-N 3.1Å; C219-C222 PolarHBondContact O-N 2.81Å; C219-C222 VanDerWaalsContact O-N 3.16Å; C219-G223 WeakPolarHBondContact O-CA 3.44Å; C219-G223 PolarHBondContact O-N 2.97Å; C219-Q224 HydrophobicContact CB-CB 4.47Å; C219-Q224 VanDerWaalsContact CB-O 3.31Å; C219-Q224 WeakPolarHBondContact CB-O 3.42Å; C219-Q224 PolarHBondContact N-O 3.32Å; C219-F226 HydrophobicContact CB-CE2 4.23Å; C219-L232 HydrophobicContact CB-CD1 3.7Å; C219-H235 PolarHBondContact SG-CD2 2.79Å; C219-H235 PolarHBondContact SG-NE2 3.45Å; C219-H239 PolarHBondContact SG-CD2 2.85Å; C219-H239 PolarHBondContact SG-NE2 3.19Å
220	E	77.1	Confident	67.4	Low	188 Å²	188	95.7 Å²	95.7	88%	0.879	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-32.6	176.5	-65.3	159	-166	0	0	113.3
221	T	67.7	Low	69.3	Low	86 Å²	86	91 Å²	91	53%	0.528	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-17.9	-176.4	-40	0	0	0	0	114.7	C219 M236 H239	C219-T221 PolarHBondContact O-N 2.87Å; C219-T221 VanDerWaalsContact O-N 3.1Å; T221-M236 VanDerWaalsContact OG1-CE 3.27Å; T221-M236 WeakPolarHBondContact OG1-CE 3.41Å; T221-H239 HydrophobicContact CG2-CB 4.17Å
222	C	76.3	Confident	71.6	Confident	63 Å²	63	87.1 Å²	87.1	43%	0.426	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.6	18	-178.4	79.8	0	0	0	0	116	C219 Q224 H235 H239	C219-C222 PolarHBondContact O-N 2.81Å; C219-C222 VanDerWaalsContact O-N 3.16Å; C222-Q224 PolarHBondContact O-N 3.14Å; C222-H235 VanDerWaalsContact SG-CE1 3.5Å; C222-H235 PolarHBondContact SG-NE2 3.49Å; C222-H239 PolarHBondContact SG-NE2 2.92Å
223	G	74.1	Confident	73.1	Confident	57 Å²	57	85.8 Å²	85.8	59%	0.588	48%	0.482	S	S	*	.			trans	66.2	-1.7	176.9	0	0	0	0	0	116.6	C219 V225	C219-G223 WeakPolarHBondContact O-CA 3.44Å; C219-G223 PolarHBondContact O-N 2.97Å; G223-V225 PolarHBondContact O-N 3.34Å
224	Q	77.6	Confident	74.7	Confident	104 Å²	104	84 Å²	84	49%	0.486	47%	0.47	S	S	.	.			trans	-68.2	125.4	-178.1	-77.8	-163.9	-16.5	0	0	111.2	P218 C219 C222 F226 H235	P218-Q224 CarbonylContact C-O 3.59Å; C219-Q224 HydrophobicContact CB-CB 4.47Å; C219-Q224 VanDerWaalsContact CB-O 3.31Å; C219-Q224 WeakPolarHBondContact CB-O 3.42Å; C219-Q224 PolarHBondContact N-O 3.32Å; C222-Q224 PolarHBondContact O-N 3.14Å; Q224-F226 HydrophobicContact CB-CE2 3.65Å; Q224-F226 HydrophobicContact CB-CZ 3.67Å; Q224-F226 WeakPolarHBondContact O-CD2 3.32Å; Q224-F226 WeakPolarHBondContact O-CE2 3.32Å; Q224-H235 PolarHBondContact OE1-CE1 3.13Å; Q224-H235 PolarHBondContact OE1-ND1 2.94Å
225	V	79.3	Confident	76.1	Confident	92 Å²	92	78.2 Å²	78.2	56%	0.558	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	132.7	-177.2	176.6	0	0	0	0	110.6	T216 P218 G223	T216-V225 HydrophobicContact CG2-CG1 3.31Å; P218-V225 HydrophobicContact CB-CG2 4.37Å; G223-V225 PolarHBondContact O-N 3.34Å
226	F	86.4	Confident	76.8	Confident	40 Å²	40	78 Å²	78	18%	0.175	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.1	179	-62	-77.9	0	0	0	111.3	F217 C219 Q224 Q228 F231 L232 H235	F217-F226 HydrophobicContact CB-CB 4.47Å; F217-F226 WeakPolarHBondContact CB-O 3.34Å; F217-F226 WeakPolarHBondContact CD2-O 3.38Å; F217-F226 PolarHBondContact N-O 2.62Å; F217-F226 PolarHBondContact O-N 2.83Å; C219-F226 HydrophobicContact CB-CE2 4.23Å; Q224-F226 HydrophobicContact CB-CE2 3.65Å; Q224-F226 HydrophobicContact CB-CZ 3.67Å; Q224-F226 WeakPolarHBondContact O-CD2 3.32Å; Q224-F226 WeakPolarHBondContact O-CE2 3.32Å; F226-Q228 PolarHBondContact O-N 2.94Å; F226-F231 HydrophobicContact CB-CB 3.97Å; F226-F231 HydrophobicContact CD1-CB 3.89Å; F226-F231 HydrophobicContact CG-CB 4.15Å; F226-L232 HydrophobicContact CB-CB 4.18Å; F226-L232 HydrophobicContact CD2-CB 3.98Å; F226-L232 HydrophobicContact CD2-CD1 3.91Å; F226-L232 HydrophobicContact CE2-CD1 4.31Å; F226-L232 HydrophobicContact CG-CB 4.33Å; F226-H235 HydrophobicContact CD2-CB 4.38Å; F226-H235 HydrophobicContact CE1-CB 4.08Å; F226-H235 HydrophobicContact CE2-CB 3.67Å; F226-H235 AromaticContact CE2-CD2 3.5Å; F226-H235 AromaticContact CE2-CG 3.36Å; F226-H235 AromaticContact CE2-ND1 3.76Å; F226-H235 AromaticContact CE2-NE2 3.97Å; F226-H235 HydrophobicContact CZ-CB 3.53Å; F226-H235 AromaticContact CZ-CD2 3.85Å; F226-H235 AromaticContact CZ-CE1 3.83Å; F226-H235 AromaticContact CZ-CG 3.26Å; F226-H235 AromaticContact CZ-ND1 3.25Å; F226-H235 VanDerWaalsContact CZ-ND1 3.25Å; F226-H235 WeakPolarHBondContact CZ-ND1 3.4Å
227	S	78.1	Confident	77	Confident	85 Å²	85	82.6 Å²	82.6	59%	0.594	44%	0.439	S	S	*	.	S	Bend	trans	-71.6	-5.7	178.8	53.5	0	0	0	0	114.9	G215	G215-S227 CarbonylContact O-C 3.51Å; G215-S227 WeakPolarHBondContact O-CA 3.44Å
228	Q	79.2	Confident	75.9	Confident	95 Å²	95	85.9 Å²	85.9	44%	0.444	45%	0.453	S	S	.	.	S	Bend	trans	-147.8	138.2	178.9	-53.2	-177.8	7.8	0	0	111.6	F217 F226 W230 F231 L232	F217-Q228 VanDerWaalsContact CD2-C 3.43Å; F226-Q228 PolarHBondContact O-N 2.94Å; Q228-W230 PolarHBondContact O-N 2.98Å; Q228-F231 HydrophobicContact CB-CD2 3.96Å; Q228-F231 HydrophobicContact CG-CD2 4.3Å; Q228-F231 WeakPolarHBondContact O-CB 3.4Å; Q228-F231 PolarHBondContact O-N 2.89Å; Q228-L232 PolarHBondContact O-N 3.05Å
229	A	75.1	Confident	75.3	Confident	51 Å²	51	85.3 Å²	85.3	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-54.6	-29.2	-178.1	0	0	0	0	0	114.3	F217 K233	F217-A229 HydrophobicContact CD1-CB 3.82Å; F217-A229 HydrophobicContact CD2-CB 4.47Å; F217-A229 VanDerWaalsContact CD2-N 3.29Å; F217-A229 HydrophobicContact CE1-CB 3.65Å; F217-A229 HydrophobicContact CE2-CB 4.32Å; F217-A229 HydrophobicContact CG-CB 4.23Å; F217-A229 HydrophobicContact CZ-CB 3.92Å; A229-K233 VanDerWaalsContact O-CB 3.27Å; A229-K233 WeakPolarHBondContact O-CB 3.41Å; A229-K233 PolarHBondContact O-N 3.49Å
230	W	72.8	Confident	74	Confident	148 Å²	148	89 Å²	89	56%	0.561	47%	0.474	S	S	*	.	H	α-helix	trans	-77.8	-29.5	178.2	80.5	-89.9	0	0	0	113.1	Q228 K233 S234	Q228-W230 PolarHBondContact O-N 2.98Å; W230-K233 PolarHBondContact O-N 2.86Å; W230-S234 VanDerWaalsContact O-CB 3.3Å; W230-S234 WeakPolarHBondContact O-CB 3.31Å; W230-S234 PolarHBondContact O-N 2.73Å
231	F	74.8	Confident	72.6	Confident	88 Å²	88	80.6 Å²	80.6	39%	0.386	44%	0.438	S	S	.	.	H	α-helix	trans	-67.3	-45.9	169	-78.1	-59.3	0	0	0	110	F226 Q228 K233 S234 H235	F226-F231 HydrophobicContact CB-CB 3.97Å; F226-F231 HydrophobicContact CD1-CB 3.89Å; F226-F231 HydrophobicContact CG-CB 4.15Å; Q228-F231 HydrophobicContact CB-CD2 3.96Å; Q228-F231 HydrophobicContact CG-CD2 4.3Å; Q228-F231 WeakPolarHBondContact O-CB 3.4Å; Q228-F231 PolarHBondContact O-N 2.89Å; F231-K233 VanDerWaalsContact C-N 3.33Å; F231-K233 PolarHBondContact O-N 3.11Å; F231-S234 PolarHBondContact O-N 3.03Å; F231-H235 WeakPolarHBondContact O-CB 3.47Å; F231-H235 PolarHBondContact O-N 3.24Å
232	L	83.2	Confident	71.8	Confident	28 Å²	28	82.8 Å²	82.8	15%	0.147	45%	0.445	C	S	.	.	H	α-helix	trans	-55.2	-49	170.2	173.7	60.5	0	0	0	110.3	F217 P218 C219 F226 Q228 S234 H235 M236	F217-L232 HydrophobicContact CB-CB 3.83Å; F217-L232 HydrophobicContact CB-CD2 3.75Å; F217-L232 HydrophobicContact CB-CG 4.38Å; P218-L232 WeakPolarHBondContact O-CD2 3.26Å; C219-L232 HydrophobicContact CB-CD1 3.7Å; F226-L232 HydrophobicContact CB-CB 4.18Å; F226-L232 HydrophobicContact CD2-CB 3.98Å; F226-L232 HydrophobicContact CD2-CD1 3.91Å; F226-L232 HydrophobicContact CE2-CD1 4.31Å; F226-L232 HydrophobicContact CG-CB 4.33Å; Q228-L232 PolarHBondContact O-N 3.05Å; L232-S234 VanDerWaalsContact C-N 3.3Å; L232-S234 PolarHBondContact O-N 3.16Å; L232-H235 CarbonylContact O-C 3.36Å; L232-H235 PolarHBondContact O-N 2.96Å; L232-H235 VanDerWaalsContact O-N 3.14Å; L232-M236 HydrophobicContact CD1-CG 3.54Å; L232-M236 HydrophobicContact CD1-SD 4.15Å; L232-M236 HydrophobicContact CG-CG 3.88Å; L232-M236 WeakPolarHBondContact O-CB 3.48Å; L232-M236 WeakPolarHBondContact O-CG 3.39Å; L232-M236 PolarHBondContact O-N 3.18Å
233	K	77.5	Confident	70.5	Confident	169 Å²	169	81.8 Å²	81.8	74%	0.735	44%	0.436	S	S	*	.	H	α-helix	trans	-62.9	-31.9	180	-162.7	161.8	-169.3	155.8	0	113.7	A229 W230 F231 K237	A229-K233 VanDerWaalsContact O-CB 3.27Å; A229-K233 WeakPolarHBondContact O-CB 3.41Å; A229-K233 PolarHBondContact O-N 3.49Å; W230-K233 PolarHBondContact O-N 2.86Å; F231-K233 VanDerWaalsContact C-N 3.33Å; F231-K233 PolarHBondContact O-N 3.11Å; K233-K237 PolarHBondContact O-N 2.85Å
234	S	69.5	Low	69.6	Low	65 Å²	65	85 Å²	85	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-75	-37.7	174	-168	0	0	0	0	112.1	W230 F231 L232 K237	W230-S234 VanDerWaalsContact O-CB 3.3Å; W230-S234 WeakPolarHBondContact O-CB 3.31Å; W230-S234 PolarHBondContact O-N 2.73Å; F231-S234 PolarHBondContact O-N 3.03Å; L232-S234 VanDerWaalsContact C-N 3.3Å; L232-S234 PolarHBondContact O-N 3.16Å; S234-K237 WeakPolarHBondContact O-CB 3.37Å; S234-K237 PolarHBondContact O-N 3.4Å
235	H	79.1	Confident	68.6	Low	10 Å²	10	82.6 Å²	82.6	5%	0.046	43%	0.428	C	S	.	.	H	α-helix	trans	-69.7	-42.2	173.1	170.1	94.3	0	0	0	112.1	C219 C222 Q224 F226 F231 L232 K237 K238 H239	C219-H235 PolarHBondContact SG-CD2 2.79Å; C219-H235 PolarHBondContact SG-NE2 3.45Å; C222-H235 VanDerWaalsContact SG-CE1 3.5Å; C222-H235 PolarHBondContact SG-NE2 3.49Å; Q224-H235 PolarHBondContact OE1-CE1 3.13Å; Q224-H235 PolarHBondContact OE1-ND1 2.94Å; F226-H235 HydrophobicContact CD2-CB 4.38Å; F226-H235 HydrophobicContact CE1-CB 4.08Å; F226-H235 HydrophobicContact CE2-CB 3.67Å; F226-H235 AromaticContact CE2-CD2 3.5Å; F226-H235 AromaticContact CE2-CG 3.36Å; F226-H235 AromaticContact CE2-ND1 3.76Å; F226-H235 AromaticContact CE2-NE2 3.97Å; F226-H235 HydrophobicContact CZ-CB 3.53Å; F226-H235 AromaticContact CZ-CD2 3.85Å; F226-H235 AromaticContact CZ-CE1 3.83Å; F226-H235 AromaticContact CZ-CG 3.26Å; F226-H235 AromaticContact CZ-ND1 3.25Å; F226-H235 VanDerWaalsContact CZ-ND1 3.25Å; F226-H235 WeakPolarHBondContact CZ-ND1 3.4Å; F231-H235 WeakPolarHBondContact O-CB 3.47Å; F231-H235 PolarHBondContact O-N 3.24Å; L232-H235 CarbonylContact O-C 3.36Å; L232-H235 PolarHBondContact O-N 2.96Å; L232-H235 VanDerWaalsContact O-N 3.14Å; H235-K237 PolarHBondContact O-N 3.26Å; H235-K238 WeakPolarHBondContact O-CA 3.32Å; H235-K238 WeakPolarHBondContact O-CB 3.48Å; H235-K238 WeakPolarHBondContact O-CG 3.14Å; H235-K238 PolarHBondContact O-N 3.19Å; H235-H239 AromaticContact CD2-CD2 3.74Å; H235-H239 AromaticContact CD2-NE2 3.73Å; H235-H239 AromaticContact CE1-NE2 3.56Å; H235-H239 AromaticContact NE2-CD2 3.41Å; H235-H239 PolarHBondContact NE2-CD2 2.87Å; H235-H239 AromaticContact NE2-NE2 2.91Å; H235-H239 PolarHBondContact NE2-NE2 2.78Å
236	M	72.6	Confident	67.6	Low	47 Å²	47	81.2 Å²	81.2	23%	0.232	42%	0.422	C	S	.	.	H	α-helix	trans	-59.3	-30.5	171.4	-67.5	-107.6	64.5	0	0	110.9	T221 L232 K238 H239 A240	T221-M236 VanDerWaalsContact OG1-CE 3.27Å; T221-M236 WeakPolarHBondContact OG1-CE 3.41Å; L232-M236 HydrophobicContact CD1-CG 3.54Å; L232-M236 HydrophobicContact CD1-SD 4.15Å; L232-M236 HydrophobicContact CG-CG 3.88Å; L232-M236 WeakPolarHBondContact O-CB 3.48Å; L232-M236 WeakPolarHBondContact O-CG 3.39Å; L232-M236 PolarHBondContact O-N 3.18Å; M236-K238 PolarHBondContact O-N 3.25Å; M236-H239 HydrophobicContact CE-CB 4.28Å; M236-H239 CarbonylContact O-C 3.59Å; M236-H239 PolarHBondContact O-N 3.33Å; M236-A240 WeakPolarHBondContact O-CA 3.37Å; M236-A240 VanDerWaalsContact O-CB 3.32Å; M236-A240 WeakPolarHBondContact O-CB 3.4Å; M236-A240 PolarHBondContact O-N 3.1Å
237	K	70.9	Confident	67.1	Low	165 Å²	165	79.4 Å²	79.4	72%	0.717	41%	0.414	S	S	*	.	H	α-helix	trans	-70	-6.3	170	-158.6	-178.7	174.5	-172.9	0	114.1	K233 S234 H235 G241	K233-K237 PolarHBondContact O-N 2.85Å; S234-K237 WeakPolarHBondContact O-CB 3.37Å; S234-K237 PolarHBondContact O-N 3.4Å; H235-K237 PolarHBondContact O-N 3.26Å; K237-G241 WeakPolarHBondContact O-CA 3.38Å; K237-G241 PolarHBondContact O-N 3.07Å; K237-G241 VanDerWaalsContact O-N 3.11Å
238	K	61.2	Low	66.2	Low	146 Å²	146	87 Å²	87	64%	0.635	43%	0.429	S	S	*	.	H	α-helix	trans	-84.6	-32.8	165	-52.4	178.3	-179.2	-179.3	0	111.3	H235 M236	H235-K238 WeakPolarHBondContact O-CA 3.32Å; H235-K238 WeakPolarHBondContact O-CB 3.48Å; H235-K238 WeakPolarHBondContact O-CG 3.14Å; H235-K238 PolarHBondContact O-N 3.19Å; M236-K238 PolarHBondContact O-N 3.25Å
239	H	63.6	Low	65.2	Low	62 Å²	62	86.7 Å²	86.7	29%	0.287	43%	0.43	S	S	.	.	H	α-helix	trans	-81.8	-61.3	176	-64.2	-56.5	0	0	0	112.3	C219 T221 C222 H235 M236 G241	C219-H239 PolarHBondContact SG-CD2 2.85Å; C219-H239 PolarHBondContact SG-NE2 3.19Å; T221-H239 HydrophobicContact CG2-CB 4.17Å; C222-H239 PolarHBondContact SG-NE2 2.92Å; H235-H239 AromaticContact CD2-CD2 3.74Å; H235-H239 AromaticContact CD2-NE2 3.73Å; H235-H239 AromaticContact CE1-NE2 3.56Å; H235-H239 AromaticContact NE2-CD2 3.41Å; H235-H239 PolarHBondContact NE2-CD2 2.87Å; H235-H239 AromaticContact NE2-NE2 2.91Å; H235-H239 PolarHBondContact NE2-NE2 2.78Å; M236-H239 HydrophobicContact CE-CB 4.28Å; M236-H239 CarbonylContact O-C 3.59Å; M236-H239 PolarHBondContact O-N 3.33Å; H239-G241 CarbonylContact O-C 3.51Å; H239-G241 VanDerWaalsContact O-C 3.27Å; H239-G241 PolarHBondContact O-N 2.82Å
240	A	57.1	Low	65	Low	79 Å²	79	85.2 Å²	85.2	65%	0.653	42%	0.417	S	S	*	.	S	Bend	trans	-63.8	3.5	162.1	0	0	0	0	0	112.9	M236 I242	M236-A240 WeakPolarHBondContact O-CA 3.37Å; M236-A240 VanDerWaalsContact O-CB 3.32Å; M236-A240 WeakPolarHBondContact O-CB 3.4Å; M236-A240 PolarHBondContact O-N 3.1Å; A240-I242 PolarHBondContact O-N 3.46Å
241	G	47.9	Very low	64.4	Low	13 Å²	13	80.7 Å²	80.7	13%	0.134	42%	0.416	C	S	.	.			trans	-62.7	76.6	145.1	0	0	0	0	0	109.6	K237 H239 L243 R253	K237-G241 WeakPolarHBondContact O-CA 3.38Å; K237-G241 PolarHBondContact O-N 3.07Å; K237-G241 VanDerWaalsContact O-N 3.11Å; H239-G241 CarbonylContact O-C 3.51Å; H239-G241 VanDerWaalsContact O-C 3.27Å; H239-G241 PolarHBondContact O-N 2.82Å; G241-L243 PolarHBondContact O-N 3.11Å; G241-R253 VanDerWaalsContact O-CZ 3.29Å; G241-R253 PolarHBondContact O-NH1 3.18Å; G241-R253 PolarHBondContact O-NH2 2.93Å
242	I	51.8	Low	63.9	Low	131 Å²	131	82.9 Å²	82.9	67%	0.672	42%	0.421	S	S	*	.			trans	-63.4	92.2	154.8	-55.3	176.2	0	0	0	104.9	A240 D244	A240-I242 PolarHBondContact O-N 3.46Å; I242-D244 VanDerWaalsContact C-N 3.28Å; I242-D244 WeakPolarHBondContact CG2-OD1 3.47Å; I242-D244 PolarHBondContact O-N 2.75Å; I242-D244 VanDerWaalsContact O-N 3.1Å
243	L	50	Low	63.4	Low	43 Å²	43	87.4 Å²	87.4	23%	0.225	44%	0.437	C	S	.	.			trans	-82.2	88	174.3	-66.7	170.5	0	0	0	105.3	G241 H245 R253 R255	G241-L243 PolarHBondContact O-N 3.11Å; L243-H245 PolarHBondContact O-N 2.97Å; L243-R253 HydrophobicContact CB-CB 3.78Å; L243-R253 HydrophobicContact CD1-CB 3.35Å; L243-R253 HydrophobicContact CD1-CG 4.4Å; L243-R253 HydrophobicContact CG-CB 4.19Å; L243-R255 HydrophobicContact CD2-CB 4.3Å; L243-R255 HydrophobicContact CD2-CG 3.78Å
244	D	55	Low	63.4	Low	123 Å²	123	81.4 Å²	81.4	66%	0.658	41%	0.411	S	S	*	.	S	Bend	trans	-47.8	-11.4	-178.9	-61.2	-36.8	0	0	0	114.3	I242	I242-D244 VanDerWaalsContact C-N 3.28Å; I242-D244 WeakPolarHBondContact CG2-OD1 3.47Å; I242-D244 PolarHBondContact O-N 2.75Å; I242-D244 VanDerWaalsContact O-N 3.1Å
245	H	55.5	Low	62.9	Low	54 Å²	54	88.3 Å²	88.3	25%	0.25	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	68.9	-170.5	-54.3	-43.6	0	0	0	110	L243 F254 A257 L260	L243-H245 PolarHBondContact O-N 2.97Å; H245-F254 PolarHBondContact O-N 2.84Å; H245-A257 WeakPolarHBondContact CD2-CA 3.28Å; H245-A257 PolarHBondContact CD2-N 3.09Å; H245-A257 WeakPolarHBondContact NE2-CB 3.3Å; H245-A257 PolarHBondContact NE2-N 3.48Å; H245-L260 HydrophobicContact CB-CB 3.79Å; H245-L260 HydrophobicContact CB-CD2 3.68Å; H245-L260 HydrophobicContact CB-CG 4.35Å
246	C	57.7	Low	62.3	Low	64 Å²	64	92 Å²	92	43%	0.432	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	143.5	167.1	60.4	0	0	0	0	111.9	R248 L260	C246-R248 PolarHBondContact O-N 3.47Å; C246-L260 WeakPolarHBondContact O-CD2 3.44Å
247	C	77.7	Confident	62	Low	2 Å²	2	92.1 Å²	92.1	1%	0.014	45%	0.453	C	S	.	.			trans	-77.3	108.9	167.6	178.4	0	0	0	0	109.9	I249 C250 G251 R252 F254 L260 H263 M264 H267	C247-I249 PolarHBondContact O-N 2.82Å; C247-I249 PolarHBondContact SG-N 3.38Å; C247-C250 PolarHBondContact O-N 3.4Å; C247-C250 PolarHBondContact SG-N 3.04Å; C247-C250 PolarHBondContact SG-SG 3.24Å; C247-G251 WeakPolarHBondContact O-CA 3.45Å; C247-G251 PolarHBondContact O-N 3.46Å; C247-R252 HydrophobicContact CB-CB 4.3Å; C247-R252 VanDerWaalsContact CB-O 3.32Å; C247-R252 WeakPolarHBondContact CB-O 3.32Å; C247-R252 PolarHBondContact N-O 3.39Å; C247-F254 HydrophobicContact CB-CE2 4.25Å; C247-L260 HydrophobicContact CB-CD1 4.06Å; C247-H263 VanDerWaalsContact SG-CD2 3.54Å; C247-H263 PolarHBondContact SG-NE2 3.09Å; C247-M264 HydrophobicContact CB-CE 4.12Å; C247-M264 WeakPolarHBondContact SG-CE 3.5Å; C247-H267 PolarHBondContact SG-NE2 3.24Å
248	R	57.8	Low	62	Low	243 Å²	243	91.7 Å²	91.7	92%	0.917	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-13.2	175.9	-64.2	-174.6	-179.4	-177.5	-1.5	114.3	C246	C246-R248 PolarHBondContact O-N 3.47Å
249	I	57.8	Low	62.5	Low	89 Å²	89	89 Å²	89	46%	0.456	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-25.7	-174.3	-54.1	170.7	0	0	0	112.6	C247 M264 H267 Y304	C247-I249 PolarHBondContact O-N 2.82Å; C247-I249 PolarHBondContact SG-N 3.38Å; I249-M264 HydrophobicContact CD1-CE 4.16Å; I249-M264 HydrophobicContact CD1-SD 4.44Å; I249-M264 HydrophobicContact CG1-CE 4.47Å; I249-H267 HydrophobicContact CD1-CB 3.85Å; I249-H267 WeakPolarHBondContact CG2-CE1 3.39Å; I249-Y304 HydrophobicContact CG2-CE2 4.25Å
250	C	70.9	Confident	63.3	Low	21 Å²	21	87.3 Å²	87.3	14%	0.142	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.9	21	179.7	73.2	0	0	0	0	115	C247 R252 H263 H267 Y304	C247-C250 PolarHBondContact O-N 3.4Å; C247-C250 PolarHBondContact SG-N 3.04Å; C247-C250 PolarHBondContact SG-SG 3.24Å; C250-R252 PolarHBondContact O-N 3.3Å; C250-H263 PolarHBondContact SG-NE2 3.05Å; C250-H267 PolarHBondContact SG-NE2 2.88Å; C250-H267 VanDerWaalsContact SG-NE2 3.37Å; C250-Y304 HydrophobicContact CB-CE2 4.42Å
251	G	60.7	Low	64.1	Low	52 Å²	52	91.6 Å²	91.6	54%	0.536	43%	0.432	S	S	.	.			trans	70	-18.7	173.3	0	0	0	0	0	116.4	C247 R253	C247-G251 WeakPolarHBondContact O-CA 3.45Å; C247-G251 PolarHBondContact O-N 3.46Å; G251-R253 WeakPolarHBondContact O-CG 3.41Å; G251-R253 PolarHBondContact O-N 3.4Å
252	R	63.8	Low	65.3	Low	134 Å²	134	94.3 Å²	94.3	51%	0.506	45%	0.449	S	S	.	.			trans	-53.3	121.9	-176.6	-68.9	-173.9	-176.3	-171.6	4.2	111.4	C247 C250 F254 H315	C247-R252 HydrophobicContact CB-CB 4.3Å; C247-R252 VanDerWaalsContact CB-O 3.32Å; C247-R252 WeakPolarHBondContact CB-O 3.32Å; C247-R252 PolarHBondContact N-O 3.39Å; C250-R252 PolarHBondContact O-N 3.3Å; R252-F254 HydrophobicContact CB-CE2 3.79Å; R252-F254 HydrophobicContact CB-CZ 3.9Å; R252-F254 WeakPolarHBondContact O-CD2 3.48Å; R252-F254 VanDerWaalsContact O-CE2 3.28Å; R252-F254 WeakPolarHBondContact O-CE2 3.39Å; R252-H315 PolarHBondContact NH2-NE2 3.41Å
253	R	73.5	Confident	66.6	Low	124 Å²	124	89.2 Å²	89.2	47%	0.468	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.5	-175.3	-51.8	179.8	78.4	-138.8	2.9	109.7	G241 L243 G251	G241-R253 VanDerWaalsContact O-CZ 3.29Å; G241-R253 PolarHBondContact O-NH1 3.18Å; G241-R253 PolarHBondContact O-NH2 2.93Å; L243-R253 HydrophobicContact CB-CB 3.78Å; L243-R253 HydrophobicContact CD1-CB 3.35Å; L243-R253 HydrophobicContact CD1-CG 4.4Å; L243-R253 HydrophobicContact CG-CB 4.19Å; G251-R253 WeakPolarHBondContact O-CG 3.41Å; G251-R253 PolarHBondContact O-N 3.4Å
254	F	76.5	Confident	67.5	Low	43 Å²	43	89.5 Å²	89.5	19%	0.189	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.2	-175.9	-62.2	-85.8	0	0	0	111.9	H245 C247 R252 E256 F259 L260 H263	H245-F254 PolarHBondContact O-N 2.84Å; C247-F254 HydrophobicContact CB-CE2 4.25Å; R252-F254 HydrophobicContact CB-CE2 3.79Å; R252-F254 HydrophobicContact CB-CZ 3.9Å; R252-F254 WeakPolarHBondContact O-CD2 3.48Å; R252-F254 VanDerWaalsContact O-CE2 3.28Å; R252-F254 WeakPolarHBondContact O-CE2 3.39Å; F254-E256 VanDerWaalsContact C-N 3.33Å; F254-E256 PolarHBondContact O-N 2.92Å; F254-F259 HydrophobicContact CB-CB 4.05Å; F254-F259 HydrophobicContact CD1-CB 3.67Å; F254-F259 HydrophobicContact CE1-CB 4.49Å; F254-F259 HydrophobicContact CG-CB 4.1Å; F254-L260 HydrophobicContact CB-CB 4.29Å; F254-L260 HydrophobicContact CD2-CB 3.93Å; F254-L260 HydrophobicContact CD2-CD1 3.98Å; F254-L260 HydrophobicContact CE2-CD1 4.17Å; F254-L260 HydrophobicContact CG-CB 4.31Å; F254-H263 HydrophobicContact CE1-CB 4.3Å; F254-H263 HydrophobicContact CE2-CB 3.97Å; F254-H263 AromaticContact CE2-CD2 3.47Å; F254-H263 VanDerWaalsContact CE2-CD2 3.47Å; F254-H263 WeakPolarHBondContact CE2-CD2 3.39Å; F254-H263 AromaticContact CE2-CG 3.82Å; F254-H263 HydrophobicContact CZ-CB 3.64Å; F254-H263 AromaticContact CZ-CD2 3.59Å; F254-H263 AromaticContact CZ-CG 3.5Å
255	R	59.3	Low	68.4	Low	210 Å²	210	90.6 Å²	90.6	79%	0.792	42%	0.422	S	S	*	.	S	Bend	trans	-72	-24.1	-179.1	-69.7	179.4	-177.1	167.3	4.2	113.4	L243	L243-R255 HydrophobicContact CD2-CB 4.3Å; L243-R255 HydrophobicContact CD2-CG 3.78Å
256	E	66.8	Low	68.7	Low	86 Å²	86	92.2 Å²	92.2	40%	0.402	44%	0.435	S	S	.	.	S	Bend	trans	-139.4	145.4	179.8	-58.2	78.8	-169	0	0	112.2	F254 W258 F259 L260	F254-E256 VanDerWaalsContact C-N 3.33Å; F254-E256 PolarHBondContact O-N 2.92Å; E256-W258 PolarHBondContact O-N 3.38Å; E256-F259 HydrophobicContact CB-CD2 4.23Å; E256-F259 PolarHBondContact O-N 3.13Å; E256-F259 VanDerWaalsContact O-N 3.09Å; E256-F259 WeakPolarHBondContact OE2-CD2 3.16Å; E256-F259 WeakPolarHBondContact OE2-CE2 3.38Å; E256-L260 PolarHBondContact O-N 2.89Å
257	A	67.8	Low	69.2	Low	51 Å²	51	90.6 Å²	90.6	42%	0.421	42%	0.422	S	S	.	.	H	α-helix	trans	-54.1	-31.3	-176.9	0	0	0	0	0	114.1	H245 L260 K261	H245-A257 WeakPolarHBondContact CD2-CA 3.28Å; H245-A257 PolarHBondContact CD2-N 3.09Å; H245-A257 WeakPolarHBondContact NE2-CB 3.3Å; H245-A257 PolarHBondContact NE2-N 3.48Å; A257-L260 PolarHBondContact O-N 3.32Å; A257-K261 WeakPolarHBondContact O-CB 3.44Å; A257-K261 PolarHBondContact O-N 2.88Å
258	W	69.6	Low	68.2	Low	155 Å²	155	95.4 Å²	95.4	59%	0.587	45%	0.447	S	S	*	.	H	α-helix	trans	-73.4	-33.2	-176.4	82.6	-91.6	0	0	0	112.4	E256 K261 S262	E256-W258 PolarHBondContact O-N 3.38Å; W258-K261 PolarHBondContact O-N 3.06Å; W258-S262 WeakPolarHBondContact O-CB 3.32Å; W258-S262 PolarHBondContact O-N 3.03Å
259	F	72	Confident	67.8	Low	90 Å²	90	88.8 Å²	88.8	40%	0.395	43%	0.434	S	S	.	.	H	α-helix	trans	-67.4	-44.8	172.5	-76.9	-69	0	0	0	110.6	F254 E256 K261 S262 H263	F254-F259 HydrophobicContact CB-CB 4.05Å; F254-F259 HydrophobicContact CD1-CB 3.67Å; F254-F259 HydrophobicContact CE1-CB 4.49Å; F254-F259 HydrophobicContact CG-CB 4.1Å; E256-F259 HydrophobicContact CB-CD2 4.23Å; E256-F259 PolarHBondContact O-N 3.13Å; E256-F259 VanDerWaalsContact O-N 3.09Å; E256-F259 WeakPolarHBondContact OE2-CD2 3.16Å; E256-F259 WeakPolarHBondContact OE2-CE2 3.38Å; F259-K261 VanDerWaalsContact C-N 3.32Å; F259-K261 PolarHBondContact O-N 2.88Å; F259-S262 PolarHBondContact O-N 3.1Å; F259-H263 WeakPolarHBondContact O-CB 3.42Å; F259-H263 PolarHBondContact O-N 2.84Å
260	L	81.2	Confident	67.1	Low	27 Å²	27	94.4 Å²	94.4	14%	0.141	45%	0.449	C	S	.	.	H	α-helix	trans	-58.7	-44	171.2	174.2	63.3	0	0	0	110.9	H245 C246 C247 F254 E256 A257 S262 H263 M264	H245-L260 HydrophobicContact CB-CB 3.79Å; H245-L260 HydrophobicContact CB-CD2 3.68Å; H245-L260 HydrophobicContact CB-CG 4.35Å; C246-L260 WeakPolarHBondContact O-CD2 3.44Å; C247-L260 HydrophobicContact CB-CD1 4.06Å; F254-L260 HydrophobicContact CB-CB 4.29Å; F254-L260 HydrophobicContact CD2-CB 3.93Å; F254-L260 HydrophobicContact CD2-CD1 3.98Å; F254-L260 HydrophobicContact CE2-CD1 4.17Å; F254-L260 HydrophobicContact CG-CB 4.31Å; E256-L260 PolarHBondContact O-N 2.89Å; A257-L260 PolarHBondContact O-N 3.32Å; L260-S262 VanDerWaalsContact C-N 3.33Å; L260-S262 PolarHBondContact O-N 3.34Å; L260-H263 CarbonylContact O-C 3.54Å; L260-H263 PolarHBondContact O-N 3.43Å; L260-M264 HydrophobicContact CD1-CE 4.02Å; L260-M264 HydrophobicContact CD1-CG 3.91Å; L260-M264 HydrophobicContact CG-CG 4.11Å; L260-M264 WeakPolarHBondContact O-CB 3.39Å; L260-M264 VanDerWaalsContact O-CG 3.27Å; L260-M264 WeakPolarHBondContact O-CG 3.28Å; L260-M264 PolarHBondContact O-N 3.33Å
261	K	73.5	Confident	65.6	Low	168 Å²	168	97.5 Å²	97.5	73%	0.73	47%	0.472	S	S	*	.	H	α-helix	trans	-65.8	-34.5	179.8	-167.6	169	-175	172.1	0	112.8	A257 W258 F259 K265	A257-K261 WeakPolarHBondContact O-CB 3.44Å; A257-K261 PolarHBondContact O-N 2.88Å; W258-K261 PolarHBondContact O-N 3.06Å; F259-K261 VanDerWaalsContact C-N 3.32Å; F259-K261 PolarHBondContact O-N 2.88Å; K261-K265 PolarHBondContact O-N 3.1Å
262	S	71.8	Confident	64.4	Low	70 Å²	70	106.4 Å²	106.4	49%	0.49	49%	0.489	S	S	.	.	H	α-helix	trans	-66.6	-43.3	171.5	-164.6	0	0	0	0	111.2	W258 F259 L260 K265 T266	W258-S262 WeakPolarHBondContact O-CB 3.32Å; W258-S262 PolarHBondContact O-N 3.03Å; F259-S262 PolarHBondContact O-N 3.1Å; L260-S262 VanDerWaalsContact C-N 3.33Å; L260-S262 PolarHBondContact O-N 3.34Å; S262-K265 WeakPolarHBondContact O-CA 3.4Å; S262-K265 WeakPolarHBondContact O-CB 3.5Å; S262-K265 PolarHBondContact O-N 2.69Å; S262-K265 VanDerWaalsContact O-N 3.09Å; S262-T266 PolarHBondContact O-N 2.76Å
263	H	79.9	Confident	62.9	Low	25 Å²	25	105.1 Å²	105.1	12%	0.116	50%	0.5	C	S	.	.	H	α-helix	trans	-68.6	-38.1	176.1	178.5	57.9	0	0	0	113.3	C247 C250 F254 F259 L260 K265 T266 H267	C247-H263 VanDerWaalsContact SG-CD2 3.54Å; C247-H263 PolarHBondContact SG-NE2 3.09Å; C250-H263 PolarHBondContact SG-NE2 3.05Å; F254-H263 HydrophobicContact CE1-CB 4.3Å; F254-H263 HydrophobicContact CE2-CB 3.97Å; F254-H263 AromaticContact CE2-CD2 3.47Å; F254-H263 VanDerWaalsContact CE2-CD2 3.47Å; F254-H263 WeakPolarHBondContact CE2-CD2 3.39Å; F254-H263 AromaticContact CE2-CG 3.82Å; F254-H263 HydrophobicContact CZ-CB 3.64Å; F254-H263 AromaticContact CZ-CD2 3.59Å; F254-H263 AromaticContact CZ-CG 3.5Å; F259-H263 WeakPolarHBondContact O-CB 3.42Å; F259-H263 PolarHBondContact O-N 2.84Å; L260-H263 CarbonylContact O-C 3.54Å; L260-H263 PolarHBondContact O-N 3.43Å; H263-K265 PolarHBondContact O-N 2.9Å; H263-T266 PolarHBondContact O-N 3.18Å; H263-T266 PolarHBondContact O-OG1 3.42Å; H263-H267 AromaticContact CD2-NE2 3.16Å; H263-H267 PolarHBondContact CD2-NE2 2.83Å; H263-H267 AromaticContact CE1-NE2 2.68Å; H263-H267 PolarHBondContact CE1-NE2 3.32Å; H263-H267 AromaticContact CG-NE2 3.89Å; H263-H267 AromaticContact ND1-NE2 3.64Å; H263-H267 AromaticContact NE2-CD2 3.93Å; H263-H267 AromaticContact NE2-NE2 2.25Å; H263-H267 PolarHBondContact NE2-NE2 2.92Å; H263-H267 PolarHBondContact O-CD2 3.47Å; H263-H267 VanDerWaalsContact O-CD2 3.31Å
264	M	68.6	Low	61	Low	48 Å²	48	110.4 Å²	110.4	24%	0.236	52%	0.52	C	S	.	.	H	α-helix	trans	-59.8	-27.6	169.1	-73.2	-70.1	101.1	0	0	111.7	C247 I249 L260 T266 H267 N268	C247-M264 HydrophobicContact CB-CE 4.12Å; C247-M264 WeakPolarHBondContact SG-CE 3.5Å; I249-M264 HydrophobicContact CD1-CE 4.16Å; I249-M264 HydrophobicContact CD1-SD 4.44Å; I249-M264 HydrophobicContact CG1-CE 4.47Å; L260-M264 HydrophobicContact CD1-CE 4.02Å; L260-M264 HydrophobicContact CD1-CG 3.91Å; L260-M264 HydrophobicContact CG-CG 4.11Å; L260-M264 WeakPolarHBondContact O-CB 3.39Å; L260-M264 VanDerWaalsContact O-CG 3.27Å; L260-M264 WeakPolarHBondContact O-CG 3.28Å; L260-M264 PolarHBondContact O-N 3.33Å; M264-T266 VanDerWaalsContact C-N 3.33Å; M264-H267 PolarHBondContact O-N 3.33Å; M264-N268 WeakPolarHBondContact O-CB 3.34Å; M264-N268 PolarHBondContact O-N 3.32Å
265	K	74.4	Confident	58.9	Low	146 Å²	146	113.6 Å²	113.6	64%	0.635	55%	0.548	S	S	*	.	H	α-helix	trans	-66.9	-31.8	172.1	-154.6	178.6	179.6	-174.3	0	112.3	K261 S262 H263 H267 N268 T269	K261-K265 PolarHBondContact O-N 3.1Å; S262-K265 WeakPolarHBondContact O-CA 3.4Å; S262-K265 WeakPolarHBondContact O-CB 3.5Å; S262-K265 PolarHBondContact O-N 2.69Å; S262-K265 VanDerWaalsContact O-N 3.09Å; H263-K265 PolarHBondContact O-N 2.9Å; K265-H267 VanDerWaalsContact C-N 3.26Å; K265-H267 PolarHBondContact O-N 3.18Å; K265-N268 PolarHBondContact O-N 3.4Å; K265-T269 WeakPolarHBondContact O-CG2 3.3Å; K265-T269 PolarHBondContact O-N 3.37Å; K265-T269 PolarHBondContact O-OG1 3.4Å; K265-T269 VanDerWaalsContact O-OG1 3.04Å
266	T	61.9	Low	57.7	Low	88 Å²	88	113.8 Å²	113.8	54%	0.54	55%	0.554	S	S	.	*	H	α-helix	trans	-71.6	-20.6	175.8	67.4	0	0	0	0	113.3	S262 H263 M264 T269	S262-T266 PolarHBondContact O-N 2.76Å; H263-T266 PolarHBondContact O-N 3.18Å; H263-T266 PolarHBondContact O-OG1 3.42Å; M264-T266 VanDerWaalsContact C-N 3.33Å; T266-T269 WeakPolarHBondContact CA-OG1 3.37Å; T266-T269 PolarHBondContact O-OG1 2.88Å; T266-T269 VanDerWaalsContact O-OG1 3.11Å
267	H	68.2	Low	56.2	Low	31 Å²	31	113.8 Å²	113.8	14%	0.144	57%	0.57	C	S	.	*	H	α-helix	trans	-81.6	-49.1	167.9	-62.8	-80.8	0	0	0	110.7	C247 I249 C250 H263 M264 K265 T269 R270 Y304	C247-H267 PolarHBondContact SG-NE2 3.24Å; I249-H267 HydrophobicContact CD1-CB 3.85Å; I249-H267 WeakPolarHBondContact CG2-CE1 3.39Å; C250-H267 PolarHBondContact SG-NE2 2.88Å; C250-H267 VanDerWaalsContact SG-NE2 3.37Å; H263-H267 AromaticContact CD2-NE2 3.16Å; H263-H267 PolarHBondContact CD2-NE2 2.83Å; H263-H267 AromaticContact CE1-NE2 2.68Å; H263-H267 PolarHBondContact CE1-NE2 3.32Å; H263-H267 AromaticContact CG-NE2 3.89Å; H263-H267 AromaticContact ND1-NE2 3.64Å; H263-H267 AromaticContact NE2-CD2 3.93Å; H263-H267 AromaticContact NE2-NE2 2.25Å; H263-H267 PolarHBondContact NE2-NE2 2.92Å; H263-H267 PolarHBondContact O-CD2 3.47Å; H263-H267 VanDerWaalsContact O-CD2 3.31Å; M264-H267 PolarHBondContact O-N 3.33Å; K265-H267 VanDerWaalsContact C-N 3.26Å; K265-H267 PolarHBondContact O-N 3.18Å; H267-T269 PolarHBondContact O-N 3.26Å; H267-R270 PolarHBondContact O-N 3.3Å; H267-R270 VanDerWaalsContact O-N 3.08Å; H267-Y304 AromaticContact CE1-CE2 3.36Å; H267-Y304 WeakPolarHBondContact CE1-CE2 3.49Å; H267-Y304 AromaticContact CE1-CZ 3.33Å; H267-Y304 PolarHBondContact CE1-OH 3.29Å
268	N	55.7	Low	54.5	Low	103 Å²	103	118.4 Å²	118.4	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-66.5	-16	-179.6	-80.8	-29.4	0	0	0	115.1	M264 K265 R270 S271	M264-N268 WeakPolarHBondContact O-CB 3.34Å; M264-N268 PolarHBondContact O-N 3.32Å; K265-N268 PolarHBondContact O-N 3.4Å; N268-R270 PolarHBondContact O-N 3.44Å; N268-S271 WeakPolarHBondContact CA-OG 3.36Å; N268-S271 PolarHBondContact O-N 3.29Å; N268-S271 PolarHBondContact O-OG 3.14Å; N268-S271 PolarHBondContact OD1-OG 3.33Å
269	T	50	Low	52.8	Low	104 Å²	104	116.1 Å²	116.1	64%	0.638	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-8.5	170.3	38.4	0	0	0	0	114.1	K265 T266 H267	K265-T269 WeakPolarHBondContact O-CG2 3.3Å; K265-T269 PolarHBondContact O-N 3.37Å; K265-T269 PolarHBondContact O-OG1 3.4Å; K265-T269 VanDerWaalsContact O-OG1 3.04Å; T266-T269 WeakPolarHBondContact CA-OG1 3.37Å; T266-T269 PolarHBondContact O-OG1 2.88Å; T266-T269 VanDerWaalsContact O-OG1 3.11Å; H267-T269 PolarHBondContact O-N 3.26Å
270	R	43.2	Very low	50.8	Low	206 Å²	206	117 Å²	117	78%	0.777	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-8.5	174.7	-90.2	-178.2	162.7	176.2	-7	115	H267 N268	H267-R270 PolarHBondContact O-N 3.3Å; H267-R270 VanDerWaalsContact O-N 3.08Å; N268-R270 PolarHBondContact O-N 3.44Å
271	S	39.6	Very low	48.6	Very low	87 Å²	87	124.4 Å²	124.4	61%	0.608	65%	0.652	S	S	*	*	S	Bend	trans	-104.2	12.2	-172.5	56.3	0	0	0	0	115	N268	N268-S271 WeakPolarHBondContact CA-OG 3.36Å; N268-S271 PolarHBondContact O-N 3.29Å; N268-S271 PolarHBondContact O-OG 3.14Å; N268-S271 PolarHBondContact OD1-OG 3.33Å
272	R	35.8	Very low	47.1	Very low	238 Å²	238	121.4 Å²	121.4	90%	0.898	65%	0.65	S	S	*	*			trans	-128.9	64.3	-176.2	-156.1	178.6	-172.3	-164.9	0.6	114.4
273	S	32.2	Very low	46.3	Very low	107 Å²	107	123.6 Å²	123.6	75%	0.748	66%	0.662	S	S	*	*			trans	-138.8	137	158.4	53.6	0	0	0	0	109.8
274	R	32.7	Very low	43.7	Very low	236 Å²	236	128.7 Å²	128.7	89%	0.891	70%	0.696	S	S	*	*			trans	65	142.1	-168.9	-65.8	-179.9	167.5	177.8	-6.9	114.7
275	S	32.8	Very low	41.9	Very low	110 Å²	110	132 Å²	132	77%	0.769	72%	0.719	S	S	*	*			cis	-165.5	153.2	-12.4	38.9	0	0	0	0	111
276	K	34.1	Very low	39.9	Very low	213 Å²	213	131.9 Å²	131.9	93%	0.926	72%	0.723	S	S	*	*			trans	-163.3	118.3	131.2	-141	173.7	-176.5	-179.7	0	113.6
277	A	35	Very low	38.5	Very low	87 Å²	87	134.1 Å²	134.1	72%	0.719	73%	0.732	S	S	*	*			trans	175.7	132.1	155	0	0	0	0	0	105.5
278	D	33.1	Very low	37.1	Very low	148 Å²	148	139.6 Å²	139.6	79%	0.791	76%	0.762	S	S	*	*			cis	-156.1	172	-5.5	-133.3	-16.9	0	0	0	113.5
279	S	33.5	Very low	36.2	Very low	107 Å²	107	140.7 Å²	140.7	75%	0.748	77%	0.773	S	S	*	*			trans	44.6	117.2	151	-57.7	0	0	0	0	123
280	A	30.4	Very low	35	Very low	107 Å²	107	140.2 Å²	140.2	88%	0.884	78%	0.779	S	S	*	*				-167.7	160.8	124.5	0	0	0	0	0	110.8
281	E	33.5	Very low	34.4	Very low	183 Å²	183	139 Å²	139	86%	0.855	78%	0.783	S	S	*	*			trans	-122.2	-176.3	-172.2	-130.6	-157.8	-164.9	0	0	112.1
282	P	41.7	Very low	33.9	Very low	106 Å²	106	142.4 Å²	142.4	69%	0.688	79%	0.794	S	S	*	*				-127.1	-139.8	-108.1	50.9	-33.2	0	0	0	112.8
283	P	56.2	Low	34.7	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	78%	0.781	S	S	*	*			trans	-122.4	149.7	-140.9	37.1	-15.6	0	0	0	117.9
284	T	24.4	Very low	34.7	Very low	133 Å²	133	137.4 Å²	137.4	82%	0.816	78%	0.782	S	S	*	*			trans	-152.7	157.5	158.1	49.7	0	0	0	0	107.3
285	T	32.3	Very low	34.8	Very low	118 Å²	118	133.4 Å²	133.4	72%	0.724	78%	0.777	S	S	*	*			cis	-134.5	138.3	8.6	32	0	0	0	0	108.6
286	I	30.8	Very low	34.8	Very low	142 Å²	142	134 Å²	134	73%	0.728	78%	0.776	S	S	*	*				68.4	131.7	82.4	-63.8	174	0	0	0	114.1
287	N	33	Very low	34.7	Very low	136 Å²	136	130.7 Å²	130.7	73%	0.727	77%	0.773	S	S	*	*			trans	75.6	75.7	176.5	-63	2.7	0	0	0	118.9
288	D	38.3	Very low	34.9	Very low	145 Å²	145	133 Å²	133	78%	0.775	78%	0.779	S	S	*	*				65.4	119.8	123.4	-61.5	-50.4	0	0	0	123.8
289	V	37.8	Very low	35.1	Very low	127 Å²	127	131 Å²	131	77%	0.77	78%	0.777	S	S	*	*			trans	76.7	98.8	152	-173.5	0	0	0	0	120
290	A	25.7	Very low	35.4	Very low	94 Å²	94	132.7 Å²	132.7	78%	0.777	78%	0.782	S	S	*	*				-154.5	108.1	125.6	0	0	0	0	0	106.9
291	Q	29.1	Very low	36.1	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	78%	0.783	S	S	*	*				67.8	102.3	87.5	-73	-167.4	-9.3	0	0	115.1
292	D	30.6	Very low	36.5	Very low	157 Å²	157	130.4 Å²	130.4	84%	0.84	77%	0.774	S	S	*	*			trans	-60	169.8	149.6	-99.6	-48.9	0	0	0	111.7
293	P	51.2	Low	37.7	Very low	98 Å²	98	130.2 Å²	130.2	64%	0.636	77%	0.77	S	S	*	*			cis	-131.8	-163.4	1.3	36.6	-16.4	0	0	0	114.3
294	D	32	Very low	37.6	Very low	142 Å²	142	127.1 Å²	127.1	76%	0.759	74%	0.744	S	S	*	*			trans	66.6	99.9	153.5	-69.7	-23.9	0	0	0	119.9
295	I	34.8	Very low	39.7	Very low	153 Å²	153	124.4 Å²	124.4	79%	0.785	72%	0.722	S	S	*	*				-177.3	142	102.5	-91.3	157.4	0	0	0	111
296	T	34.5	Very low	41.5	Very low	122 Å²	122	124.3 Å²	124.3	75%	0.748	72%	0.715	S	S	*	*			trans	53.3	107.7	173.4	48.2	0	0	0	0	118.9
297	T	31.8	Very low	43.8	Very low	143 Å²	143	117.6 Å²	117.6	88%	0.877	68%	0.681	S	S	*	*				-164.4	122.2	106.8	13.9	0	0	0	0	111.8
298	T	38.1	Very low	45.6	Very low	137 Å²	137	116.9 Å²	116.9	84%	0.84	69%	0.686	S	S	*	*			trans	-147.2	150.9	170	-68.1	0	0	0	0	109.4
299	S	37.8	Very low	46.8	Very low	106 Å²	106	116.7 Å²	116.7	74%	0.741	68%	0.679	S	S	*	*			trans	67.7	92.9	170.9	69.7	0	0	0	0	118.8
300	V	39.4	Very low	48.3	Very low	141 Å²	141	113.3 Å²	113.3	86%	0.855	66%	0.66	S	S	*	*			trans	-141.7	100.1	140.5	-175.2	0	0	0	0	109.8
301	T	44.6	Very low	50.4	Low	148 Å²	148	110.7 Å²	110.7	91%	0.908	64%	0.642	S	S	*	*			trans	-171.3	75.9	150.3	10.8	0	0	0	0	111.8
302	S	43.1	Very low	52	Low	95 Å²	95	105.9 Å²	105.9	66%	0.664	62%	0.622	S	S	*	*			trans	-136.5	136.4	154.8	-174.1	0	0	0	0	110.8	Y304	S302-Y304 PolarHBondContact OG-N 2.95Å; S302-Y304 PolarHBondContact OG-O 3.02Å
303	V	65.9	Low	53.9	Low	101 Å²	101	101.9 Å²	101.9	61%	0.612	60%	0.6	S	S	*	*			trans	-117.6	12.2	178.1	-170.4	0	0	0	0	110.5
304	Y	54.3	Low	55.2	Low	50 Å²	50	99.1 Å²	99.1	20%	0.196	58%	0.579	C	S	.	*	S	Bend	trans	-128.5	136.9	175.1	-64.7	-75.4	0	0	0	109.2	I249 C250 H267 S302 H315	I249-Y304 HydrophobicContact CG2-CE2 4.25Å; C250-Y304 HydrophobicContact CB-CE2 4.42Å; H267-Y304 AromaticContact CE1-CE2 3.36Å; H267-Y304 WeakPolarHBondContact CE1-CE2 3.49Å; H267-Y304 AromaticContact CE1-CZ 3.33Å; H267-Y304 PolarHBondContact CE1-OH 3.29Å; S302-Y304 PolarHBondContact OG-N 2.95Å; S302-Y304 PolarHBondContact OG-O 3.02Å; Y304-H315 AromaticContact CD1-CE1 3.98Å; Y304-H315 AromaticContact CD1-ND1 3.7Å; Y304-H315 AromaticContact CE1-CD2 3.85Å; Y304-H315 AromaticContact CE1-CE1 3.6Å; Y304-H315 AromaticContact CE1-CG 3.81Å; Y304-H315 AromaticContact CE1-ND1 3.65Å; Y304-H315 AromaticContact CE1-NE2 3.74Å
305	Q	69.6	Low	56.5	Low	76 Å²	76	97.6 Å²	97.6	36%	0.355	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	125	176.3	-68.2	-176.5	-26	0	0	109.3	F314 K317 L320	Q305-F314 PolarHBondContact N-O 3.45Å; Q305-F314 PolarHBondContact O-N 2.87Å; Q305-K317 VanDerWaalsContact OE1-CG 3.25Å; Q305-L320 HydrophobicContact CB-CD2 3.67Å
306	M	69	Low	58.1	Low	117 Å²	117	92.5 Å²	92.5	58%	0.576	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	135.2	-176.9	-165.5	-174.1	-64.2	0	0	109.9	S308 G311 N312 L313	M306-S308 PolarHBondContact O-N 2.91Å; M306-G311 WeakPolarHBondContact CG-O 3.28Å; M306-N312 CarbonylContact C-O 3.54Å; M306-N312 WeakPolarHBondContact CA-O 3.36Å; M306-L313 HydrophobicContact CB-CD2 3.88Å; M306-L313 HydrophobicContact CE-CD2 4.05Å; M306-L313 HydrophobicContact CG-CD2 4.13Å
307	C	80.3	Confident	59.8	Low	1 Å²	1	91.1 Å²	91.1	1%	0.007	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-71.5	116.3	167.7	179.7	0	0	0	0	109.6	K309 C310 G311 N312 F314 L320 D324 H327	C307-K309 PolarHBondContact O-N 3.17Å; C307-K309 VanDerWaalsContact O-N 3.16Å; C307-C310 PolarHBondContact O-N 3.28Å; C307-C310 VanDerWaalsContact SG-SG 3.64Å; C307-G311 PolarHBondContact O-N 3.16Å; C307-N312 PolarHBondContact N-O 2.87Å; C307-F314 HydrophobicContact CB-CD2 4.49Å; C307-F314 HydrophobicContact CB-CE2 4.03Å; C307-L320 HydrophobicContact CB-CD1 3.6Å; C307-D324 PolarHBondContact SG-OD1 3.02Å; C307-H327 VanDerWaalsContact SG-CD2 3.54Å
308	S	69.4	Low	61.8	Low	121 Å²	121	90.2 Å²	90.2	85%	0.846	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-20.8	-177.3	50.8	0	0	0	0	114.1	M306	M306-S308 PolarHBondContact O-N 2.91Å
309	K	63	Low	63.5	Low	141 Å²	141	86.5 Å²	86.5	61%	0.613	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-14.8	178.9	-70	-174.7	173.9	-171.6	0	115	C307 H327	C307-K309 PolarHBondContact O-N 3.17Å; C307-K309 VanDerWaalsContact O-N 3.16Å; K309-H327 HydrophobicContact CD-CB 3.49Å; K309-H327 VanDerWaalsContact CD-CB 3.49Å; K309-H327 PolarHBondContact NZ-O 2.84Å
310	C	70.9	Confident	65.6	Low	55 Å²	55	82.4 Å²	82.4	37%	0.372	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.1	4.8	-173.8	69.8	0	0	0	0	116.4	C307 N312 H323 H327	C307-C310 PolarHBondContact O-N 3.28Å; C307-C310 VanDerWaalsContact SG-SG 3.64Å; C310-N312 PolarHBondContact O-N 2.93Å; C310-N312 PolarHBondContact SG-ND2 3.16Å; C310-H323 PolarHBondContact SG-NE2 3.43Å; C310-H327 PolarHBondContact SG-NE2 2.84Å; C310-H327 VanDerWaalsContact SG-NE2 3.39Å
311	G	68.8	Low	67.2	Low	40 Å²	40	81.4 Å²	81.4	41%	0.412	44%	0.444	S	S	.	.			trans	74.5	-2.1	176.2	0	0	0	0	0	116.3	M306 C307 L313	M306-G311 WeakPolarHBondContact CG-O 3.28Å; C307-G311 PolarHBondContact O-N 3.16Å; G311-L313 PolarHBondContact O-N 2.64Å
312	N	63.8	Low	68.9	Low	80 Å²	80	77.3 Å²	77.3	43%	0.428	43%	0.425	S	S	.	.			trans	-65.3	131.5	-178.7	-80.3	-43.1	0	0	0	112.2	M306 C307 C310 F314 H323	M306-N312 CarbonylContact C-O 3.54Å; M306-N312 WeakPolarHBondContact CA-O 3.36Å; C307-N312 PolarHBondContact N-O 2.87Å; C310-N312 PolarHBondContact O-N 2.93Å; C310-N312 PolarHBondContact SG-ND2 3.16Å; N312-F314 HydrophobicContact CB-CD2 4.38Å; N312-F314 HydrophobicContact CB-CE2 3.42Å; N312-F314 VanDerWaalsContact CB-CE2 3.42Å; N312-F314 HydrophobicContact CB-CZ 3.73Å; N312-F314 VanDerWaalsContact O-CD2 3.31Å; N312-F314 WeakPolarHBondContact O-CD2 3.07Å; N312-F314 WeakPolarHBondContact O-CE2 3.46Å; N312-H323 PolarHBondContact ND2-NE2 3.37Å
313	L	70.7	Confident	70.7	Confident	72 Å²	72	74.6 Å²	74.6	38%	0.377	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	105.1	-174.3	-75	162.5	0	0	0	112.7	M306 G311 H315	M306-L313 HydrophobicContact CB-CD2 3.88Å; M306-L313 HydrophobicContact CE-CD2 4.05Å; M306-L313 HydrophobicContact CG-CD2 4.13Å; G311-L313 PolarHBondContact O-N 2.64Å; L313-H315 PolarHBondContact O-ND1 3.3Å
314	F	76.6	Confident	71	Confident	41 Å²	41	72.3 Å²	72.3	18%	0.18	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	147.7	-179.4	-63.7	-83	0	0	0	112.2	Q305 C307 N312 L320 H323	Q305-F314 PolarHBondContact N-O 3.45Å; Q305-F314 PolarHBondContact O-N 2.87Å; C307-F314 HydrophobicContact CB-CD2 4.49Å; C307-F314 HydrophobicContact CB-CE2 4.03Å; N312-F314 HydrophobicContact CB-CD2 4.38Å; N312-F314 HydrophobicContact CB-CE2 3.42Å; N312-F314 VanDerWaalsContact CB-CE2 3.42Å; N312-F314 HydrophobicContact CB-CZ 3.73Å; N312-F314 VanDerWaalsContact O-CD2 3.31Å; N312-F314 WeakPolarHBondContact O-CD2 3.07Å; N312-F314 WeakPolarHBondContact O-CE2 3.46Å; F314-L320 HydrophobicContact CB-CB 3.96Å; F314-L320 HydrophobicContact CD2-CB 4.15Å; F314-L320 HydrophobicContact CD2-CD1 3.76Å; F314-L320 HydrophobicContact CE2-CD1 4.21Å; F314-L320 HydrophobicContact CG-CB 4.15Å; F314-H323 HydrophobicContact CE1-CB 3.84Å; F314-H323 HydrophobicContact CE2-CB 3.84Å; F314-H323 AromaticContact CE2-CD2 3.36Å; F314-H323 WeakPolarHBondContact CE2-CD2 3.45Å; F314-H323 AromaticContact CE2-CG 3.67Å; F314-H323 HydrophobicContact CZ-CB 3.41Å; F314-H323 VanDerWaalsContact CZ-CB 3.41Å; F314-H323 AromaticContact CZ-CD2 3.37Å; F314-H323 WeakPolarHBondContact CZ-CD2 3.38Å; F314-H323 AromaticContact CZ-CG 3.22Å; F314-H323 AromaticContact CZ-ND1 3.76Å; F314-H323 AromaticContact CZ-NE2 3.94Å
315	H	60.8	Low	72	Confident	109 Å²	109	77.6 Å²	77.6	51%	0.505	41%	0.41	S	S	.	.	S	Bend	trans	-94.5	2.3	-174.3	-58.3	27.9	0	0	0	111.9	R252 Y304 L313	R252-H315 PolarHBondContact NH2-NE2 3.41Å; Y304-H315 AromaticContact CD1-CE1 3.98Å; Y304-H315 AromaticContact CD1-ND1 3.7Å; Y304-H315 AromaticContact CE1-CD2 3.85Å; Y304-H315 AromaticContact CE1-CE1 3.6Å; Y304-H315 AromaticContact CE1-CG 3.81Å; Y304-H315 AromaticContact CE1-ND1 3.65Å; Y304-H315 AromaticContact CE1-NE2 3.74Å; L313-H315 PolarHBondContact O-ND1 3.3Å
316	S	67.6	Low	72	Confident	46 Å²	46	79.4 Å²	79.4	32%	0.322	43%	0.426	S	S	.	.	S	Bend	trans	-156.7	150.7	175.5	69.5	0	0	0	0	110.5	E318 S319 L320	S316-E318 PolarHBondContact O-N 3.42Å; S316-S319 PolarHBondContact O-N 2.88Å; S316-S319 WeakPolarHBondContact OG-CB 2.98Å; S316-S319 PolarHBondContact OG-N 3.13Å; S316-S319 PolarHBondContact OG-OG 3.33Å; S316-S319 VanDerWaalsContact OG-OG 3.09Å; S316-L320 PolarHBondContact O-N 2.68Å; S316-L320 VanDerWaalsContact O-N 3.14Å
317	K	71.3	Confident	72.1	Confident	94 Å²	94	76.2 Å²	76.2	41%	0.409	41%	0.41	S	S	.	.	H	α-helix	trans	-62.6	-27.6	172.8	-154.9	164.9	-168.5	-177.4	0	111.4	Q305 R321 D387	Q305-K317 VanDerWaalsContact OE1-CG 3.25Å; K317-R321 WeakPolarHBondContact O-CB 3.33Å; K317-R321 VanDerWaalsContact O-CG 3.26Å; K317-R321 WeakPolarHBondContact O-CG 3.41Å; K317-R321 PolarHBondContact O-N 3.3Å; K317-D387 IonicContact NZ-OD2 3.84Å; K317-D387 PolarHBondContact NZ-OD2 3.13Å
318	E	73.4	Confident	71.2	Confident	124 Å²	124	79.7 Å²	79.7	58%	0.579	43%	0.434	S	S	*	.	H	α-helix	trans	-60.9	-53.9	173.4	-160.3	75	-100	0	0	112.4	S316 L320 R321 A322	S316-E318 PolarHBondContact O-N 3.42Å; E318-L320 VanDerWaalsContact C-N 3.33Å; E318-L320 PolarHBondContact O-N 3.23Å; E318-R321 PolarHBondContact O-N 3.3Å; E318-R321 IonicContact OE1-CZ 2.62Å; E318-R321 IonicContact OE1-NE 3.36Å; E318-R321 IonicContact OE1-NH2 3.63Å; E318-R321 PolarHBondContact OE1-NH2 2.97Å; E318-R321 IonicContact OE2-NH2 3.77Å; E318-R321 PolarHBondContact OE2-NH2 2.94Å; E318-R321 VanDerWaalsContact OE2-NH2 3.1Å; E318-A322 PolarHBondContact O-N 3.3Å
319	S	74.1	Confident	70.1	Confident	58 Å²	58	79.2 Å²	79.2	41%	0.406	43%	0.428	S	S	.	.	H	α-helix	trans	-71.2	-29.8	-178.9	-59.2	0	0	0	0	112.3	S316 H323	S316-S319 PolarHBondContact O-N 2.88Å; S316-S319 WeakPolarHBondContact OG-CB 2.98Å; S316-S319 PolarHBondContact OG-N 3.13Å; S316-S319 PolarHBondContact OG-OG 3.33Å; S316-S319 VanDerWaalsContact OG-OG 3.09Å; S319-H323 WeakPolarHBondContact O-CB 3.25Å; S319-H323 PolarHBondContact O-N 3Å
320	L	80.4	Confident	69.2	Low	21 Å²	21	80.3 Å²	80.3	11%	0.11	44%	0.441	C	S	.	.	H	α-helix	trans	-63.1	-54.2	169	176.8	52	0	0	0	110.7	Q305 C307 F314 S316 E318 A322 H323 D324	Q305-L320 HydrophobicContact CB-CD2 3.67Å; C307-L320 HydrophobicContact CB-CD1 3.6Å; F314-L320 HydrophobicContact CB-CB 3.96Å; F314-L320 HydrophobicContact CD2-CB 4.15Å; F314-L320 HydrophobicContact CD2-CD1 3.76Å; F314-L320 HydrophobicContact CE2-CD1 4.21Å; F314-L320 HydrophobicContact CG-CB 4.15Å; S316-L320 PolarHBondContact O-N 2.68Å; S316-L320 VanDerWaalsContact O-N 3.14Å; E318-L320 VanDerWaalsContact C-N 3.33Å; E318-L320 PolarHBondContact O-N 3.23Å; L320-A322 PolarHBondContact O-N 3.48Å; L320-A322 VanDerWaalsContact O-N 3.16Å; L320-H323 CarbonylContact O-C 3.6Å; L320-H323 WeakPolarHBondContact O-CA 3.32Å; L320-H323 WeakPolarHBondContact O-CB 3.36Å; L320-H323 PolarHBondContact O-N 3.24Å; L320-D324 WeakPolarHBondContact CD1-OD1 3.28Å; L320-D324 WeakPolarHBondContact CD1-OD2 3.47Å; L320-D324 WeakPolarHBondContact CG-OD2 3.32Å; L320-D324 VanDerWaalsContact O-CG 3.28Å; L320-D324 PolarHBondContact O-N 2.56Å
321	R	73.8	Confident	67.3	Low	120 Å²	120	83.1 Å²	83.1	45%	0.453	46%	0.46	S	S	.	.	H	α-helix	trans	-56	-34.3	175.6	-72.6	-176.7	-53.1	-128	7.8	113.4	K317 E318 K325	K317-R321 WeakPolarHBondContact O-CB 3.33Å; K317-R321 VanDerWaalsContact O-CG 3.26Å; K317-R321 WeakPolarHBondContact O-CG 3.41Å; K317-R321 PolarHBondContact O-N 3.3Å; E318-R321 PolarHBondContact O-N 3.3Å; E318-R321 IonicContact OE1-CZ 2.62Å; E318-R321 IonicContact OE1-NE 3.36Å; E318-R321 IonicContact OE1-NH2 3.63Å; E318-R321 PolarHBondContact OE1-NH2 2.97Å; E318-R321 IonicContact OE2-NH2 3.77Å; E318-R321 PolarHBondContact OE2-NH2 2.94Å; E318-R321 VanDerWaalsContact OE2-NH2 3.1Å; R321-K325 WeakPolarHBondContact O-CG 3.48Å; R321-K325 PolarHBondContact O-N 2.82Å
322	A	80.3	Confident	65.5	Low	61 Å²	61	84.6 Å²	84.6	50%	0.504	48%	0.475	S	S	.	.	H	α-helix	trans	-69.6	-34.4	175	0	0	0	0	0	112.4	E318 L320	E318-A322 PolarHBondContact O-N 3.3Å; L320-A322 PolarHBondContact O-N 3.48Å; L320-A322 VanDerWaalsContact O-N 3.16Å
323	H	81.1	Confident	64.3	Low	38 Å²	38	92.4 Å²	92.4	18%	0.176	50%	0.498	C	S	.	.	H	α-helix	trans	-76.3	-37.2	173.9	-176.2	66.4	0	0	0	113	C310 N312 F314 S319 L320 K325 V326 H327	C310-H323 PolarHBondContact SG-NE2 3.43Å; N312-H323 PolarHBondContact ND2-NE2 3.37Å; F314-H323 HydrophobicContact CE1-CB 3.84Å; F314-H323 HydrophobicContact CE2-CB 3.84Å; F314-H323 AromaticContact CE2-CD2 3.36Å; F314-H323 WeakPolarHBondContact CE2-CD2 3.45Å; F314-H323 AromaticContact CE2-CG 3.67Å; F314-H323 HydrophobicContact CZ-CB 3.41Å; F314-H323 VanDerWaalsContact CZ-CB 3.41Å; F314-H323 AromaticContact CZ-CD2 3.37Å; F314-H323 WeakPolarHBondContact CZ-CD2 3.38Å; F314-H323 AromaticContact CZ-CG 3.22Å; F314-H323 AromaticContact CZ-ND1 3.76Å; F314-H323 AromaticContact CZ-NE2 3.94Å; S319-H323 WeakPolarHBondContact O-CB 3.25Å; S319-H323 PolarHBondContact O-N 3Å; L320-H323 CarbonylContact O-C 3.6Å; L320-H323 WeakPolarHBondContact O-CA 3.32Å; L320-H323 WeakPolarHBondContact O-CB 3.36Å; L320-H323 PolarHBondContact O-N 3.24Å; H323-K325 PolarHBondContact O-N 2.76Å; H323-V326 WeakPolarHBondContact O-CA 3.33Å; H323-V326 WeakPolarHBondContact O-CB 3.46Å; H323-V326 WeakPolarHBondContact O-CG2 3.34Å; H323-V326 PolarHBondContact O-N 3.4Å; H323-H327 AromaticContact CD2-CD2 3.96Å; H323-H327 AromaticContact CD2-NE2 3.49Å; H323-H327 PolarHBondContact CD2-NE2 2.25Å; H323-H327 AromaticContact CE1-NE2 3.73Å; H323-H327 AromaticContact NE2-CD2 3.96Å; H323-H327 AromaticContact NE2-CE1 3.93Å; H323-H327 AromaticContact NE2-NE2 3.05Å; H323-H327 PolarHBondContact NE2-NE2 3.49Å
324	D	72.4	Confident	62.5	Low	54 Å²	54	99.1 Å²	99.1	29%	0.289	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-28.3	178.9	-63.4	-34.5	0	0	0	112.2	C307 L320 V326 H327 S328	C307-D324 PolarHBondContact SG-OD1 3.02Å; L320-D324 WeakPolarHBondContact CD1-OD1 3.28Å; L320-D324 WeakPolarHBondContact CD1-OD2 3.47Å; L320-D324 WeakPolarHBondContact CG-OD2 3.32Å; L320-D324 VanDerWaalsContact O-CG 3.28Å; L320-D324 PolarHBondContact O-N 2.56Å; D324-V326 PolarHBondContact O-N 3.5Å; D324-H327 CarbonylContact O-C 3.56Å; D324-H327 WeakPolarHBondContact O-CA 3.23Å; D324-H327 WeakPolarHBondContact O-CB 3.49Å; D324-H327 PolarHBondContact O-N 2.96Å; D324-S328 PolarHBondContact O-N 2.68Å; D324-S328 PolarHBondContact O-OG 3.16Å
325	K	75.6	Confident	60.1	Low	161 Å²	161	102.6 Å²	102.6	70%	0.7	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-63.6	-21.3	169.5	-70.8	174.6	-176.5	-175.1	0	113.8	R321 H323 H327	R321-K325 WeakPolarHBondContact O-CG 3.48Å; R321-K325 PolarHBondContact O-N 2.82Å; H323-K325 PolarHBondContact O-N 2.76Å; K325-H327 VanDerWaalsContact C-N 3.31Å
326	V	69	Low	59.3	Low	113 Å²	113	102.8 Å²	102.8	69%	0.685	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-75.6	-24.5	171.6	-169.4	0	0	0	0	110.9	H323 D324 S328	H323-V326 WeakPolarHBondContact O-CA 3.33Å; H323-V326 WeakPolarHBondContact O-CB 3.46Å; H323-V326 WeakPolarHBondContact O-CG2 3.34Å; H323-V326 PolarHBondContact O-N 3.4Å; D324-V326 PolarHBondContact O-N 3.5Å; V326-S328 VanDerWaalsContact C-N 3.33Å
327	H	70.5	Confident	57.4	Low	50 Å²	50	107.8 Å²	107.8	23%	0.231	59%	0.593	C	S	.	*	G	3₁₀ helix	trans	-92.8	14.8	174.7	-57.7	-66.2	0	0	0	114	C307 K309 C310 H323 D324 K325	C307-H327 VanDerWaalsContact SG-CD2 3.54Å; K309-H327 HydrophobicContact CD-CB 3.49Å; K309-H327 VanDerWaalsContact CD-CB 3.49Å; K309-H327 PolarHBondContact NZ-O 2.84Å; C310-H327 PolarHBondContact SG-NE2 2.84Å; C310-H327 VanDerWaalsContact SG-NE2 3.39Å; H323-H327 AromaticContact CD2-CD2 3.96Å; H323-H327 AromaticContact CD2-NE2 3.49Å; H323-H327 PolarHBondContact CD2-NE2 2.25Å; H323-H327 AromaticContact CE1-NE2 3.73Å; H323-H327 AromaticContact NE2-CD2 3.96Å; H323-H327 AromaticContact NE2-CE1 3.93Å; H323-H327 AromaticContact NE2-NE2 3.05Å; H323-H327 PolarHBondContact NE2-NE2 3.49Å; D324-H327 CarbonylContact O-C 3.56Å; D324-H327 WeakPolarHBondContact O-CA 3.23Å; D324-H327 WeakPolarHBondContact O-CB 3.49Å; D324-H327 PolarHBondContact O-N 2.96Å; K325-H327 VanDerWaalsContact C-N 3.31Å
328	S	61.6	Low	55.5	Low	75 Å²	75	111.4 Å²	111.4	52%	0.524	61%	0.611	S	S	.	*			trans	-113.3	95.4	178.6	-72.3	0	0	0	0	110.2	D324 V326	D324-S328 PolarHBondContact O-N 2.68Å; D324-S328 PolarHBondContact O-OG 3.16Å; V326-S328 VanDerWaalsContact C-N 3.33Å
329	P	47.3	Very low	53.1	Low	111 Å²	111	110 Å²	110	72%	0.721	61%	0.614	S	S	*	*			trans	-62.2	139.3	171.8	26.8	-33.7	0	0	0	110.5	C331	P329-C331 PolarHBondContact O-N 3Å
330	N	42.6	Very low	50.8	Low	163 Å²	163	117.5 Å²	117.5	87%	0.872	63%	0.633	S	S	*	*			trans	-78.1	79.5	-166.2	-172.5	24.9	0	0	0	113.1
331	C	31.5	Very low	48.4	Very low	115 Å²	115	121.5 Å²	121.5	78%	0.777	66%	0.663	S	S	*	*			trans	-85.3	110.8	176.1	-71.1	0	0	0	0	112.6	P329	P329-C331 PolarHBondContact O-N 3Å
332	G	32	Very low	46.3	Very low	70 Å²	70	122.5 Å²	122.5	72%	0.722	68%	0.682	S	S	*	*			trans	76.9	107.1	150.4	0	0	0	0	0	117.7	K334	G332-K334 PolarHBondContact O-N 3.37Å
333	R	37.8	Very low	44	Very low	245 Å²	245	126.5 Å²	126.5	93%	0.925	70%	0.695	S	S	*	*			trans	-62.4	130.9	159.8	-66.3	173.8	171.2	-130.4	3.4	110.5
334	K	32.6	Very low	41.6	Very low	213 Å²	213	132.8 Å²	132.8	93%	0.926	73%	0.73	S	S	*	*			trans	-174.1	151.1	137.7	-101.8	154.8	-172.6	-177.2	0	111.9	G332	G332-K334 PolarHBondContact O-N 3.37Å
335	S	26.8	Very low	39.7	Very low	113 Å²	113	139.1 Å²	139.1	79%	0.79	76%	0.758	S	S	*	*			trans	-175.2	155.8	-177.9	177.8	0	0	0	0	107.6
336	P	42.9	Very low	37.7	Very low	113 Å²	113	137.2 Å²	137.2	73%	0.734	76%	0.755	S	S	*	*			cis	-123.1	160.6	-28.4	34.3	-20.4	0	0	0	112.3
337	V	28.6	Very low	36	Very low	152 Å²	152	135.9 Å²	135.9	92%	0.921	75%	0.751	S	S	*	*			trans	-136.6	144.4	156.1	-177.7	0	0	0	0	108.7
338	H	30.2	Very low	34.5	Very low	170 Å²	170	138.3 Å²	138.3	79%	0.787	77%	0.771	S	S	*	*			trans	-107.1	141.8	-177	180	89.6	0	0	0	110.3
339	C	23.1	Very low	33.7	Very low	94 Å²	94	137.4 Å²	137.4	64%	0.635	77%	0.769	S	S	*	*			trans	147.2	118.8	134.6	-155.2	0	0	0	0	113.5
340	R	26.3	Very low	33.5	Very low	216 Å²	216	135.6 Å²	135.6	82%	0.815	76%	0.763	S	S	*	*			trans	45.8	111.7	143.1	-70	-178.4	176	-173.4	-3.5	122.4
341	S	30.1	Very low	33.4	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	75%	0.749	S	S	*	*				37.7	117.8	122.8	63.8	0	0	0	0	121.1
342	T	30.8	Very low	34.1	Very low	141 Å²	141	137.5 Å²	137.5	87%	0.865	75%	0.745	S	S	*	*				-152	160.1	116.4	11.9	0	0	0	0	109.6
343	D	30.8	Very low	34.8	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	75%	0.745	S	S	*	*			trans	-79.9	153.4	-179.9	-47.5	-95.9	0	0	0	112.2
344	D	30	Very low	35	Very low	170 Å²	170	137.1 Å²	137.1	91%	0.909	73%	0.731	S	S	*	*			trans	174.5	164.2	130.4	-95.9	-39	0	0	0	112.5
345	E	33.8	Very low	35.7	Very low	186 Å²	186	133.8 Å²	133.8	87%	0.869	72%	0.722	S	S	*	*			trans	-94.7	163	-157.7	-78.6	-99.5	82.7	0	0	117.9
346	D	33.2	Very low	36.4	Very low	121 Å²	121	135.4 Å²	135.4	65%	0.647	72%	0.717	S	S	*	*			trans	8	128.7	164.6	-137.7	-1.2	0	0	0	120.5	K351	D346-K351 IonicContact OD1-NZ 3.74Å; D346-K351 IonicContact OD2-NZ 2.99Å; D346-K351 PolarHBondContact OD2-NZ 3.23Å
347	S	33.8	Very low	36.5	Very low	85 Å²	85	139.7 Å²	139.7	59%	0.594	72%	0.72	S	S	*	*			trans	-130.7	127.4	167.3	-171.8	0	0	0	0	111.4	A349	S347-A349 PolarHBondContact O-N 3.2Å
348	P	39.3	Very low	37.3	Very low	101 Å²	101	140.1 Å²	140.1	66%	0.656	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	9.2	-161.9	29.6	-37	0	0	0	115.9
349	A	44.2	Very low	37.8	Very low	57 Å²	57	139.4 Å²	139.4	47%	0.471	71%	0.712	S	S	.	*	H	α-helix	trans	-71.7	-30.8	177.6	0	0	0	0	0	113.4	S347	S347-A349 PolarHBondContact O-N 3.2Å
350	A	42.7	Very low	38.4	Very low	73 Å²	73	143 Å²	143	60%	0.603	72%	0.724	S	S	*	*	H	α-helix	trans	-69.2	-37.7	-173.9	0	0	0	0	0	113.7	R352 R353	A350-R352 VanDerWaalsContact C-N 3.32Å; A350-R352 PolarHBondContact O-N 3.47Å; A350-R353 PolarHBondContact O-N 3.12Å
351	K	40.8	Very low	38.7	Very low	134 Å²	134	141.5 Å²	141.5	58%	0.583	73%	0.726	S	S	*	*	H	α-helix	trans	-67.2	-28.4	-175.1	-71	165.6	-177.5	148.9	0	112.8	D346 L354	D346-K351 IonicContact OD1-NZ 3.74Å; D346-K351 IonicContact OD2-NZ 2.99Å; D346-K351 PolarHBondContact OD2-NZ 3.23Å; K351-L354 WeakPolarHBondContact O-CB 3.27Å; K351-L354 PolarHBondContact O-N 3.28Å
352	R	46.2	Very low	38.5	Very low	184 Å²	184	142.8 Å²	142.8	69%	0.694	73%	0.733	S	S	*	*	H	α-helix	trans	-66.3	-39.6	175.4	-79.5	-176.5	-79	142.6	-8.6	113.1	A350 L354 L355 E356	A350-R352 VanDerWaalsContact C-N 3.32Å; A350-R352 PolarHBondContact O-N 3.47Å; R352-L354 PolarHBondContact O-N 3.39Å; R352-L355 PolarHBondContact O-N 3.5Å; R352-E356 PolarHBondContact O-N 3.47Å
353	R	46.7	Very low	38.4	Very low	188 Å²	188	140.9 Å²	140.9	71%	0.709	72%	0.721	S	S	*	*	H	α-helix	trans	-68.2	-13.1	176.1	-75.9	-177.1	172.7	164	-0.7	114.2	A350	A350-R353 PolarHBondContact O-N 3.12Å
354	L	42.6	Very low	38.5	Very low	119 Å²	119	143.3 Å²	143.3	62%	0.623	73%	0.728	S	S	*	*	H	α-helix	trans	-80.3	-38.4	178	-162	74.9	0	0	0	112.1	K351 R352 Y357 F358	K351-L354 WeakPolarHBondContact O-CB 3.27Å; K351-L354 PolarHBondContact O-N 3.28Å; R352-L354 PolarHBondContact O-N 3.39Å; L354-Y357 PolarHBondContact O-N 2.86Å; L354-F358 WeakPolarHBondContact O-CD2 3.25Å
355	L	47	Very low	38.5	Very low	143 Å²	143	138.7 Å²	138.7	75%	0.749	72%	0.72	S	S	*	*	H	α-helix	trans	-72.5	-35.7	176.5	-74.2	163.5	0	0	0	111.7	R352 Y357 F358	R352-L355 PolarHBondContact O-N 3.5Å; L355-Y357 PolarHBondContact O-N 3.49Å; L355-F358 PolarHBondContact O-N 2.9Å
356	E	40.7	Very low	38.3	Very low	147 Å²	147	140 Å²	140	69%	0.687	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-17.2	174	-162.4	167.5	-142.5	0	0	113.1	R352	R352-E356 PolarHBondContact O-N 3.47Å
357	Y	44.8	Very low	38	Very low	203 Å²	203	140.6 Å²	140.6	80%	0.796	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-4.8	179.7	-119.7	-83.7	0	0	0	114.9	L354 L355	L354-Y357 PolarHBondContact O-N 2.86Å; L355-Y357 PolarHBondContact O-N 3.49Å
358	F	45.8	Very low	38.4	Very low	161 Å²	161	142.7 Å²	142.7	71%	0.706	74%	0.743	S	S	*	*	S	Bend	trans	-111.3	-1.2	-173	-84	-72.1	0	0	0	115.9	L354 L355 L360	L354-F358 WeakPolarHBondContact O-CD2 3.25Å; L355-F358 PolarHBondContact O-N 2.9Å; F358-L360 VanDerWaalsContact C-N 3.34Å; F358-L360 PolarHBondContact O-N 3.45Å; F358-L360 VanDerWaalsContact O-N 3.14Å
359	N	41.9	Very low	37.8	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	74%	0.743	S	S	*	*			trans	45.2	46.6	168.1	-78.6	-12.3	0	0	0	116.3
360	L	35.7	Very low	37.1	Very low	170 Å²	170	146.8 Å²	146.8	89%	0.89	76%	0.761	S	S	*	*			trans	-116.1	112.4	164.7	-74.9	172.6	0	0	0	109.2	F358	F358-L360 VanDerWaalsContact C-N 3.34Å; F358-L360 PolarHBondContact O-N 3.45Å; F358-L360 VanDerWaalsContact O-N 3.14Å
361	Q	31.4	Very low	36.5	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	77%	0.773	S	S	*	*			trans	-92	127.6	-176	-169.8	172.4	11.8	0	0	110.1
362	C	25.6	Very low	36	Very low	130 Å²	130	154.9 Å²	154.9	88%	0.878	79%	0.788	S	S	*	*			trans	-116.4	149.7	165.6	-157.9	0	0	0	0	108.7
363	V	29.4	Very low	35.1	Very low	101 Å²	101	152.1 Å²	152.1	61%	0.612	79%	0.787	S	S	*	*			trans	-118.8	135.7	-155.5	173.3	0	0	0	0	112.2
364	E	32.6	Very low	34.3	Very low	197 Å²	197	153 Å²	153	92%	0.921	79%	0.791	S	S	*	*			trans	64.1	154.3	169.8	-71.4	177	125.3	0	0	118.5
365	G	29.6	Very low	33.7	Very low	73 Å²	73	153.9 Å²	153.9	75%	0.753	79%	0.792	S	S	*	*			trans	178.2	-20.9	-177.2	0	0	0	0	0	120.1
366	K	31.3	Very low	33	Very low	214 Å²	214	154.1 Å²	154.1	93%	0.93	79%	0.787	S	S	*	*			trans	65.7	162.1	179.6	-66.3	176.6	175.9	173.5	0	117.5
367	T	26.8	Very low	32.5	Very low	133 Å²	133	158.1 Å²	158.1	82%	0.816	80%	0.795	S	S	*	*			trans	-119.3	-173.4	175.9	58.3	0	0	0	0	108.6
368	P	40.8	Very low	31.9	Very low	129 Å²	129	153.8 Å²	153.8	84%	0.838	79%	0.79	S	S	*	*			cis	-129.2	-169.2	-9.6	41.5	-24.8	0	0	0	113.3
369	G	27.2	Very low	31.1	Very low	64 Å²	64	153.7 Å²	153.7	66%	0.66	80%	0.796	S	S	*	*			trans	156.6	136.1	159.4	0	0	0	0	0	116.8
370	E	29.1	Very low	30.4	Very low	181 Å²	181	149.9 Å²	149.9	85%	0.846	79%	0.794	S	S	*	*			trans	-18.7	139.4	163.1	-69.3	100.6	-110.5	0	0	118.3
371	E	30.5	Very low	30.2	Very low	184 Å²	184	149 Å²	149	86%	0.86	79%	0.785	S	S	*	*				97	159.3	55.2	-165	164.5	-116	0	0	113.2
372	E	29.7	Very low	29.9	Very low	192 Å²	192	150.6 Å²	150.6	90%	0.897	78%	0.783	S	S	*	*			trans	71.2	175.8	-176.7	-76.1	-152.3	125.2	0	0	119.4
373	D	29	Very low	30.1	Very low	126 Å²	126	151.9 Å²	151.9	67%	0.674	78%	0.78	S	S	*	*			trans	-137.1	159.5	-132.7	-172.7	27.8	0	0	0	113.7
374	R	28.5	Very low	30.6	Very low	206 Å²	206	152.9 Å²	152.9	78%	0.777	79%	0.788	S	S	*	*			trans	53.1	122.9	163.9	-75.9	162.2	-174.5	-143.9	-3.2	119.6
375	E	30	Very low	30.6	Very low	139 Å²	139	151.4 Å²	151.4	65%	0.65	78%	0.781	S	S	*	*				179.7	132.8	89.9	-87	-148.4	155.6	0	0	115.4
376	K	33	Very low	30.5	Very low	148 Å²	148	154.8 Å²	154.8	64%	0.643	78%	0.781	S	S	*	*			trans	49.9	122.9	138.5	-59.5	174.1	-167	148.2	0	122.4
377	R	30.9	Very low	30.6	Very low	230 Å²	230	149.2 Å²	149.2	87%	0.868	76%	0.762	S	S	*	*			trans	73.7	146	143.7	-65	179.7	171.4	-178.8	-3.6	117.2
378	T	30.4	Very low	31.3	Very low	112 Å²	112	147.3 Å²	147.3	69%	0.687	75%	0.752	S	S	*	*			cis	-158.4	139.2	-1.1	7.3	0	0	0	0	112.9
379	L	30	Very low	31.1	Very low	160 Å²	160	147.4 Å²	147.4	84%	0.838	75%	0.75	S	S	*	*			trans	48.8	135.5	142.3	-64.2	167.2	0	0	0	123.3
380	G	27.8	Very low	31.6	Very low	75 Å²	75	148.8 Å²	148.8	77%	0.773	75%	0.748	S	S	*	*			trans	136.8	132.5	148.4	0	0	0	0	0	117.7
381	Q	30.5	Very low	32	Very low	151 Å²	151	144.5 Å²	144.5	71%	0.706	74%	0.738	S	S	*	*				-157.4	130.3	-78.4	176.1	168.1	-40.9	0	0	113.1
382	R	26.3	Very low	32.4	Very low	218 Å²	218	143 Å²	143	82%	0.823	73%	0.726	S	S	*	*			trans	62.6	113.2	156.1	-75.4	-180	-170.2	-176.9	3	124.3
383	I	29.4	Very low	33.1	Very low	157 Å²	157	140 Å²	140	81%	0.805	71%	0.712	S	S	*	*			trans	-42	178.8	130.5	22.6	166.6	0	0	0	116.1
384	P	39	Very low	34	Very low	122 Å²	122	137 Å²	137	79%	0.792	71%	0.705	S	S	*	*			cis	-137.9	-145.7	-12.7	35.8	-11.6	0	0	0	114.5
385	E	31.9	Very low	35	Very low	166 Å²	166	134.3 Å²	134.3	78%	0.776	69%	0.694	S	S	*	*			trans	-86.9	159.9	-165.4	-53.3	-166.2	131.7	0	0	120.1
386	L	29	Very low	35.9	Very low	143 Å²	143	132.2 Å²	132.2	75%	0.749	68%	0.684	S	S	*	*			trans	63.6	119.1	135.4	-75.5	171.3	0	0	0	125.5
387	D	32.7	Very low	37	Very low	98 Å²	98	132.5 Å²	132.5	52%	0.524	69%	0.692	S	S	.	*				80.2	164.2	128.1	-149.1	40.8	0	0	0	118.6	K317	K317-D387 IonicContact NZ-OD2 3.84Å; K317-D387 PolarHBondContact NZ-OD2 3.13Å
388	P	42.4	Very low	37.7	Very low	93 Å²	93	125 Å²	125	60%	0.604	68%	0.68	S	S	*	*			cis	-123.4	154.4	-28.8	17.4	5.5	0	0	0	116
389	V	35.8	Very low	38.1	Very low	131 Å²	131	123.9 Å²	123.9	79%	0.794	67%	0.673	S	S	*	*			trans	42.2	116.2	139.8	-175.3	0	0	0	0	121.1
390	C	36.9	Very low	38.5	Very low	92 Å²	92	125.8 Å²	125.8	62%	0.622	67%	0.674	S	S	*	*				-168	93.7	126.6	-128.3	0	0	0	0	115.4
391	S	38.4	Very low	38.6	Very low	92 Å²	92	125.5 Å²	125.5	64%	0.643	67%	0.671	S	S	*	*			trans	-105.8	6.6	173.7	55.7	0	0	0	0	114.9	A394 W395	S391-A394 PolarHBondContact O-N 3.39Å; S391-W395 PolarHBondContact O-N 3.47Å
392	Y	38.8	Very low	38.8	Very low	153 Å²	153	129.7 Å²	129.7	60%	0.6	68%	0.681	S	S	*	*	H	α-helix	trans	-68.2	-38.8	172.3	-174.4	-124.6	0	0	0	111.7	W395 Q396	Y392-W395 HydrophobicContact CE2-CE3 4.49Å; Y392-W395 PolarHBondContact O-N 3.23Å; Y392-Q396 VanDerWaalsContact CE1-NE2 3.26Å; Y392-Q396 VanDerWaalsContact CZ-NE2 3.32Å; Y392-Q396 WeakPolarHBondContact O-CG 3.48Å; Y392-Q396 PolarHBondContact O-N 2.91Å; Y392-Q396 PolarHBondContact OH-NE2 2.95Å
393	Q	44.4	Very low	38.9	Very low	129 Å²	129	125.3 Å²	125.3	60%	0.603	68%	0.678	S	S	*	*	H	α-helix	trans	-65.1	-39.7	170.9	-74.6	170.9	-52	0	0	111.9	W395 Q396 L397	Q393-W395 VanDerWaalsContact C-N 3.31Å; Q393-W395 PolarHBondContact O-N 2.73Å; Q393-Q396 PolarHBondContact O-N 3.25Å; Q393-L397 WeakPolarHBondContact O-CG 3.27Å; Q393-L397 PolarHBondContact O-N 2.95Å
394	A	47.9	Very low	39	Very low	63 Å²	63	123.7 Å²	123.7	52%	0.521	68%	0.675	S	S	.	*	H	α-helix	trans	-61.4	-37	175.3	0	0	0	0	0	112.5	S391	S391-A394 PolarHBondContact O-N 3.39Å
395	W	49.5	Very low	38.7	Very low	148 Å²	148	124.9 Å²	124.9	56%	0.561	67%	0.67	S	S	*	*	H	α-helix	trans	-73.3	-38.9	174.5	-174.3	65.5	0	0	0	113.1	S391 Y392 Q393 L397 A398	S391-W395 PolarHBondContact O-N 3.47Å; Y392-W395 HydrophobicContact CE2-CE3 4.49Å; Y392-W395 PolarHBondContact O-N 3.23Å; Q393-W395 VanDerWaalsContact C-N 3.31Å; Q393-W395 PolarHBondContact O-N 2.73Å; W395-L397 PolarHBondContact O-N 2.96Å; W395-L397 VanDerWaalsContact O-N 3.17Å; W395-A398 PolarHBondContact O-N 3.18Å
396	Q	49.1	Very low	39.5	Very low	95 Å²	95	121.5 Å²	121.5	44%	0.444	66%	0.662	S	S	.	*	H	α-helix	trans	-62.6	-20.4	177.9	-77	-177.2	-18.7	0	0	114.1	Y392 Q393	Y392-Q396 VanDerWaalsContact CE1-NE2 3.26Å; Y392-Q396 VanDerWaalsContact CZ-NE2 3.32Å; Y392-Q396 WeakPolarHBondContact O-CG 3.48Å; Y392-Q396 PolarHBondContact O-N 2.91Å; Y392-Q396 PolarHBondContact OH-NE2 2.95Å; Q393-Q396 PolarHBondContact O-N 3.25Å
397	L	55	Low	39.6	Very low	155 Å²	155	120.3 Å²	120.3	81%	0.812	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-14.4	174.3	-68	169.7	0	0	0	113.7	Q393 W395	Q393-L397 WeakPolarHBondContact O-CG 3.27Å; Q393-L397 PolarHBondContact O-N 2.95Å; W395-L397 PolarHBondContact O-N 2.96Å; W395-L397 VanDerWaalsContact O-N 3.17Å
398	A	45.7	Very low	39.7	Very low	73 Å²	73	123.8 Å²	123.8	60%	0.603	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-21.1	-166.8	0	0	0	0	0	115.8	W395	W395-A398 PolarHBondContact O-N 3.18Å
399	T	39.2	Very low	39.7	Very low	88 Å²	88	123.9 Å²	123.9	54%	0.54	68%	0.675	S	S	.	*			trans	-134.2	26.2	-170	66	0	0	0	0	114.9	G401	T399-G401 VanDerWaalsContact C-N 3.31Å; T399-G401 PolarHBondContact O-N 2.87Å; T399-G401 VanDerWaalsContact O-N 3.14Å
400	K	37.8	Very low	39.5	Very low	200 Å²	200	122 Å²	122	87%	0.87	67%	0.667	S	S	*	*			trans	-89.5	59.3	-178.7	-146.3	175.3	-169.1	177	0	113.1
401	G	31.5	Very low	39.3	Very low	69 Å²	69	125.5 Å²	125.5	71%	0.711	67%	0.668	S	S	*	*			trans	-105.2	127.6	164.3	0	0	0	0	0	110.2	T399	T399-G401 VanDerWaalsContact C-N 3.31Å; T399-G401 PolarHBondContact O-N 2.87Å; T399-G401 VanDerWaalsContact O-N 3.14Å
402	R	34.8	Very low	39	Very low	238 Å²	238	130.9 Å²	130.9	90%	0.898	68%	0.68	S	S	*	*			trans	-76.8	165.2	177.3	-59.2	-172.9	-175.9	-166.4	2.9	109.4
403	V	28.7	Very low	38.6	Very low	127 Å²	127	128.6 Å²	128.6	77%	0.77	69%	0.693	S	S	*	*				-161.8	144.1	50.7	170.5	0	0	0	0	112.2
404	V	30.1	Very low	37.9	Very low	122 Å²	122	123.9 Å²	123.9	74%	0.739	67%	0.674	S	S	*	*			trans	83.2	132.1	158	158.7	0	0	0	0	122.3
405	E	32.5	Very low	36.9	Very low	148 Å²	148	130.4 Å²	130.4	69%	0.692	69%	0.687	S	S	*	*			trans	-67	-164.7	168.1	-92.6	-93.6	144.1	0	0	112.5	V407	E405-V407 PolarHBondContact OE2-N 3.13Å
406	P	48.3	Very low	35.9	Very low	94 Å²	94	126 Å²	126	61%	0.61	68%	0.678	S	S	*	*			cis	-134.8	160	6.8	16.4	11	0	0	0	120.4
407	V	32.7	Very low	35	Very low	119 Å²	119	123.7 Å²	123.7	72%	0.721	68%	0.681	S	S	*	*			trans	73.9	130.6	138.8	170.2	0	0	0	0	121.1	E405	E405-V407 PolarHBondContact OE2-N 3.13Å
408	E	34.4	Very low	33.7	Very low	171 Å²	171	117.9 Å²	117.9	80%	0.799	66%	0.658	S	S	*	*			trans	-85.1	-126.7	173.5	-152.2	-164	-120.6	0	0	108.8
409	P	43	Very low	32.9	Very low	95 Å²	95	118.7 Å²	118.7	62%	0.617	66%	0.659	S	S	*	*			cis	-135.6	177.9	-0.9	43.1	-23.7	0	0	0	117.3
410	S	30.8	Very low	32.4	Very low	90 Å²	90	121.9 Å²	121.9	63%	0.629	67%	0.67	S	S	*	*			trans	73.8	155.4	138.3	-82.3	0	0	0	0	121.3
411	Y	32.1	Very low	32.1	Very low	167 Å²	167	119.8 Å²	119.8	66%	0.655	66%	0.663	S	S	*	*			cis	-154.2	-175.9	-16.6	48.8	-131.3	0	0	0	113	D137	D137-Y411 PolarHBondContact OD1-OH 3.05Å; D137-Y411 PolarHBondContact OD2-OH 2.87Å; D137-Y411 VanDerWaalsContact OD2-OH 3.12Å
412	K	32.9	Very low	32.1	Very low	204 Å²	204	123.4 Å²	123.4	89%	0.887	67%	0.666	S	S	*	*			trans	-53.4	162	-179.4	-57.5	164.7	178.8	173	0	115.8
413	A	29.5	Very low	32	Very low	105 Å²	105	119.8 Å²	119.8	87%	0.868	66%	0.659	S	S	*	*			trans	-147.8	166.1	171.7	0	0	0	0	0	112.6
414	S	30.4	Very low	32.3	Very low	30 Å²	30	116.7 Å²	116.7	21%	0.21	65%	0.647	C	S	.	*			trans	-114.4	129.5	-162.8	39.4	0	0	0	0	118.7	E140 E141 S142	E140-S414 VanDerWaalsContact OE1-CB 3.3Å; E140-S414 WeakPolarHBondContact OE1-CB 3.4Å; E140-S414 PolarHBondContact OE1-OG 3.12Å; E141-S414 PolarHBondContact N-OG 2.83Å; S142-S414 PolarHBondContact N-O 3.3Å
415	Y	27.4	Very low	32.7	Very low	201 Å²	201	116.6 Å²	116.6	79%	0.788	64%	0.642	S	S	*	*			trans	64.7	163	136.4	-89.4	-80.1	0	0	0	125.2	E141 S142	E141-Y415 WeakPolarHBondContact OE1-CB 3.36Å; S142-Y415 PolarHBondContact OG-O 3.29Å
416	S	28.5	Very low	32.6	Very low	54 Å²	54	114.1 Å²	114.1	38%	0.378	64%	0.637	S	S	.	*			trans	63.4	83.2	142.8	-61	0	0	0	0	125.3	E141 S142 R143	E141-S416 WeakPolarHBondContact OE1-CB 3.37Å; E141-S416 PolarHBondContact OE1-OG 3.2Å; E141-S416 VanDerWaalsContact OE1-OG 3.06Å; S142-S416 PolarHBondContact OG-O 3.06Å; R143-S416 PolarHBondContact NE-O 3.23Å; R143-S416 PolarHBondContact NH2-O 3.32Å; R143-S416 VanDerWaalsContact NH2-O 3.07Å
417	G	28.7	Very low	31.8	Very low	48 Å²	48	116.2 Å²	116.2	50%	0.495	64%	0.643	S	S	.	*				71.9	-171.6	118.3	0	0	0	0	0	121.5	R143 R144	R143-G417 PolarHBondContact NE-O 2.99Å; R143-G417 VanDerWaalsContact NE-O 3.15Å; R144-G417 VanDerWaalsContact CZ-O 3.23Å; R144-G417 PolarHBondContact NE-O 3.28Å; R144-G417 PolarHBondContact NH2-O 3.32Å
418	G	29.1	Very low	31.8	Very low	32 Å²	32	113.4 Å²	113.4	33%	0.33	63%	0.633	S	S	.	*			trans	78.7	102.3	159.5	0	0	0	0	0	122	R144	R144-G418 WeakPolarHBondContact CD-O 3.49Å; R144-G418 VanDerWaalsContact CZ-C 3.5Å; R144-G418 PolarHBondContact NE-O 2.85Å; R144-G418 PolarHBondContact NH1-O 3.12Å
419	S	27.8	Very low	31.6	Very low	91 Å²	91	108.9 Å²	108.9	64%	0.636	62%	0.624	S	S	*	*			trans	60.4	149.9	150	-65.7	0	0	0	0	120.5	R144	R144-S419 PolarHBondContact NH1-O 2.96Å
420	M	29.3	Very low	31.4	Very low	155 Å²	155	109.1 Å²	109.1	76%	0.764	62%	0.623	S	S	*	*				55.3	135.7	64.7	-110.5	-176.2	80	0	0	111.7
421	E	30.8	Very low	32	Very low	155 Å²	155	106.6 Å²	106.6	72%	0.724	60%	0.604	S	S	*	*			cis	-148.4	-167.7	16.8	59.6	-146.8	123.6	0	0	114
422	D	31.3	Very low	32.4	Very low	145 Å²	145	105.4 Å²	105.4	78%	0.775	60%	0.6	S	S	*	*			trans	-53.1	165.6	167.9	-58.9	-85.6	0	0	0	111.8
423	E	34.2	Very low	33.1	Very low	163 Å²	163	99.9 Å²	99.9	76%	0.762	58%	0.577	S	S	*	*				178.5	179.3	61.6	-99.9	-149.4	123.6	0	0	105.8
424	A	34.1	Very low	34	Very low	62 Å²	62	104.1 Å²	104.1	51%	0.512	58%	0.576	S	S	.	*			cis	-176.6	179.1	-30.9	0	0	0	0	0	106.2
425	L	38.3	Very low	35	Very low	120 Å²	120	112.1 Å²	112.1	63%	0.628	61%	0.61	S	S	*	*			trans	64.7	167.2	166.8	-51	168.8	0	0	0	113.7	Q509	L425-Q509 HydrophobicContact CD1-CG 3.8Å
426	T	31.5	Very low	35.6	Very low	96 Å²	96	107.3 Å²	107.3	59%	0.589	60%	0.598	S	S	*	*			cis	-155	165.6	-29.7	19.8	0	0	0	0	106.3
427	D	30.5	Very low	36.1	Very low	137 Å²	137	109 Å²	109	73%	0.733	61%	0.61	S	S	*	*				-143.6	162.5	126.1	-139.9	-18.4	0	0	0	112.6	R505	D427-R505 IonicContact OD1-NH1 3.24Å
428	A	32.9	Very low	36.7	Very low	61 Å²	61	114.3 Å²	114.3	50%	0.504	62%	0.615	S	S	.	*			trans	-118.9	-161.7	-162.9	0	0	0	0	0	112.5
429	A	31.3	Very low	37.2	Very low	75 Å²	75	119.3 Å²	119.3	62%	0.62	63%	0.625	S	S	*	*			trans	67.8	129.4	-174.2	0	0	0	0	0	112.8
430	V	37.5	Very low	38.5	Very low	100 Å²	100	121.4 Å²	121.4	61%	0.606	63%	0.634	S	S	*	*			cis	66.2	157.3	16.6	-153.3	0	0	0	0	113.5	L441	V430-L441 HydrophobicContact CB-CD1 3.83Å; V430-L441 HydrophobicContact CB-CG 4.2Å; V430-L441 HydrophobicContact CG1-CD1 3.93Å; V430-L441 HydrophobicContact CG1-CD2 4Å; V430-L441 HydrophobicContact CG1-CG 3.72Å; V430-L441 HydrophobicContact CG2-CD1 4.14Å
431	V	44.8	Very low	39.2	Very low	38 Å²	38	119.1 Å²	119.1	23%	0.23	62%	0.624	C	S	.	*			trans	77.1	0	170.7	-43.4	0	0	0	0	117.6	Y439 V440 L441	V431-Y439 VanDerWaalsContact CA-CZ 3.43Å; V431-Y439 VanDerWaalsContact CB-CB 3.46Å; V431-Y439 HydrophobicContact CB-CD1 3.14Å; V431-Y439 HydrophobicContact CB-CD2 4.16Å; V431-Y439 HydrophobicContact CB-CE1 4.04Å; V431-Y439 HydrophobicContact CB-CG 3.18Å; V431-Y439 HydrophobicContact CG1-CD1 4.24Å; V431-Y439 HydrophobicContact CG2-CD1 4.23Å; V431-Y439 HydrophobicContact CG2-CD2 4.08Å; V431-Y439 HydrophobicContact CG2-CG 3.56Å; V431-Y439 WeakPolarHBondContact O-CD1 3.43Å; V431-Y439 WeakPolarHBondContact O-CD2 3.02Å; V431-Y439 WeakPolarHBondContact O-CE1 3.37Å; V431-Y439 WeakPolarHBondContact O-CE2 3.36Å; V431-V440 VanDerWaalsContact CG1-O 3.3Å; V431-V440 WeakPolarHBondContact CG1-O 3.21Å; V431-L441 HydrophobicContact CG1-CB 4.17Å; V431-L441 HydrophobicContact CG1-CD1 4.22Å; V431-L441 HydrophobicContact CG1-CG 3.9Å
432	Y	39.3	Very low	39.6	Very low	141 Å²	141	116.8 Å²	116.8	55%	0.553	61%	0.613	S	S	*	*				0	157.6	0	-39.5	109.8	0	0	0	120	S437 Y439	Y432-S437 VanDerWaalsContact CE2-O 3.31Å; Y432-S437 WeakPolarHBondContact CE2-O 3.39Å; Y432-Y439 VanDerWaalsContact C-CD1 3.42Å; Y432-Y439 VanDerWaalsContact CA-CD2 3.49Å; Y432-Y439 AromaticContact CD1-CD2 3.39Å; Y432-Y439 HydrophobicContact CD1-CD2 3.39Å; Y432-Y439 AromaticContact CD1-CE2 3.37Å; Y432-Y439 HydrophobicContact CD1-CE2 3.37Å; Y432-Y439 AromaticContact CD2-CD2 3.4Å; Y432-Y439 HydrophobicContact CD2-CD2 3.4Å; Y432-Y439 VanDerWaalsContact CD2-CD2 3.4Å; Y432-Y439 HydrophobicContact CD2-CE2 4.47Å; Y432-Y439 AromaticContact CD2-CG 3.7Å; Y432-Y439 HydrophobicContact CD2-CG 3.7Å; Y432-Y439 AromaticContact CE1-CD2 3.71Å; Y432-Y439 HydrophobicContact CE1-CD2 3.71Å; Y432-Y439 AromaticContact CE1-CE2 3.98Å; Y432-Y439 HydrophobicContact CE1-CE2 3.98Å; Y432-Y439 AromaticContact CE2-CD2 3.73Å; Y432-Y439 HydrophobicContact CE2-CD2 3.73Å; Y432-Y439 HydrophobicContact CE2-CG 4.36Å; Y432-Y439 AromaticContact CG-CD2 3.22Å; Y432-Y439 HydrophobicContact CG-CD2 3.22Å; Y432-Y439 AromaticContact CG-CE2 3.66Å; Y432-Y439 HydrophobicContact CG-CE2 3.66Å; Y432-Y439 AromaticContact CG-CG 3.84Å; Y432-Y439 HydrophobicContact CG-CG 3.84Å; Y432-Y439 AromaticContact CZ-CD2 3.88Å; Y432-Y439 PolarHBondContact N-OH 2.83Å; Y432-Y439 WeakPolarHBondContact O-CE1 3.44Å
433	E	48.5	Very low	39.8	Very low	89 Å²	89	112.6 Å²	112.6	42%	0.416	60%	0.604	S	S	.	*			cis	74.2	163.4	27.7	-153.4	-110.1	-113.4	0	0	114.5	E435 N436 S437 R438	E433-E435 PolarHBondContact OE2-N 3.43Å; E433-N436 WeakPolarHBondContact OE1-CB 3.25Å; E433-N436 PolarHBondContact OE1-N 3.46Å; E433-N436 PolarHBondContact OE2-N 3.3Å; E433-S437 VanDerWaalsContact CD-N 3.31Å; E433-S437 PolarHBondContact OE1-N 3.24Å; E433-S437 VanDerWaalsContact OE1-N 3.16Å; E433-S437 WeakPolarHBondContact OE2-CA 3.35Å; E433-S437 PolarHBondContact OE2-N 2.93Å; E433-R438 WeakPolarHBondContact CB-O 3.44Å; E433-R438 VanDerWaalsContact CD-O 3.26Å; E433-R438 VanDerWaalsContact CG-O 3.24Å; E433-R438 WeakPolarHBondContact CG-O 3.31Å; E433-R438 WeakPolarHBondContact OE1-CG 3.35Å; E433-R438 PolarHBondContact OE1-N 3.02Å; E433-R438 VanDerWaalsContact OE1-O 3.09Å
434	K	47.8	Very low	39.9	Very low	193 Å²	193	108.2 Å²	108.2	84%	0.839	58%	0.584	S	S	*	*	S	Bend	trans	-154.7	-30.3	171.1	-161.9	178.6	177.5	-168.3	0	114.8	N436	K434-N436 PolarHBondContact O-N 3.27Å
435	E	51.3	Low	39.9	Very low	199 Å²	199	110.2 Å²	110.2	93%	0.93	58%	0.583	S	S	*	*	S	Bend	trans	-83.8	-4.7	-170.1	-155.4	153	-131.8	0	0	114.6	E433	E433-E435 PolarHBondContact OE2-N 3.43Å
436	N	39.9	Very low	39.9	Very low	100 Å²	100	111.1 Å²	111.1	54%	0.535	58%	0.581	S	S	.	*	S	Bend	trans	-145.7	-0.6	174.3	-142.1	149.9	0	0	0	114.6	E433 K434 R438	E433-N436 WeakPolarHBondContact OE1-CB 3.25Å; E433-N436 PolarHBondContact OE1-N 3.46Å; E433-N436 PolarHBondContact OE2-N 3.3Å; K434-N436 PolarHBondContact O-N 3.27Å; N436-R438 HydrophobicContact CB-CG 4.36Å; N436-R438 PolarHBondContact OD1-NH2 3.4Å
437	S	39.5	Very low	39.9	Very low	90 Å²	90	113.3 Å²	113.3	63%	0.629	58%	0.579	S	S	*	*	S	Bend	trans	57.7	46.2	-178.3	-62.4	0	0	0	0	116.1	Y432 E433	Y432-S437 VanDerWaalsContact CE2-O 3.31Å; Y432-S437 WeakPolarHBondContact CE2-O 3.39Å; E433-S437 VanDerWaalsContact CD-N 3.31Å; E433-S437 PolarHBondContact OE1-N 3.24Å; E433-S437 VanDerWaalsContact OE1-N 3.16Å; E433-S437 WeakPolarHBondContact OE2-CA 3.35Å; E433-S437 PolarHBondContact OE2-N 2.93Å
438	R	40.4	Very low	39.9	Very low	158 Å²	158	112.5 Å²	112.5	60%	0.596	58%	0.584	S	S	*	*			trans	-149.3	176.6	174.2	52.6	-178.7	167.8	176.8	-5.5	113.6	E433 N436	E433-R438 WeakPolarHBondContact CB-O 3.44Å; E433-R438 VanDerWaalsContact CD-O 3.26Å; E433-R438 VanDerWaalsContact CG-O 3.24Å; E433-R438 WeakPolarHBondContact CG-O 3.31Å; E433-R438 WeakPolarHBondContact OE1-CG 3.35Å; E433-R438 PolarHBondContact OE1-N 3.02Å; E433-R438 VanDerWaalsContact OE1-O 3.09Å; N436-R438 HydrophobicContact CB-CG 4.36Å; N436-R438 PolarHBondContact OD1-NH2 3.4Å
439	Y	40.7	Very low	39.7	Very low	138 Å²	138	115.5 Å²	115.5	54%	0.541	60%	0.601	S	S	.	*			trans	-156.7	123.3	-143.8	-128.4	-19.1	0	0	0	113.2	V431 Y432	V431-Y439 VanDerWaalsContact CA-CZ 3.43Å; V431-Y439 VanDerWaalsContact CB-CB 3.46Å; V431-Y439 HydrophobicContact CB-CD1 3.14Å; V431-Y439 HydrophobicContact CB-CD2 4.16Å; V431-Y439 HydrophobicContact CB-CE1 4.04Å; V431-Y439 HydrophobicContact CB-CG 3.18Å; V431-Y439 HydrophobicContact CG1-CD1 4.24Å; V431-Y439 HydrophobicContact CG2-CD1 4.23Å; V431-Y439 HydrophobicContact CG2-CD2 4.08Å; V431-Y439 HydrophobicContact CG2-CG 3.56Å; V431-Y439 WeakPolarHBondContact O-CD1 3.43Å; V431-Y439 WeakPolarHBondContact O-CD2 3.02Å; V431-Y439 WeakPolarHBondContact O-CE1 3.37Å; V431-Y439 WeakPolarHBondContact O-CE2 3.36Å; Y432-Y439 VanDerWaalsContact C-CD1 3.42Å; Y432-Y439 VanDerWaalsContact CA-CD2 3.49Å; Y432-Y439 AromaticContact CD1-CD2 3.39Å; Y432-Y439 HydrophobicContact CD1-CD2 3.39Å; Y432-Y439 AromaticContact CD1-CE2 3.37Å; Y432-Y439 HydrophobicContact CD1-CE2 3.37Å; Y432-Y439 AromaticContact CD2-CD2 3.4Å; Y432-Y439 HydrophobicContact CD2-CD2 3.4Å; Y432-Y439 VanDerWaalsContact CD2-CD2 3.4Å; Y432-Y439 HydrophobicContact CD2-CE2 4.47Å; Y432-Y439 AromaticContact CD2-CG 3.7Å; Y432-Y439 HydrophobicContact CD2-CG 3.7Å; Y432-Y439 AromaticContact CE1-CD2 3.71Å; Y432-Y439 HydrophobicContact CE1-CD2 3.71Å; Y432-Y439 AromaticContact CE1-CE2 3.98Å; Y432-Y439 HydrophobicContact CE1-CE2 3.98Å; Y432-Y439 AromaticContact CE2-CD2 3.73Å; Y432-Y439 HydrophobicContact CE2-CD2 3.73Å; Y432-Y439 HydrophobicContact CE2-CG 4.36Å; Y432-Y439 AromaticContact CG-CD2 3.22Å; Y432-Y439 HydrophobicContact CG-CD2 3.22Å; Y432-Y439 AromaticContact CG-CE2 3.66Å; Y432-Y439 HydrophobicContact CG-CE2 3.66Å; Y432-Y439 AromaticContact CG-CG 3.84Å; Y432-Y439 HydrophobicContact CG-CG 3.84Å; Y432-Y439 AromaticContact CZ-CD2 3.88Å; Y432-Y439 PolarHBondContact N-OH 2.83Å; Y432-Y439 WeakPolarHBondContact O-CE1 3.44Å
440	V	53.8	Low	39.5	Very low	135 Å²	135	115.4 Å²	115.4	82%	0.818	61%	0.607	S	S	*	*			trans	-144.2	166.5	-168.9	-170.2	0	0	0	0	114.6	V431	V431-V440 VanDerWaalsContact CG1-O 3.3Å; V431-V440 WeakPolarHBondContact CG1-O 3.21Å
441	L	43.7	Very low	39.4	Very low	106 Å²	106	122 Å²	122	56%	0.555	62%	0.621	S	S	*	*			trans	-146.5	160.9	-167.8	-120.8	179.9	0	0	0	115.6	V430 V431	V430-L441 HydrophobicContact CB-CD1 3.83Å; V430-L441 HydrophobicContact CB-CG 4.2Å; V430-L441 HydrophobicContact CG1-CD1 3.93Å; V430-L441 HydrophobicContact CG1-CD2 4Å; V430-L441 HydrophobicContact CG1-CG 3.72Å; V430-L441 HydrophobicContact CG2-CD1 4.14Å; V431-L441 HydrophobicContact CG1-CB 4.17Å; V431-L441 HydrophobicContact CG1-CD1 4.22Å; V431-L441 HydrophobicContact CG1-CG 3.9Å
442	Q	39.9	Very low	38.6	Very low	106 Å²	106	131.3 Å²	131.3	50%	0.495	65%	0.652	S	S	.	*			trans	91.2	135.8	150.3	-165.8	168.4	-62.7	0	0	122.3	Q444	Q442-Q444 VanDerWaalsContact CG-OE1 3.26Å
443	G	35.7	Very low	38.4	Very low	58 Å²	58	129.8 Å²	129.8	60%	0.598	66%	0.662	S	S	*	*			trans	141.4	129.9	171.3	0	0	0	0	0	112.8
444	Q	35.9	Very low	37.9	Very low	71 Å²	71	130.9 Å²	130.9	33%	0.332	68%	0.68	S	S	.	*			cis	94.6	106.3	-6.5	-57.4	-179.4	-125.9	0	0	120.9	Q442 S492 K493 K495	Q442-Q444 VanDerWaalsContact CG-OE1 3.26Å; Q444-S492 PolarHBondContact O-N 3.38Å; Q444-K493 WeakPolarHBondContact CB-O 3.47Å; Q444-K493 PolarHBondContact NE2-O 3.45Å; Q444-K493 PolarHBondContact O-N 2.87Å; Q444-K495 VanDerWaalsContact OE1-CE 3.3Å
445	E	34.8	Very low	37.2	Very low	104 Å²	104	127 Å²	127	49%	0.486	68%	0.677	S	S	.	*			trans	-158.7	171.3	156.4	-120.4	-150.9	129.3	0	0	119.6	S491 K493	E445-S491 VanDerWaalsContact CG-O 3.32Å; E445-S491 WeakPolarHBondContact CG-O 3.27Å; E445-K493 HydrophobicContact CG-CB 4.46Å; E445-K493 HydrophobicContact CG-CD 4.21Å; E445-K493 HydrophobicContact CG-CG 4.01Å; E445-K493 IonicContact OE1-NZ 2.68Å; E445-K493 PolarHBondContact OE1-NZ 2.76Å
446	K	38.2	Very low	36	Very low	138 Å²	138	120.9 Å²	120.9	60%	0.6	67%	0.667	S	S	*	*			trans	151	-123.4	167.7	-66	144.7	178.8	144	0	114.6	K493	K446-K493 WeakPolarHBondContact O-CD 3.49Å; K446-K493 WeakPolarHBondContact O-CE 3.38Å; K446-K493 PolarHBondContact O-NZ 2.79Å
447	R	32.3	Very low	35.7	Very low	142 Å²	142	124.8 Å²	124.8	54%	0.536	69%	0.687	S	S	.	*			trans	75.1	157.3	-168	-68.9	177	-158.5	162.2	2.1	115.4	K493 E496	R447-K493 HydrophobicContact CB-CD 4.19Å; R447-K493 HydrophobicContact CG-CD 3.78Å; R447-E496 IonicContact CZ-OE1 2.66Å; R447-E496 IonicContact NH1-OE1 2.62Å; R447-E496 IonicContact NH2-OE1 3.81Å; R447-E496 PolarHBondContact NH2-OE1 3.05Å
448	S	29.1	Very low	35.2	Very low	120 Å²	120	123.5 Å²	123.5	84%	0.839	69%	0.688	S	S	*	*			trans	-146	166.6	173.1	53.9	0	0	0	0	109.5
449	S	30.1	Very low	34.7	Very low	125 Å²	125	121.3 Å²	121.3	87%	0.874	70%	0.697	S	S	*	*			trans	-168	147.8	-172.3	53.4	0	0	0	0	115
450	G	25.2	Very low	34.2	Very low	72 Å²	72	123 Å²	123	74%	0.742	71%	0.709	S	S	*	*			trans	-173.8	164.5	164.3	0	0	0	0	0	113.3
451	R	36.9	Very low	33	Very low	240 Å²	240	123.7 Å²	123.7	91%	0.906	71%	0.714	S	S	*	*			cis	-171.1	151.4	-15.2	-126.2	-171.8	-154.7	-113.5	8.5	110.4
452	R	28.1	Very low	32.5	Very low	232 Å²	232	123.9 Å²	123.9	88%	0.875	72%	0.724	S	S	*	*			trans	-177.4	129.1	152.3	-96.5	163.1	-142.8	-107.7	5.6	106.1
453	S	34.7	Very low	32.1	Very low	110 Å²	110	125 Å²	125	77%	0.769	74%	0.744	S	S	*	*				76.6	132.3	67	-56.1	0	0	0	0	112.4
454	S	38.2	Very low	31.8	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	75%	0.752	S	S	*	*			cis	-154.6	-153.1	-5.1	40.8	0	0	0	0	108.8
455	S	32.7	Very low	31.7	Very low	111 Å²	111	130 Å²	130	78%	0.776	78%	0.777	S	S	*	*			cis	-164.9	154.4	17.1	-54.4	0	0	0	0	112.4
456	G	25.8	Very low	31.4	Very low	71 Å²	71	136.6 Å²	136.6	73%	0.732	80%	0.797	S	S	*	*			trans	97.8	158.8	147.5	0	0	0	0	0	120.6
457	L	34.8	Very low	31.2	Very low	183 Å²	183	136.3 Å²	136.3	96%	0.958	81%	0.807	S	S	*	*			cis	-172.6	147.7	-25.3	-124.1	169	0	0	0	112.7
458	G	27.9	Very low	32.6	Very low	62 Å²	62	134.8 Å²	134.8	64%	0.639	82%	0.816	S	S	*	*			trans	90.1	155.5	162.8	0	0	0	0	0	118
459	S	29.7	Very low	32.7	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	82%	0.816	S	S	*	*			cis	-161.3	141.7	-11.7	-88.8	0	0	0	0	114
460	H	31.4	Very low	32.7	Very low	174 Å²	174	136.6 Å²	136.6	81%	0.806	81%	0.809	S	S	*	*			trans	10.6	137	157.3	-54	-86.5	0	0	0	124.5
461	T	27.3	Very low	32.9	Very low	149 Å²	149	142.1 Å²	142.1	91%	0.914	81%	0.812	S	S	*	*				-165.2	-176.9	120	15.1	0	0	0	0	110.2
462	S	34.1	Very low	32.7	Very low	110 Å²	110	135.6 Å²	135.6	77%	0.769	80%	0.803	S	S	*	*			trans	-144.2	154.5	-151.2	58.1	0	0	0	0	118.2
463	S	30.9	Very low	32.8	Very low	131 Å²	131	130.9 Å²	130.9	92%	0.916	80%	0.796	S	S	*	*			trans	77.9	133	149.3	-164.4	0	0	0	0	120
464	G	29.1	Very low	32.9	Very low	74 Å²	74	130 Å²	130	76%	0.763	79%	0.79	S	S	*	*			trans	142.8	113.8	159.9	0	0	0	0	0	115.8
465	D	34.1	Very low	32.7	Very low	160 Å²	160	133 Å²	133	86%	0.856	79%	0.792	S	S	*	*			trans	-78.4	137.4	172.4	-77.4	-73.1	0	0	0	113.3
466	R	29.3	Very low	32.3	Very low	242 Å²	242	138.2 Å²	138.2	91%	0.913	80%	0.795	S	S	*	*				174.1	161.4	111	-93.4	174.6	-177.1	176.2	1.6	113.7
467	T	33.7	Very low	32.4	Very low	131 Å²	131	144.9 Å²	144.9	80%	0.804	80%	0.799	S	S	*	*			trans	-94.5	174.1	175.6	44.9	0	0	0	0	111.8
468	P	61.3	Low	33.4	Very low	111 Å²	111	141 Å²	141	72%	0.721	79%	0.785	S	S	*	*			cis	-134.8	-166.1	-30.6	28.8	-5.3	0	0	0	113.7
469	E	32.2	Very low	33.2	Very low	180 Å²	180	143.9 Å²	143.9	84%	0.841	79%	0.794	S	S	*	*			trans	89	160.9	157.4	-56.1	-155.8	127.7	0	0	122.3
470	S	30.5	Very low	33.1	Very low	103 Å²	103	143.6 Å²	143.6	72%	0.72	79%	0.793	S	S	*	*			trans	70.7	119.3	-178.7	-63.2	0	0	0	0	117.6
471	F	27.4	Very low	33.1	Very low	187 Å²	187	145.6 Å²	145.6	82%	0.82	79%	0.793	S	S	*	*				77.7	114.1	62.7	-70.1	-57.1	0	0	0	112.4
472	S	33.2	Very low	33.1	Very low	103 Å²	103	146 Å²	146	72%	0.72	79%	0.785	S	S	*	*				65.5	141.1	98.8	-97.2	0	0	0	0	114
473	D	30.2	Very low	32.8	Very low	134 Å²	134	146.5 Å²	146.5	72%	0.717	78%	0.779	S	S	*	*			cis	-158.1	-175	2.3	-141.9	-56.5	0	0	0	110.8
474	S	36.4	Very low	32.8	Very low	91 Å²	91	147.3 Å²	147.3	64%	0.636	77%	0.766	S	S	*	*			trans	31.4	129.5	147.3	71.4	0	0	0	0	120.4
475	E	33.8	Very low	32.8	Very low	175 Å²	175	154.6 Å²	154.6	82%	0.818	77%	0.77	S	S	*	*				-169.2	173	63.4	-90.6	-154.3	132.2	0	0	115.5
476	Y	26.2	Very low	32.4	Very low	219 Å²	219	158.6 Å²	158.6	86%	0.859	77%	0.773	S	S	*	*			trans	83.8	165.2	151.5	-133.2	-106.7	0	0	0	121.5
477	R	27.8	Very low	33.2	Very low	212 Å²	212	152.1 Å²	152.1	80%	0.8	76%	0.762	S	S	*	*			trans	-158.7	-179.3	-146.3	-144.3	-158.7	161.6	120.6	-2.3	111.9
478	P	55.1	Low	32.9	Very low	102 Å²	102	150.8 Å²	150.8	66%	0.662	76%	0.759	S	S	*	*				-122.3	177.1	-89.1	41.8	-28.3	0	0	0	115.9
479	S	24.6	Very low	31.6	Very low	121 Å²	121	154.9 Å²	154.9	85%	0.846	77%	0.768	S	S	*	*			trans	-161.7	150.6	150.9	-86.5	0	0	0	0	109.9
480	S	26.7	Very low	31.6	Very low	107 Å²	107	151.6 Å²	151.6	75%	0.748	77%	0.765	S	S	*	*			cis	-150	161.5	-10.3	-167.7	0	0	0	0	112.3
481	R	31.1	Very low	31.8	Very low	216 Å²	216	150.3 Å²	150.3	82%	0.815	76%	0.756	S	S	*	*			trans	-40	162.2	170.9	-71.3	161	172.8	-161.6	-2.7	116.4
482	Q	27.8	Very low	32.4	Very low	158 Å²	158	143.9 Å²	143.9	74%	0.738	73%	0.734	S	S	*	*			cis	-136.6	161.2	10.9	-92.4	119.2	28.3	0	0	110.3
483	D	27.9	Very low	33.3	Very low	119 Å²	119	141.7 Å²	141.7	64%	0.636	71%	0.712	S	S	*	*			cis	92.3	94.2	20.5	-178.3	40.8	0	0	0	117.7
484	K	31.3	Very low	34.3	Very low	149 Å²	149	136.4 Å²	136.4	65%	0.648	69%	0.689	S	S	*	*				167.5	134.5	127.3	-90.8	150.3	-164.5	158.3	0	118
485	R	28.5	Very low	35.6	Very low	227 Å²	227	134 Å²	134	86%	0.857	67%	0.667	S	S	*	*			trans	63.9	123	137.5	-62	171.3	-179.9	-175.1	-2	123.6
486	R	25.5	Very low	37.8	Very low	244 Å²	244	128.1 Å²	128.1	92%	0.921	64%	0.64	S	S	*	*			trans	5.5	162.6	137.1	-89.8	-171.9	-175.6	-157.9	3.3	121.6
487	P	45.3	Very low	40.3	Very low	105 Å²	105	117.7 Å²	117.7	68%	0.682	60%	0.599	S	S	*	*			cis	-143.6	-178.2	-6.6	39.3	-18.9	0	0	0	118.3
488	S	27.7	Very low	42.1	Very low	104 Å²	104	114.1 Å²	114.1	73%	0.727	59%	0.589	S	S	*	*			trans	79.3	130.8	146.2	76	0	0	0	0	122.5
489	Q	34.3	Very low	43	Very low	197 Å²	197	112.5 Å²	112.5	92%	0.921	57%	0.573	S	S	*	*				-178.8	171.2	117.7	-97.5	-172.4	18.3	0	0	112.4
490	S	33.2	Very low	45.5	Very low	110 Å²	110	108.8 Å²	108.8	77%	0.769	55%	0.546	S	S	*	.			trans	-125.1	154.8	-173.7	56.8	0	0	0	0	112.3
491	S	34.9	Very low	47.8	Very low	76 Å²	76	106.3 Å²	106.3	53%	0.531	54%	0.538	S	S	.	.			trans	-152.3	98.6	171.7	-168.4	0	0	0	0	117.3	E445 K493	E445-S491 VanDerWaalsContact CG-O 3.32Å; E445-S491 WeakPolarHBondContact CG-O 3.27Å; S491-K493 PolarHBondContact O-N 3.48Å
492	S	38.8	Very low	50	Low	52 Å²	52	101.7 Å²	101.7	36%	0.364	52%	0.523	S	S	.	.				18	96.8	129.8	36.1	0	0	0	0	120.4	Q444	Q444-S492 PolarHBondContact O-N 3.38Å
493	K	51.8	Low	52.1	Low	58 Å²	58	99.4 Å²	99.4	25%	0.252	51%	0.514	S	S	.	.			trans	-119.9	131.1	156.4	-69.1	-169.3	174.1	102.9	0	114.5	Q444 E445 K446 R447 S491	Q444-K493 WeakPolarHBondContact CB-O 3.47Å; Q444-K493 PolarHBondContact NE2-O 3.45Å; Q444-K493 PolarHBondContact O-N 2.87Å; E445-K493 HydrophobicContact CG-CB 4.46Å; E445-K493 HydrophobicContact CG-CD 4.21Å; E445-K493 HydrophobicContact CG-CG 4.01Å; E445-K493 IonicContact OE1-NZ 2.68Å; E445-K493 PolarHBondContact OE1-NZ 2.76Å; K446-K493 WeakPolarHBondContact O-CD 3.49Å; K446-K493 WeakPolarHBondContact O-CE 3.38Å; K446-K493 PolarHBondContact O-NZ 2.79Å; R447-K493 HydrophobicContact CB-CD 4.19Å; R447-K493 HydrophobicContact CG-CD 3.78Å; S491-K493 PolarHBondContact O-N 3.48Å
494	G	52.7	Low	54.5	Low	23 Å²	23	95.9 Å²	95.9	24%	0.237	49%	0.493	C	S	.	.			cis	-144.7	135.8	-35.1	0	0	0	0	0	105
495	K	62.8	Low	56.3	Low	40 Å²	40	96.7 Å²	96.7	17%	0.174	49%	0.492	C	S	.	.			trans	-106.6	8.7	175.3	-54.4	-177.9	-173.5	172.9	0	111.9	Q444 M503 F504 R505 M510	Q444-K495 VanDerWaalsContact OE1-CE 3.3Å; K495-M503 HydrophobicContact CB-SD 4.05Å; K495-F504 WeakPolarHBondContact CB-O 3.49Å; K495-F504 WeakPolarHBondContact CD-O 3.41Å; K495-F504 PolarHBondContact O-N 3.41Å; K495-R505 PolarHBondContact NZ-O 3.11Å; K495-M510 VanDerWaalsContact C-SD 3.58Å
496	E	80.1	Confident	58.6	Low	52 Å²	52	88 Å²	88	24%	0.243	47%	0.466	C	S	.	.	B	Isolated β-bridge	trans	-73.4	130.4	173.3	62.2	-152.8	-179.6	0	0	110.3	R447 F498 K502 M503 M510	R447-E496 IonicContact CZ-OE1 2.66Å; R447-E496 IonicContact NH1-OE1 2.62Å; R447-E496 IonicContact NH2-OE1 3.81Å; R447-E496 PolarHBondContact NH2-OE1 3.05Å; E496-F498 PolarHBondContact O-N 3.36Å; E496-K502 CarbonylContact C-O 3.58Å; E496-K502 VanDerWaalsContact CA-O 3.32Å; E496-K502 WeakPolarHBondContact CA-O 3.35Å; E496-M503 HydrophobicContact CB-CE 4.18Å; E496-M503 HydrophobicContact CB-CG 4.29Å; E496-M503 HydrophobicContact CB-SD 4.04Å; E496-M503 PolarHBondContact N-SD 3.14Å; E496-M503 VanDerWaalsContact N-SD 3.44Å; E496-M503 WeakPolarHBondContact OE2-CE 3.14Å; E496-M510 VanDerWaalsContact O-SD 3.35Å
497	C	78.4	Confident	61.1	Low	0 Å²	0	85.3 Å²	85.3	0%	0	46%	0.456	C	S	.	.			trans	-71.7	113.9	164.1	-179.4	0	0	0	0	108.4	E499 C500 G501 K502 F504 M510	C497-E499 PolarHBondContact O-N 3.42Å; C497-C500 PolarHBondContact O-N 3.31Å; C497-G501 WeakPolarHBondContact O-CA 3.2Å; C497-G501 PolarHBondContact O-N 3.3Å; C497-K502 PolarHBondContact N-O 3.08Å; C497-F504 HydrophobicContact CB-CE2 3.94Å; C497-M510 HydrophobicContact CB-CG 4.49Å
498	F	66.2	Low	62.6	Low	136 Å²	136	86.9 Å²	86.9	60%	0.596	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.7	-178	-74.7	-93.1	0	0	0	114.3	E496	E496-F498 PolarHBondContact O-N 3.36Å
499	E	74.4	Confident	65	Low	69 Å²	69	84.5 Å²	84.5	32%	0.322	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.7	-179.7	-70.5	153.3	-149.5	0	0	112.9	C497 Q514 H517 R518	C497-E499 PolarHBondContact O-N 3.42Å; E499-Q514 PolarHBondContact OE1-NE2 3.15Å; E499-Q514 WeakPolarHBondContact OE2-CG 3.34Å; E499-H517 HydrophobicContact CB-CB 4.5Å; E499-H517 WeakPolarHBondContact OE2-CB 3.36Å; E499-R518 IonicContact OE1-CZ 2.72Å; E499-R518 VanDerWaalsContact OE1-CZ 3.24Å; E499-R518 IonicContact OE1-NE 3.37Å; E499-R518 PolarHBondContact OE1-NE 3.03Å; E499-R518 IonicContact OE1-NH2 3.68Å; E499-R518 PolarHBondContact OE1-NH2 2.94Å; E499-R518 IonicContact OE2-NE 2.64Å
500	C	76.8	Confident	67.5	Low	43 Å²	43	76 Å²	76	29%	0.291	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.4	7.7	-179.3	68.6	0	0	0	0	116.6	C497 K502 H513	C497-C500 PolarHBondContact O-N 3.31Å; C500-K502 PolarHBondContact O-N 3.36Å; C500-H513 PolarHBondContact SG-NE2 3.27Å
501	G	75.1	Confident	69.7	Low	55 Å²	55	73.5 Å²	73.5	57%	0.567	37%	0.37	S	S	*	.			trans	70.9	-13.6	178.5	0	0	0	0	0	116.6	C497 M503	C497-G501 WeakPolarHBondContact O-CA 3.2Å; C497-G501 PolarHBondContact O-N 3.3Å; G501-M503 PolarHBondContact O-N 3.19Å
502	K	77.3	Confident	71.9	Confident	118 Å²	118	72.9 Å²	72.9	51%	0.513	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-63.2	123.1	-172.8	-67.8	172.1	-173.1	166.5	0	112	E496 C497 C500 F504	E496-K502 CarbonylContact C-O 3.58Å; E496-K502 VanDerWaalsContact CA-O 3.32Å; E496-K502 WeakPolarHBondContact CA-O 3.35Å; C497-K502 PolarHBondContact N-O 3.08Å; C500-K502 PolarHBondContact O-N 3.36Å; K502-F504 HydrophobicContact CB-CE2 3.68Å; K502-F504 HydrophobicContact CB-CZ 3.84Å; K502-F504 WeakPolarHBondContact O-CD2 3.25Å; K502-F504 WeakPolarHBondContact O-CE2 3.44Å
503	M	70.9	Confident	73.9	Confident	111 Å²	111	72.3 Å²	72.3	55%	0.547	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-85.5	120.8	178.2	-87.3	-78.1	-165.1	0	0	111.9	K495 E496 G501	K495-M503 HydrophobicContact CB-SD 4.05Å; E496-M503 HydrophobicContact CB-CE 4.18Å; E496-M503 HydrophobicContact CB-CG 4.29Å; E496-M503 HydrophobicContact CB-SD 4.04Å; E496-M503 PolarHBondContact N-SD 3.14Å; E496-M503 VanDerWaalsContact N-SD 3.44Å; E496-M503 WeakPolarHBondContact OE2-CE 3.14Å; G501-M503 PolarHBondContact O-N 3.19Å
504	F	77.9	Confident	75.1	Confident	45 Å²	45	71.7 Å²	71.7	20%	0.197	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-100.1	157.8	-179.4	-67.7	-82.2	0	0	0	112.8	K495 C497 K502 Q509 M510 H513	K495-F504 WeakPolarHBondContact CB-O 3.49Å; K495-F504 WeakPolarHBondContact CD-O 3.41Å; K495-F504 PolarHBondContact O-N 3.41Å; C497-F504 HydrophobicContact CB-CE2 3.94Å; K502-F504 HydrophobicContact CB-CE2 3.68Å; K502-F504 HydrophobicContact CB-CZ 3.84Å; K502-F504 WeakPolarHBondContact O-CD2 3.25Å; K502-F504 WeakPolarHBondContact O-CE2 3.44Å; F504-Q509 HydrophobicContact CB-CB 3.97Å; F504-Q509 HydrophobicContact CD1-CB 3.89Å; F504-Q509 HydrophobicContact CG-CB 4.18Å; F504-M510 HydrophobicContact CB-CB 4.08Å; F504-M510 HydrophobicContact CD2-CB 3.97Å; F504-M510 HydrophobicContact CD2-CG 4.11Å; F504-M510 HydrophobicContact CG-CB 4.23Å; F504-H513 HydrophobicContact CE1-CB 4.02Å; F504-H513 HydrophobicContact CE2-CB 3.93Å; F504-H513 AromaticContact CE2-CD2 3.42Å; F504-H513 VanDerWaalsContact CE2-CD2 3.42Å; F504-H513 WeakPolarHBondContact CE2-CD2 3.09Å; F504-H513 AromaticContact CE2-CG 3.81Å; F504-H513 HydrophobicContact CZ-CB 3.57Å; F504-H513 AromaticContact CZ-CD2 3.22Å; F504-H513 WeakPolarHBondContact CZ-CD2 3.41Å; F504-H513 AromaticContact CZ-CG 3.29Å; F504-H513 AromaticContact CZ-ND1 3.97Å; F504-H513 AromaticContact CZ-NE2 3.85Å
505	R	69.1	Low	76.3	Confident	165 Å²	165	79.2 Å²	79.2	62%	0.623	37%	0.373	S	S	*	.	S	Bend	trans	-78	-29.1	-178.4	-60.4	-177.7	84	-172.6	1.5	111.7	D427 K495	D427-R505 IonicContact OD1-NH1 3.24Å; K495-R505 PolarHBondContact NZ-O 3.11Å
506	S	78	Confident	76.5	Confident	45 Å²	45	80.9 Å²	80.9	32%	0.315	39%	0.386	S	S	.	.	S	Bend	trans	-127	154.7	172.8	81.3	0	0	0	0	113.1	H508 Q509 M510	S506-H508 PolarHBondContact O-N 3.42Å; S506-H508 PolarHBondContact OG-N 2.72Å; S506-Q509 PolarHBondContact O-N 2.85Å; S506-Q509 PolarHBondContact OG-N 3.34Å; S506-Q509 VanDerWaalsContact OG-N 3.12Å; S506-M510 PolarHBondContact O-N 3.48Å
507	R	78.1	Confident	75.9	Confident	187 Å²	187	81.7 Å²	81.7	71%	0.706	39%	0.39	S	S	*	.	H	α-helix	trans	-61.6	-26.5	172	-170.3	-176.4	178.3	-150.3	-0.8	111.9	M510 I511	R507-M510 HydrophobicContact CG-CE 4.15Å; R507-I511 HydrophobicContact CG-CD1 4Å; R507-I511 WeakPolarHBondContact O-CD1 3.46Å; R507-I511 VanDerWaalsContact O-CG1 3.27Å; R507-I511 WeakPolarHBondContact O-CG1 3.29Å; R507-I511 PolarHBondContact O-N 3.43Å
508	H	76.9	Confident	75	Confident	139 Å²	139	90.2 Å²	90.2	64%	0.644	42%	0.422	S	S	*	.	H	α-helix	trans	-71.3	-45.3	178.5	-153.8	87.6	0	0	0	111.4	S506 M510 I511 V512	S506-H508 PolarHBondContact O-N 3.42Å; S506-H508 PolarHBondContact OG-N 2.72Å; H508-M510 VanDerWaalsContact C-N 3.3Å; H508-M510 PolarHBondContact O-N 3.19Å; H508-I511 PolarHBondContact O-N 3.47Å; H508-I511 VanDerWaalsContact O-N 3.17Å; H508-V512 WeakPolarHBondContact O-CG2 3.46Å; H508-V512 PolarHBondContact O-N 2.96Å
509	Q	78.3	Confident	74.2	Confident	54 Å²	54	92.4 Å²	92.4	25%	0.252	43%	0.431	S	S	.	.	H	α-helix	trans	-58.3	-42.4	172.1	-78.8	178.5	-36.5	0	0	111.9	L425 F504 S506 I511 V512 H513	L425-Q509 HydrophobicContact CD1-CG 3.8Å; F504-Q509 HydrophobicContact CB-CB 3.97Å; F504-Q509 HydrophobicContact CD1-CB 3.89Å; F504-Q509 HydrophobicContact CG-CB 4.18Å; S506-Q509 PolarHBondContact O-N 2.85Å; S506-Q509 PolarHBondContact OG-N 3.34Å; S506-Q509 VanDerWaalsContact OG-N 3.12Å; Q509-I511 VanDerWaalsContact C-N 3.35Å; Q509-I511 PolarHBondContact O-N 2.79Å; Q509-V512 PolarHBondContact O-N 2.87Å; Q509-H513 WeakPolarHBondContact O-CB 3.39Å; Q509-H513 PolarHBondContact O-N 3.04Å
510	M	85.6	Confident	72.8	Confident	17 Å²	17	95 Å²	95	8%	0.084	45%	0.447	C	S	.	.	H	α-helix	trans	-59.1	-43.5	175.4	-170.1	-165.3	82.3	0	0	112.1	K495 E496 C497 F504 S506 R507 H508 H513 Q514	K495-M510 VanDerWaalsContact C-SD 3.58Å; E496-M510 VanDerWaalsContact O-SD 3.35Å; C497-M510 HydrophobicContact CB-CG 4.49Å; F504-M510 HydrophobicContact CB-CB 4.08Å; F504-M510 HydrophobicContact CD2-CB 3.97Å; F504-M510 HydrophobicContact CD2-CG 4.11Å; F504-M510 HydrophobicContact CG-CB 4.23Å; S506-M510 PolarHBondContact O-N 3.48Å; R507-M510 HydrophobicContact CG-CE 4.15Å; H508-M510 VanDerWaalsContact C-N 3.3Å; H508-M510 PolarHBondContact O-N 3.19Å; M510-H513 PolarHBondContact O-N 3.09Å; M510-Q514 WeakPolarHBondContact O-CB 3.2Å; M510-Q514 PolarHBondContact O-N 2.76Å
511	I	80.5	Confident	71.1	Confident	59 Å²	59	96.2 Å²	96.2	30%	0.303	47%	0.468	S	S	.	.	H	α-helix	trans	-70	-39.1	178.7	-71.7	166.5	0	0	0	111.8	R507 H508 Q509 Q514 R515	R507-I511 HydrophobicContact CG-CD1 4Å; R507-I511 WeakPolarHBondContact O-CD1 3.46Å; R507-I511 VanDerWaalsContact O-CG1 3.27Å; R507-I511 WeakPolarHBondContact O-CG1 3.29Å; R507-I511 PolarHBondContact O-N 3.43Å; H508-I511 PolarHBondContact O-N 3.47Å; H508-I511 VanDerWaalsContact O-N 3.17Å; Q509-I511 VanDerWaalsContact C-N 3.35Å; Q509-I511 PolarHBondContact O-N 2.79Å; I511-Q514 PolarHBondContact O-N 2.93Å; I511-R515 WeakPolarHBondContact O-CB 3.43Å; I511-R515 PolarHBondContact O-N 3.02Å
512	V	80.8	Confident	69.5	Low	62 Å²	62	96.9 Å²	96.9	38%	0.376	47%	0.474	S	S	.	.	H	α-helix	trans	-62	-46.2	173.3	171.5	0	0	0	0	110	H508 Q509 R515 V516	H508-V512 WeakPolarHBondContact O-CG2 3.46Å; H508-V512 PolarHBondContact O-N 2.96Å; Q509-V512 PolarHBondContact O-N 2.87Å; V512-R515 WeakPolarHBondContact O-CB 3.48Å; V512-R515 PolarHBondContact O-N 2.97Å; V512-R515 VanDerWaalsContact O-N 3.17Å; V512-V516 PolarHBondContact O-N 3.11Å
513	H	81.4	Confident	67.4	Low	40 Å²	40	102.7 Å²	102.7	19%	0.185	49%	0.493	C	S	.	.	H	α-helix	trans	-64.1	-41.7	177.9	-173.3	61.1	0	0	0	113.2	C500 F504 Q509 M510 R515 V516 H517	C500-H513 PolarHBondContact SG-NE2 3.27Å; F504-H513 HydrophobicContact CE1-CB 4.02Å; F504-H513 HydrophobicContact CE2-CB 3.93Å; F504-H513 AromaticContact CE2-CD2 3.42Å; F504-H513 VanDerWaalsContact CE2-CD2 3.42Å; F504-H513 WeakPolarHBondContact CE2-CD2 3.09Å; F504-H513 AromaticContact CE2-CG 3.81Å; F504-H513 HydrophobicContact CZ-CB 3.57Å; F504-H513 AromaticContact CZ-CD2 3.22Å; F504-H513 WeakPolarHBondContact CZ-CD2 3.41Å; F504-H513 AromaticContact CZ-CG 3.29Å; F504-H513 AromaticContact CZ-ND1 3.97Å; F504-H513 AromaticContact CZ-NE2 3.85Å; Q509-H513 WeakPolarHBondContact O-CB 3.39Å; Q509-H513 PolarHBondContact O-N 3.04Å; M510-H513 PolarHBondContact O-N 3.09Å; H513-R515 VanDerWaalsContact C-N 3.26Å; H513-R515 PolarHBondContact O-N 3.32Å; H513-V516 WeakPolarHBondContact O-CB 3.33Å; H513-V516 PolarHBondContact O-N 3.47Å; H513-V516 VanDerWaalsContact O-N 3.14Å; H513-H517 AromaticContact CD2-CD2 4Å; H513-H517 AromaticContact CE1-CD2 3.89Å; H513-H517 AromaticContact CE1-NE2 3.78Å; H513-H517 AromaticContact NE2-CD2 3.58Å; H513-H517 AromaticContact NE2-NE2 3.41Å; H513-H517 PolarHBondContact NE2-NE2 3.49Å; H513-H517 PolarHBondContact O-N 3.09Å
514	Q	75.7	Confident	65.6	Low	45 Å²	45	101.9 Å²	101.9	21%	0.21	50%	0.504	C	S	.	.	H	α-helix	trans	-65.5	-29.7	174.9	-164.8	175.5	13.8	0	0	112.2	E499 M510 I511 V516 H517 R518	E499-Q514 PolarHBondContact OE1-NE2 3.15Å; E499-Q514 WeakPolarHBondContact OE2-CG 3.34Å; M510-Q514 WeakPolarHBondContact O-CB 3.2Å; M510-Q514 PolarHBondContact O-N 2.76Å; I511-Q514 PolarHBondContact O-N 2.93Å; Q514-V516 VanDerWaalsContact C-N 3.32Å; Q514-H517 PolarHBondContact O-N 3Å; Q514-R518 WeakPolarHBondContact O-CG 3.39Å; Q514-R518 PolarHBondContact O-N 3.37Å; Q514-R518 VanDerWaalsContact O-N 3.12Å
515	R	78.5	Confident	63.7	Low	182 Å²	182	105.6 Å²	105.6	69%	0.687	53%	0.532	S	S	*	.	H	α-helix	trans	-70	-26.4	173.7	-169.7	176	-67.4	176.4	-2	112.9	I511 V512 H513 K519	I511-R515 WeakPolarHBondContact O-CB 3.43Å; I511-R515 PolarHBondContact O-N 3.02Å; V512-R515 WeakPolarHBondContact O-CB 3.48Å; V512-R515 PolarHBondContact O-N 2.97Å; V512-R515 VanDerWaalsContact O-N 3.17Å; H513-R515 VanDerWaalsContact C-N 3.26Å; H513-R515 PolarHBondContact O-N 3.32Å; R515-K519 PolarHBondContact O-N 2.81Å
516	V	67	Low	62	Low	75 Å²	75	102.2 Å²	102.2	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-70.1	-52.5	170.4	-179.6	0	0	0	0	110.1	V512 H513 Q514 R518 K519 D520	V512-V516 PolarHBondContact O-N 3.11Å; H513-V516 WeakPolarHBondContact O-CB 3.33Å; H513-V516 PolarHBondContact O-N 3.47Å; H513-V516 VanDerWaalsContact O-N 3.14Å; Q514-V516 VanDerWaalsContact C-N 3.32Å; V516-R518 PolarHBondContact O-N 2.87Å; V516-R518 VanDerWaalsContact O-N 3.1Å; V516-K519 WeakPolarHBondContact O-CB 3.23Å; V516-K519 PolarHBondContact O-N 3.41Å; V516-D520 PolarHBondContact O-N 3.35Å
517	H	67.2	Low	60	Low	68 Å²	68	103.5 Å²	103.5	32%	0.315	56%	0.56	S	S	.	*	H	α-helix	trans	-53.6	-35.5	177.3	-87.8	-82.8	0	0	0	113.4	E499 H513 Q514 K519 G521	E499-H517 HydrophobicContact CB-CB 4.5Å; E499-H517 WeakPolarHBondContact OE2-CB 3.36Å; H513-H517 AromaticContact CD2-CD2 4Å; H513-H517 AromaticContact CE1-CD2 3.89Å; H513-H517 AromaticContact CE1-NE2 3.78Å; H513-H517 AromaticContact NE2-CD2 3.58Å; H513-H517 AromaticContact NE2-NE2 3.41Å; H513-H517 PolarHBondContact NE2-NE2 3.49Å; H513-H517 PolarHBondContact O-N 3.09Å; Q514-H517 PolarHBondContact O-N 3Å; H517-K519 VanDerWaalsContact C-N 3.35Å; H517-G521 PolarHBondContact O-N 3.15Å
518	R	60	Low	57.8	Low	179 Å²	179	100.9 Å²	100.9	68%	0.675	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-6.8	176.9	-69.4	-179.1	175.9	-102.4	-10.7	115.4	E499 Q514 V516	E499-R518 IonicContact OE1-CZ 2.72Å; E499-R518 VanDerWaalsContact OE1-CZ 3.24Å; E499-R518 IonicContact OE1-NE 3.37Å; E499-R518 PolarHBondContact OE1-NE 3.03Å; E499-R518 IonicContact OE1-NH2 3.68Å; E499-R518 PolarHBondContact OE1-NH2 2.94Å; E499-R518 IonicContact OE2-NE 2.64Å; Q514-R518 WeakPolarHBondContact O-CG 3.39Å; Q514-R518 PolarHBondContact O-N 3.37Å; Q514-R518 VanDerWaalsContact O-N 3.12Å; V516-R518 PolarHBondContact O-N 2.87Å; V516-R518 VanDerWaalsContact O-N 3.1Å
519	K	48.9	Very low	55.7	Low	183 Å²	183	101.3 Å²	101.3	80%	0.796	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-29.9	171.9	-163.8	178.4	178.6	-171.9	0	111.9	R515 V516 H517	R515-K519 PolarHBondContact O-N 2.81Å; V516-K519 WeakPolarHBondContact O-CB 3.23Å; V516-K519 PolarHBondContact O-N 3.41Å; H517-K519 VanDerWaalsContact C-N 3.35Å
520	D	44.4	Very low	53.5	Low	122 Å²	122	107 Å²	107	65%	0.652	59%	0.587	S	S	*	*	S	Bend	trans	-96.7	10.1	180	-56.2	-43.4	0	0	0	113.5	V516 G522	V516-D520 PolarHBondContact O-N 3.35Å; D520-G522 PolarHBondContact O-N 3.04Å
521	G	40.9	Very low	50.9	Low	70 Å²	70	117.1 Å²	117.1	72%	0.722	62%	0.624	S	S	*	*			trans	-70.7	37.9	-177.9	0	0	0	0	0	115.6	H517	H517-G521 PolarHBondContact O-N 3.15Å
522	G	43.1	Very low	48.6	Very low	68 Å²	68	120.5 Å²	120.5	70%	0.701	65%	0.647	S	S	*	*	S	Bend	trans	-106.6	10.7	-171.6	0	0	0	0	0	116	D520	D520-G522 PolarHBondContact O-N 3.04Å
523	R	31.9	Very low	46.3	Very low	241 Å²	241	120.9 Å²	120.9	91%	0.909	66%	0.664	S	S	*	*			trans	-159.6	133.6	167.8	-141.8	163.7	-73.1	-141.6	0.5	111.6
524	A	32.7	Very low	43.9	Very low	93 Å²	93	129.9 Å²	129.9	77%	0.769	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-103.9	142.9	173.7	0	0	0	0	0	110.4
525	P	37.8	Very low	41.8	Very low	124 Å²	124	132.4 Å²	132.4	81%	0.805	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-91	130.2	168.1	33.8	-29.7	0	0	0	111.4
526	A	35.4	Very low	39.6	Very low	94 Å²	94	130.5 Å²	130.5	78%	0.777	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-69.6	155.5	145.6	0	0	0	0	0	107.8
527	G	34.3	Very low	37.9	Very low	72 Å²	72	134 Å²	134	74%	0.742	73%	0.727	S	S	*	*			cis	84	115	44.8	0	0	0	0	0	108.1
528	D	31.8	Very low	36.1	Very low	131 Å²	131	141.9 Å²	141.9	70%	0.701	75%	0.754	S	S	*	*			cis	-154.2	-179.7	11	-154.2	1.9	0	0	0	113.2
529	K	33.8	Very low	34.3	Very low	149 Å²	149	136.2 Å²	136.2	65%	0.648	75%	0.751	S	S	*	*			trans	-6.9	131.4	165.3	-69.9	161	-158	74.1	0	118.5
530	E	31.3	Very low	34.6	Very low	174 Å²	174	133.1 Å²	133.1	81%	0.813	75%	0.749	S	S	*	*				53.1	107.3	83.5	-81.8	-167.1	100	0	0	116.2
531	R	32.3	Very low	33.7	Very low	228 Å²	228	133.4 Å²	133.4	86%	0.86	76%	0.756	S	S	*	*				-179.4	126.9	107.8	-101.1	-178.5	-176.8	-156.1	-1.1	116.6
532	T	31.6	Very low	33.2	Very low	130 Å²	130	135.1 Å²	135.1	80%	0.798	76%	0.757	S	S	*	*			trans	27.3	115.4	138.7	58.5	0	0	0	0	122.3
533	G	31.8	Very low	32.7	Very low	71 Å²	71	139.3 Å²	139.3	73%	0.732	76%	0.763	S	S	*	*				112.6	130.4	99.3	0	0	0	0	0	120.1
534	R	31.7	Very low	33.3	Very low	228 Å²	228	132.9 Å²	132.9	86%	0.86	75%	0.753	S	S	*	*			trans	64.6	154.2	166.3	-67.9	-173.5	158.8	-115.7	6.7	116.4
535	D	30.4	Very low	33.3	Very low	99 Å²	99	136.7 Å²	136.7	53%	0.529	75%	0.754	S	S	.	*			cis	-158	162.2	-18.1	-99.8	-24.3	0	0	0	109.4
536	D	32.2	Very low	33.1	Very low	142 Å²	142	136.2 Å²	136.2	76%	0.759	75%	0.754	S	S	*	*			trans	62.1	153.7	153	-65.1	-35.7	0	0	0	124.3
537	Q	31.4	Very low	32.8	Very low	149 Å²	149	135.2 Å²	135.2	70%	0.696	75%	0.753	S	S	*	*			trans	79.7	102.7	146.1	-124.8	64.4	-19.4	0	0	124.4
538	W	29.4	Very low	32.8	Very low	232 Å²	232	137.5 Å²	137.5	88%	0.879	76%	0.758	S	S	*	*			trans	50.4	145.1	137.2	-69.9	64.6	0	0	0	122.9
539	G	23.6	Very low	33.4	Very low	60 Å²	60	136.7 Å²	136.7	62%	0.619	76%	0.76	S	S	*	*			trans	-108.4	-156.3	158.1	0	0	0	0	0	111.3
540	P	53.8	Low	33.3	Very low	118 Å²	118	134.5 Å²	134.5	77%	0.766	76%	0.763	S	S	*	*			cis	-132.1	-137.3	3.8	41.7	-22.2	0	0	0	112.6
541	T	27.2	Very low	33.4	Very low	128 Å²	128	137.2 Å²	137.2	79%	0.785	77%	0.766	S	S	*	*			trans	76.9	148.5	174.5	72.2	0	0	0	0	117
542	S	28.6	Very low	33.8	Very low	107 Å²	107	131.1 Å²	131.1	75%	0.748	76%	0.756	S	S	*	*			cis	-166.2	154.3	-20	45.8	0	0	0	0	111.3
543	D	33.4	Very low	33.7	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	76%	0.757	S	S	*	*			trans	-65.1	165.5	164.1	-60.8	-81.6	0	0	0	112.1
544	P	45.5	Very low	33.9	Very low	106 Å²	106	133.4 Å²	133.4	69%	0.688	76%	0.761	S	S	*	*				-150.1	161.3	96.6	39.1	-22.2	0	0	0	117.8
545	E	31.9	Very low	34.5	Very low	173 Å²	173	129 Å²	129	81%	0.808	76%	0.761	S	S	*	*			trans	54.2	124.7	144.4	-66.4	173.2	109.3	0	0	121.3
546	S	34.1	Very low	34.5	Very low	114 Å²	114	127.7 Å²	127.7	80%	0.797	77%	0.771	S	S	*	*				90.3	144.7	55.8	98.1	0	0	0	0	114.4
547	G	27.9	Very low	34.6	Very low	74 Å²	74	132.9 Å²	132.9	76%	0.763	78%	0.782	S	S	*	*			cis	-163.5	-151.7	9.6	0	0	0	0	0	116.6
548	S	35.1	Very low	34.5	Very low	120 Å²	120	128.6 Å²	128.6	84%	0.839	78%	0.778	S	S	*	*			trans	-90.8	-165.7	-167.1	-48.1	0	0	0	0	113.2
549	P	43.5	Very low	34.5	Very low	114 Å²	114	125.1 Å²	125.1	74%	0.74	78%	0.777	S	S	*	*			cis	-151.1	170.9	8.7	44.9	-23.4	0	0	0	121.7
550	S	33.3	Very low	34.9	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	78%	0.783	S	S	*	*			trans	63.6	118.9	138.4	-69.5	0	0	0	0	127.2
551	R	31.8	Very low	35.1	Very low	232 Å²	232	127.3 Å²	127.3	88%	0.875	78%	0.782	S	S	*	*			trans	69.9	169.7	130.9	-77.1	-173	159.5	-134.2	-3.2	120.7
552	P	41.8	Very low	36.2	Very low	100 Å²	100	127.5 Å²	127.5	65%	0.649	79%	0.786	S	S	*	*			cis	-143.4	178.7	-47.4	43.1	-26.3	0	0	0	116.8
553	S	29.7	Very low	36.3	Very low	118 Å²	118	126.8 Å²	126.8	83%	0.825	79%	0.787	S	S	*	*			trans	84.2	160	146	-64.4	0	0	0	0	124.2
554	T	35.3	Very low	36.3	Very low	131 Å²	131	124.5 Å²	124.5	80%	0.804	78%	0.783	S	S	*	*			trans	-95.5	163.7	-162.5	49.7	0	0	0	0	117.3
555	P	44.3	Very low	35.6	Very low	134 Å²	134	125 Å²	125	87%	0.87	78%	0.784	S	S	*	*				-146.3	-179.6	111.4	38.9	-23.9	0	0	0	114.4
556	G	30.3	Very low	35.6	Very low	72 Å²	72	125.1 Å²	125.1	74%	0.742	79%	0.789	S	S	*	*			cis	161.2	89.9	-16.4	0	0	0	0	0	118.9
557	Y	34.1	Very low	35.4	Very low	251 Å²	251	123.6 Å²	123.6	98%	0.984	79%	0.792	S	S	*	*			trans	76.4	162.5	145.1	-120.6	-97.1	0	0	0	124.4
558	G	29.3	Very low	35.8	Very low	60 Å²	60	127 Å²	127	62%	0.619	79%	0.792	S	S	*	*			trans	112.2	142.7	167.9	0	0	0	0	0	116.1
559	D	29.7	Very low	35.9	Very low	159 Å²	159	129.4 Å²	129.4	85%	0.85	79%	0.79	S	S	*	*			cis	-158.7	-175.8	-18.4	-141.1	-44.2	0	0	0	111.6
560	S	31.9	Very low	35.2	Very low	106 Å²	106	128.3 Å²	128.3	74%	0.741	79%	0.791	S	S	*	*			trans	-108.6	172.7	-166.7	-66.1	0	0	0	0	115.8
561	P	59	Low	35.2	Very low	117 Å²	117	128.5 Å²	128.5	76%	0.76	79%	0.792	S	S	*	*			trans	-108.5	178.8	-156.9	42.4	-37.3	0	0	0	115.8
562	P	50.6	Low	35.2	Very low	132 Å²	132	125.3 Å²	125.3	86%	0.857	79%	0.787	S	S	*	*			trans	-116.8	170.3	151.1	38.5	-28.5	0	0	0	113
563	A	30.2	Very low	34.7	Very low	93 Å²	93	128.5 Å²	128.5	77%	0.769	80%	0.796	S	S	*	*			trans	-130.4	157.7	176.4	0	0	0	0	0	111
564	S	32.3	Very low	34.8	Very low	107 Å²	107	126.3 Å²	126.3	75%	0.748	79%	0.792	S	S	*	*			trans	171.6	152	140.7	-82.5	0	0	0	0	115.2
565	T	31.3	Very low	34.6	Very low	115 Å²	115	126.6 Å²	126.6	71%	0.706	79%	0.793	S	S	*	*			trans	54.2	120.1	146.6	52.9	0	0	0	0	123.1
566	L	32.4	Very low	34.1	Very low	176 Å²	176	125.7 Å²	125.7	92%	0.921	79%	0.79	S	S	*	*				45.5	126.8	123.9	-57.5	170.4	0	0	0	120.6
567	G	30.7	Very low	34.2	Very low	83 Å²	83	129.5 Å²	129.5	86%	0.856	79%	0.794	S	S	*	*			trans	-174.6	139.8	163.2	0	0	0	0	0	111.5
568	D	35.9	Very low	34.1	Very low	144 Å²	144	122.6 Å²	122.6	77%	0.77	78%	0.782	S	S	*	*			trans	-115.5	146	-171.8	-124.9	-46.8	0	0	0	112.2
569	Q	37.7	Very low	34.2	Very low	171 Å²	171	123.2 Å²	123.2	80%	0.799	79%	0.789	S	S	*	*			trans	61.3	147.9	158.7	-69.4	172.6	72.9	0	0	122.3
570	A	28.4	Very low	34.7	Very low	92 Å²	92	124.6 Å²	124.6	76%	0.76	79%	0.79	S	S	*	*			trans	67.3	146.2	158.5	0	0	0	0	0	119.3
571	S	33.4	Very low	35.1	Very low	105 Å²	105	127.5 Å²	127.5	73%	0.734	80%	0.795	S	S	*	*			cis	-166	171.7	-19.5	-95.7	0	0	0	0	109.8
572	E	31.7	Very low	34.3	Very low	165 Å²	165	125.5 Å²	125.5	77%	0.771	79%	0.789	S	S	*	*			trans	78.8	156.7	158.9	-41.4	-154.5	136.7	0	0	120.7
573	M	30.8	Very low	34.1	Very low	167 Å²	167	127.1 Å²	127.1	82%	0.823	79%	0.79	S	S	*	*			trans	-26.6	147.8	173.1	62.6	-141.5	160.8	0	0	119.2
574	G	31.1	Very low	35.3	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	79%	0.785	S	S	*	*			cis	154	122.8	-4.8	0	0	0	0	0	112.6
575	T	31.1	Very low	37.2	Very low	137 Å²	137	132.7 Å²	132.7	84%	0.84	79%	0.786	S	S	*	*			trans	-138.6	146.7	172.5	48.1	0	0	0	0	111.4
576	S	35	Very low	39.5	Very low	115 Å²	115	130.4 Å²	130.4	80%	0.804	77%	0.773	S	S	*	*			trans	-71.8	131	-176.7	54.1	0	0	0	0	112.6
577	N	31.4	Very low	41.7	Very low	152 Å²	152	125.9 Å²	125.9	81%	0.813	74%	0.744	S	S	*	*			trans	-140.1	151.5	160.2	-95	-45.8	0	0	0	111.5	G579	N577-G579 PolarHBondContact O-N 2.74Å
578	S	31.8	Very low	44.3	Very low	106 Å²	106	127.1 Å²	127.1	74%	0.741	73%	0.73	S	S	*	*			trans	-23.7	115.3	178.5	50.7	0	0	0	0	117	E580	S578-E580 PolarHBondContact O-N 3.48Å
579	G	32.4	Very low	46.5	Very low	73 Å²	73	120.6 Å²	120.6	75%	0.753	70%	0.696	S	S	*	*			trans	-77	110.5	160	0	0	0	0	0	110.6	N577 I581	N577-G579 PolarHBondContact O-N 2.74Å; G579-I581 PolarHBondContact O-N 3.28Å
580	E	39.7	Very low	48.2	Very low	188 Å²	188	117.5 Å²	117.5	88%	0.879	69%	0.693	S	S	*	*			trans	-72.2	110.3	168.6	-68.2	-172.1	111	0	0	109.6	S578 A582	S578-E580 PolarHBondContact O-N 3.48Å; E580-A582 PolarHBondContact O-N 3.16Å; E580-A582 VanDerWaalsContact O-N 3.16Å
581	I	40.5	Very low	50.4	Low	167 Å²	167	118.4 Å²	118.4	86%	0.856	68%	0.684	S	S	*	*			trans	-79.2	96.7	169.8	-57.6	177.1	0	0	0	107.5	G579	G579-I581 PolarHBondContact O-N 3.28Å
582	A	41.2	Very low	52.7	Low	75 Å²	75	115.9 Å²	115.9	62%	0.62	67%	0.666	S	S	*	*			trans	-67.7	138.6	167.8	0	0	0	0	0	110.3	E580 E584	E580-A582 PolarHBondContact O-N 3.16Å; E580-A582 VanDerWaalsContact O-N 3.16Å; A582-E584 VanDerWaalsContact C-N 3.26Å; A582-E584 PolarHBondContact O-N 2.58Å
583	D	46.4	Very low	55	Low	166 Å²	166	116 Å²	116	89%	0.888	67%	0.672	S	S	*	*			trans	-69.8	78.1	174.1	-83.3	-58	0	0	0	110.9	K585	D583-K585 PolarHBondContact O-N 2.84Å; D583-K585 VanDerWaalsContact O-N 3.11Å
584	E	56	Low	57.6	Low	142 Å²	142	111.6 Å²	111.6	66%	0.664	65%	0.649	S	S	*	*			trans	-58.9	113.1	168.8	-89.1	-62.6	148	0	0	109.8	A582	A582-E584 VanDerWaalsContact C-N 3.26Å; A582-E584 PolarHBondContact O-N 2.58Å
585	K	72.6	Confident	60.1	Low	175 Å²	175	111.9 Å²	111.9	76%	0.761	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-92.9	120.8	-165.4	-167.8	175.5	-175.3	176.7	0	109.5	D583	D583-K585 PolarHBondContact O-N 2.84Å; D583-K585 VanDerWaalsContact O-N 3.11Å
586	P	79.4	Confident	62.7	Low	67 Å²	67	106.6 Å²	106.6	44%	0.435	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-63.1	140.8	-168.9	24.2	-34.5	0	0	0	112.7	V595 T596	P586-V595 HydrophobicContact CB-CG1 3.88Å; P586-V595 HydrophobicContact CG-CG1 4.45Å; P586-T596 CarbonylContact C-O 3.54Å; P586-T596 WeakPolarHBondContact CA-O 3.19Å
587	Y	78.4	Confident	65.1	Low	82 Å²	82	104.7 Å²	104.7	32%	0.322	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.2	118.5	178.1	-60.5	-95.8	0	0	0	109.1	V595 T596 A597 Y602	Y587-V595 WeakPolarHBondContact O-CA 3.38Å; Y587-T596 PolarHBondContact N-O 3.47Å; Y587-T596 PolarHBondContact O-N 3.41Å; Y587-A597 WeakPolarHBondContact CD2-O 3.24Å; Y587-A597 WeakPolarHBondContact CE2-O 3.23Å; Y587-Y602 HydrophobicContact CD1-CD1 4.43Å; Y587-Y602 HydrophobicContact CD1-CG 4.47Å; Y587-Y602 HydrophobicContact CG-CG 4.36Å
588	I	84.2	Confident	67.5	Low	109 Å²	109	103.8 Å²	103.8	56%	0.559	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110	124.1	-176.3	-62.3	165.1	0	0	0	108.1	V595 Y602	I588-V595 HydrophobicContact CB-CG2 4.35Å; I588-V595 HydrophobicContact CG1-CB 4.45Å; I588-V595 HydrophobicContact CG1-CG1 3.82Å; I588-V595 HydrophobicContact CG1-CG2 3.91Å; I588-V595 HydrophobicContact CG2-CG2 4.16Å; I588-Y602 WeakPolarHBondContact O-CE2 3.38Å
589	C	83.1	Confident	69.9	Low	7 Å²	7	101.2 Å²	101.2	5%	0.047	57%	0.567	C	S	.	*			trans	-64.5	134.8	173.4	-172.8	0	0	0	0	110.3	L591 C592 F594 Y602 H605 H610	C589-L591 VanDerWaalsContact C-N 3.29Å; C589-L591 PolarHBondContact SG-N 3.26Å; C589-L591 VanDerWaalsContact SG-N 3.42Å; C589-C592 WeakPolarHBondContact CB-O 3.37Å; C589-C592 VanDerWaalsContact O-O 3.09Å; C589-F594 HydrophobicContact CB-CB 4.06Å; C589-F594 WeakPolarHBondContact CB-O 3.46Å; C589-F594 PolarHBondContact N-O 2.84Å; C589-Y602 HydrophobicContact CB-CE2 4.46Å; C589-H605 PolarHBondContact SG-NE2 3.21Å; C589-H610 VanDerWaalsContact SG-CD2 3.53Å; C589-H610 PolarHBondContact SG-NE2 3.19Å
590	S	73.3	Confident	72.2	Confident	106 Å²	106	105 Å²	105	74%	0.741	57%	0.566	S	S	*	*	S	Bend	trans	-87.8	2.3	176.2	56.2	0	0	0	0	113.4
591	L	74	Confident	74.1	Confident	110 Å²	110	97.3 Å²	97.3	58%	0.576	53%	0.534	S	S	*	.	S	Bend	trans	-122.7	-14.2	-172.3	-58	176	0	0	0	113.4	C589 H610	C589-L591 VanDerWaalsContact C-N 3.29Å; C589-L591 PolarHBondContact SG-N 3.26Å; C589-L591 VanDerWaalsContact SG-N 3.42Å; L591-H610 HydrophobicContact CD1-CB 3.61Å
592	C	83.2	Confident	76.4	Confident	53 Å²	53	91.6 Å²	91.6	36%	0.358	50%	0.502	S	S	.	.	S	Bend	trans	-159.7	174.2	164.1	69.8	0	0	0	0	109.9	C589 F594 H605 H610	C589-C592 WeakPolarHBondContact CB-O 3.37Å; C589-C592 VanDerWaalsContact O-O 3.09Å; C592-F594 PolarHBondContact O-N 2.81Å; C592-H605 PolarHBondContact SG-CE1 3.26Å; C592-H605 PolarHBondContact SG-NE2 3.26Å; C592-H605 VanDerWaalsContact SG-NE2 3.37Å; C592-H610 PolarHBondContact SG-NE2 3.04Å
593	D	78.5	Confident	78.2	Confident	167 Å²	167	93.8 Å²	93.8	89%	0.893	50%	0.498	S	S	*	.	S	Bend	trans	-73.5	20.8	-174.7	-59.1	-61.3	0	0	0	115.6
594	F	85.5	Confident	79.9	Confident	75 Å²	75	89.6 Å²	89.6	33%	0.329	48%	0.478	S	S	.	.			trans	-73.4	128.8	177.9	-176.3	-97.5	0	0	0	111.8	C589 C592 T596 H605	C589-F594 HydrophobicContact CB-CB 4.06Å; C589-F594 WeakPolarHBondContact CB-O 3.46Å; C589-F594 PolarHBondContact N-O 2.84Å; C592-F594 PolarHBondContact O-N 2.81Å; F594-T596 HydrophobicContact CD1-CG2 4.49Å; F594-T596 HydrophobicContact CE1-CG2 3.66Å; F594-T596 HydrophobicContact CZ-CG2 4.27Å; F594-H605 VanDerWaalsContact CB-CE1 3.43Å; F594-H605 WeakPolarHBondContact CB-CE1 3.39Å; F594-H605 WeakPolarHBondContact CB-NE2 3.41Å; F594-H605 HydrophobicContact CD1-CB 3.73Å; F594-H605 AromaticContact CD1-CD2 3.44Å; F594-H605 VanDerWaalsContact CD1-CD2 3.44Å; F594-H605 WeakPolarHBondContact CD1-CD2 3.14Å; F594-H605 AromaticContact CD1-CG 3.3Å; F594-H605 AromaticContact CD1-ND1 3.72Å; F594-H605 AromaticContact CD1-NE2 3.95Å; F594-H605 AromaticContact CD2-ND1 3.84Å; F594-H605 HydrophobicContact CE1-CB 3.5Å; F594-H605 VanDerWaalsContact CE1-CB 3.5Å; F594-H605 AromaticContact CE1-CG 3.63Å; F594-H605 HydrophobicContact CG-CB 4.4Å; F594-H605 AromaticContact CG-CD2 3.82Å; F594-H605 AromaticContact CG-CE1 3.66Å; F594-H605 AromaticContact CG-CG 3.63Å; F594-H605 AromaticContact CG-ND1 3.52Å; F594-H605 AromaticContact CG-NE2 3.85Å; F594-H605 HydrophobicContact CZ-CB 4.01Å
595	V	84.3	Confident	81.4	Confident	78 Å²	78	83.8 Å²	83.8	47%	0.473	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.2	-179.9	-174.5	0	0	0	0	109.9	P586 Y587 I588	P586-V595 HydrophobicContact CB-CG1 3.88Å; P586-V595 HydrophobicContact CG-CG1 4.45Å; Y587-V595 WeakPolarHBondContact O-CA 3.38Å; I588-V595 HydrophobicContact CB-CG2 4.35Å; I588-V595 HydrophobicContact CG1-CB 4.45Å; I588-V595 HydrophobicContact CG1-CG1 3.82Å; I588-V595 HydrophobicContact CG1-CG2 3.91Å; I588-V595 HydrophobicContact CG2-CG2 4.16Å
596	T	85.3	Confident	81.8	Confident	26 Å²	26	77.5 Å²	77.5	16%	0.16	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	150.6	176.9	179.4	0	0	0	0	111.7	P586 Y587 F594 E598 A601	P586-T596 CarbonylContact C-O 3.54Å; P586-T596 WeakPolarHBondContact CA-O 3.19Å; Y587-T596 PolarHBondContact N-O 3.47Å; Y587-T596 PolarHBondContact O-N 3.41Å; F594-T596 HydrophobicContact CD1-CG2 4.49Å; F594-T596 HydrophobicContact CE1-CG2 3.66Å; F594-T596 HydrophobicContact CZ-CG2 4.27Å; T596-E598 VanDerWaalsContact C-N 3.31Å; T596-E598 VanDerWaalsContact CG2-O 3.29Å; T596-E598 WeakPolarHBondContact CG2-O 3.48Å; T596-E598 PolarHBondContact OG1-N 3.14Å; T596-E598 VanDerWaalsContact OG1-N 3.08Å; T596-A601 HydrophobicContact CG2-CB 4.1Å
597	A	84.8	Confident	81.5	Confident	75 Å²	75	82.8 Å²	82.8	62%	0.62	44%	0.438	S	S	*	.	S	Bend	trans	-75	-23	169.3	0	0	0	0	0	112.1	Y587	Y587-A597 WeakPolarHBondContact CD2-O 3.24Å; Y587-A597 WeakPolarHBondContact CE2-O 3.23Å
598	E	82.2	Confident	81.5	Confident	133 Å²	133	83.7 Å²	83.7	62%	0.621	45%	0.452	S	S	*	.			trans	-92.3	113.8	-174.7	-67.9	178.6	-173.6	0	0	111.9	T596 Q600 A601 Y602	T596-E598 VanDerWaalsContact C-N 3.31Å; T596-E598 VanDerWaalsContact CG2-O 3.29Å; T596-E598 WeakPolarHBondContact CG2-O 3.48Å; T596-E598 PolarHBondContact OG1-N 3.14Å; T596-E598 VanDerWaalsContact OG1-N 3.08Å; E598-Q600 PolarHBondContact O-N 3.27Å; E598-Q600 VanDerWaalsContact O-N 3.17Å; E598-A601 HydrophobicContact CB-CB 3.94Å; E598-A601 PolarHBondContact O-N 3.04Å; E598-A601 VanDerWaalsContact O-N 3.14Å; E598-Y602 PolarHBondContact O-N 3.21Å
599	S	83.6	Confident	80.8	Confident	52 Å²	52	85 Å²	85	36%	0.364	46%	0.456	S	S	.	.	H	α-helix	trans	-54.8	-34.8	177.1	62.9	0	0	0	0	113	Y602 F603	S599-Y602 WeakPolarHBondContact O-CB 3.45Å; S599-Y602 PolarHBondContact O-N 3.3Å; S599-F603 WeakPolarHBondContact O-CD2 3.46Å; S599-F603 PolarHBondContact O-N 2.87Å
600	Q	80.4	Confident	80.6	Confident	153 Å²	153	87.2 Å²	87.2	72%	0.715	47%	0.465	S	S	*	.	H	α-helix	trans	-72.5	-38.4	-179.4	-163.4	154.5	-15.3	0	0	112.1	E598 Y602 F603 T604	E598-Q600 PolarHBondContact O-N 3.27Å; E598-Q600 VanDerWaalsContact O-N 3.17Å; Q600-Y602 VanDerWaalsContact C-N 3.32Å; Q600-F603 PolarHBondContact O-N 3.46Å; Q600-T604 WeakPolarHBondContact O-CG2 3.46Å; Q600-T604 PolarHBondContact O-N 3.27Å; Q600-T604 PolarHBondContact O-OG1 3.15Å
601	A	80.3	Confident	80.1	Confident	25 Å²	25	89.6 Å²	89.6	21%	0.207	47%	0.465	C	S	.	.	H	α-helix	trans	-66.3	-33.3	171.2	0	0	0	0	0	112.2	T596 E598 T604 H605	T596-A601 HydrophobicContact CG2-CB 4.1Å; E598-A601 HydrophobicContact CB-CB 3.94Å; E598-A601 PolarHBondContact O-N 3.04Å; E598-A601 VanDerWaalsContact O-N 3.14Å; A601-T604 WeakPolarHBondContact CA-OG1 3.47Å; A601-T604 PolarHBondContact O-OG1 2.83Å; A601-T604 VanDerWaalsContact O-OG1 3.07Å; A601-H605 WeakPolarHBondContact O-CB 3.38Å; A601-H605 PolarHBondContact O-N 3.06Å
602	Y	87.6	Confident	78.6	Confident	47 Å²	47	88.6 Å²	88.6	18%	0.184	47%	0.472	C	S	.	.	H	α-helix	trans	-64.5	-47.5	171.9	171.2	-94	0	0	0	111.7	Y587 I588 C589 E598 S599 Q600 T604 H605 V606	Y587-Y602 HydrophobicContact CD1-CD1 4.43Å; Y587-Y602 HydrophobicContact CD1-CG 4.47Å; Y587-Y602 HydrophobicContact CG-CG 4.36Å; I588-Y602 WeakPolarHBondContact O-CE2 3.38Å; C589-Y602 HydrophobicContact CB-CE2 4.46Å; E598-Y602 PolarHBondContact O-N 3.21Å; S599-Y602 WeakPolarHBondContact O-CB 3.45Å; S599-Y602 PolarHBondContact O-N 3.3Å; Q600-Y602 VanDerWaalsContact C-N 3.32Å; Y602-T604 PolarHBondContact O-N 2.79Å; Y602-H605 PolarHBondContact O-N 3.17Å; Y602-V606 HydrophobicContact CE1-CG2 4.29Å; Y602-V606 HydrophobicContact CE2-CG2 4.18Å; Y602-V606 WeakPolarHBondContact O-CG2 3.28Å; Y602-V606 PolarHBondContact O-N 3.02Å
603	F	78.9	Confident	76.6	Confident	122 Å²	122	91.2 Å²	91.2	54%	0.535	50%	0.497	S	S	.	.	H	α-helix	trans	-70.8	-28.8	-179.9	-74.5	-60.2	0	0	0	114	S599 Q600 R607	S599-F603 WeakPolarHBondContact O-CD2 3.46Å; S599-F603 PolarHBondContact O-N 2.87Å; Q600-F603 PolarHBondContact O-N 3.46Å; F603-R607 VanDerWaalsContact O-CB 3.23Å; F603-R607 WeakPolarHBondContact O-CB 3.44Å; F603-R607 PolarHBondContact O-N 3.36Å
604	T	83.3	Confident	74.4	Confident	77 Å²	77	88.1 Å²	88.1	47%	0.472	49%	0.489	S	S	.	.	H	α-helix	trans	-72.3	-45	170.1	53.1	0	0	0	0	111.2	Q600 A601 Y602 V606 R607 V608	Q600-T604 WeakPolarHBondContact O-CG2 3.46Å; Q600-T604 PolarHBondContact O-N 3.27Å; Q600-T604 PolarHBondContact O-OG1 3.15Å; A601-T604 WeakPolarHBondContact CA-OG1 3.47Å; A601-T604 PolarHBondContact O-OG1 2.83Å; A601-T604 VanDerWaalsContact O-OG1 3.07Å; Y602-T604 PolarHBondContact O-N 2.79Å; T604-V606 PolarHBondContact O-N 3.39Å; T604-R607 PolarHBondContact O-N 3.27Å; T604-V608 WeakPolarHBondContact O-CB 3.44Å; T604-V608 WeakPolarHBondContact O-CG2 3.44Å; T604-V608 PolarHBondContact O-N 3.27Å
605	H	86.8	Confident	72.3	Confident	21 Å²	21	93.5 Å²	93.5	10%	0.097	51%	0.513	C	S	.	.	H	α-helix	trans	-52.6	-54.2	174.6	166.1	76.7	0	0	0	111.9	C589 C592 F594 A601 Y602 R607 V608 Q609 H610	C589-H605 PolarHBondContact SG-NE2 3.21Å; C592-H605 PolarHBondContact SG-CE1 3.26Å; C592-H605 PolarHBondContact SG-NE2 3.26Å; C592-H605 VanDerWaalsContact SG-NE2 3.37Å; F594-H605 VanDerWaalsContact CB-CE1 3.43Å; F594-H605 WeakPolarHBondContact CB-CE1 3.39Å; F594-H605 WeakPolarHBondContact CB-NE2 3.41Å; F594-H605 HydrophobicContact CD1-CB 3.73Å; F594-H605 AromaticContact CD1-CD2 3.44Å; F594-H605 VanDerWaalsContact CD1-CD2 3.44Å; F594-H605 WeakPolarHBondContact CD1-CD2 3.14Å; F594-H605 AromaticContact CD1-CG 3.3Å; F594-H605 AromaticContact CD1-ND1 3.72Å; F594-H605 AromaticContact CD1-NE2 3.95Å; F594-H605 AromaticContact CD2-ND1 3.84Å; F594-H605 HydrophobicContact CE1-CB 3.5Å; F594-H605 VanDerWaalsContact CE1-CB 3.5Å; F594-H605 AromaticContact CE1-CG 3.63Å; F594-H605 HydrophobicContact CG-CB 4.4Å; F594-H605 AromaticContact CG-CD2 3.82Å; F594-H605 AromaticContact CG-CE1 3.66Å; F594-H605 AromaticContact CG-CG 3.63Å; F594-H605 AromaticContact CG-ND1 3.52Å; F594-H605 AromaticContact CG-NE2 3.85Å; F594-H605 HydrophobicContact CZ-CB 4.01Å; A601-H605 WeakPolarHBondContact O-CB 3.38Å; A601-H605 PolarHBondContact O-N 3.06Å; Y602-H605 PolarHBondContact O-N 3.17Å; H605-R607 VanDerWaalsContact C-N 3.29Å; H605-R607 PolarHBondContact O-N 3.44Å; H605-V608 PolarHBondContact O-N 3.39Å; H605-Q609 WeakPolarHBondContact O-CB 3.3Å; H605-Q609 PolarHBondContact O-N 3.09Å; H605-H610 AromaticContact CE1-NE2 3.94Å; H605-H610 AromaticContact NE2-CD2 3.64Å; H605-H610 AromaticContact NE2-NE2 3.44Å; H605-H610 PolarHBondContact NE2-NE2 2.92Å
606	V	80.2	Confident	69.9	Low	42 Å²	42	97.6 Å²	97.6	26%	0.255	53%	0.532	S	S	.	.	H	α-helix	trans	-61.4	-37.2	179.9	174.7	0	0	0	0	111.8	Y602 T604 H610	Y602-V606 HydrophobicContact CE1-CG2 4.29Å; Y602-V606 HydrophobicContact CE2-CG2 4.18Å; Y602-V606 WeakPolarHBondContact O-CG2 3.28Å; Y602-V606 PolarHBondContact O-N 3.02Å; T604-V606 PolarHBondContact O-N 3.39Å; V606-H610 CarbonylContact O-C 3.27Å; V606-H610 WeakPolarHBondContact O-CA 3.27Å; V606-H610 WeakPolarHBondContact O-CB 3Å; V606-H610 PolarHBondContact O-N 3.23Å; V606-H610 VanDerWaalsContact O-N 3.16Å
607	R	74.7	Confident	67.1	Low	178 Å²	178	106.7 Å²	106.7	67%	0.672	56%	0.563	S	S	*	*	H	α-helix	trans	-72.9	-29.3	-179.1	-170	-177.2	-56.6	-171.9	2.4	113.9	F603 T604 H605 Q611	F603-R607 VanDerWaalsContact O-CB 3.23Å; F603-R607 WeakPolarHBondContact O-CB 3.44Å; F603-R607 PolarHBondContact O-N 3.36Å; T604-R607 PolarHBondContact O-N 3.27Å; H605-R607 VanDerWaalsContact C-N 3.29Å; H605-R607 PolarHBondContact O-N 3.44Å; R607-Q611 PolarHBondContact O-NE2 2.86Å; R607-Q611 VanDerWaalsContact O-NE2 3.09Å
608	V	77.8	Confident	64.8	Low	101 Å²	101	108.7 Å²	108.7	61%	0.612	57%	0.57	S	S	*	*	H	α-helix	trans	-94	-48	-177	175.5	0	0	0	0	111.5	T604 H605	T604-V608 WeakPolarHBondContact O-CB 3.44Å; T604-V608 WeakPolarHBondContact O-CG2 3.44Å; T604-V608 PolarHBondContact O-N 3.27Å; H605-V608 PolarHBondContact O-N 3.39Å
609	Q	70.1	Confident	62.2	Low	136 Å²	136	107.4 Å²	107.4	64%	0.636	58%	0.575	S	S	*	*	H	α-helix	trans	-88.6	-20.3	-175.1	-63.3	-67.2	-0.4	0	0	113.9	H605	H605-Q609 WeakPolarHBondContact O-CB 3.3Å; H605-Q609 PolarHBondContact O-N 3.09Å
610	H	78.3	Confident	59.9	Low	55 Å²	55	110 Å²	110	26%	0.255	59%	0.591	S	S	.	*	S	Bend	trans	-125.7	44.7	-177.4	-58	-54.4	0	0	0	111.9	C589 L591 C592 H605 V606 A612	C589-H610 VanDerWaalsContact SG-CD2 3.53Å; C589-H610 PolarHBondContact SG-NE2 3.19Å; L591-H610 HydrophobicContact CD1-CB 3.61Å; C592-H610 PolarHBondContact SG-NE2 3.04Å; H605-H610 AromaticContact CE1-NE2 3.94Å; H605-H610 AromaticContact NE2-CD2 3.64Å; H605-H610 AromaticContact NE2-NE2 3.44Å; H605-H610 PolarHBondContact NE2-NE2 2.92Å; V606-H610 CarbonylContact O-C 3.27Å; V606-H610 WeakPolarHBondContact O-CA 3.27Å; V606-H610 WeakPolarHBondContact O-CB 3Å; V606-H610 PolarHBondContact O-N 3.23Å; V606-H610 VanDerWaalsContact O-N 3.16Å; H610-A612 PolarHBondContact O-N 3.28Å
611	Q	62.8	Low	57.7	Low	156 Å²	156	109 Å²	109	73%	0.729	60%	0.595	S	S	*	*			trans	-71.4	100.7	179.7	-162.5	165.4	110.1	0	0	110.8	R607 A613	R607-Q611 PolarHBondContact O-NE2 2.86Å; R607-Q611 VanDerWaalsContact O-NE2 3.09Å; Q611-A613 PolarHBondContact O-N 3.48Å
612	A	43.3	Very low	55.4	Low	89 Å²	89	113.4 Å²	113.4	74%	0.736	62%	0.622	S	S	*	*			trans	-63.3	129.1	176.9	0	0	0	0	0	111	H610 S614	H610-A612 PolarHBondContact O-N 3.28Å; A612-S614 PolarHBondContact O-N 2.87Å
613	A	39.7	Very low	52.7	Low	107 Å²	107	116.3 Å²	116.3	88%	0.884	65%	0.648	S	S	*	*			trans	-70.5	86.4	179.8	0	0	0	0	0	111.5	Q611 K615	Q611-A613 PolarHBondContact O-N 3.48Å; A613-K615 PolarHBondContact O-N 2.84Å; A613-K615 VanDerWaalsContact O-N 3.13Å
614	S	32.5	Very low	50.7	Low	103 Å²	103	115.8 Å²	115.8	72%	0.72	66%	0.658	S	S	*	*			trans	-70.2	104.3	170.4	58.9	0	0	0	0	110	A612	A612-S614 PolarHBondContact O-N 2.87Å
615	K	41.7	Very low	48	Very low	188 Å²	188	117.1 Å²	117.1	82%	0.817	67%	0.67	S	S	*	*			trans	-59.7	158.4	148.3	-83.3	-175.3	172.1	-179.1	0	109.2	A613	A613-K615 PolarHBondContact O-N 2.84Å; A613-K615 VanDerWaalsContact O-N 3.13Å
616	D	34.1	Very low	45.2	Very low	163 Å²	163	121 Å²	121	87%	0.872	70%	0.699	S	S	*	*			trans	66.5	64.6	174.4	-50	-30.7	0	0	0	116
617	R	27	Very low	42.7	Very low	218 Å²	218	124.6 Å²	124.6	82%	0.823	73%	0.726	S	S	*	*			trans	-122.7	128.1	139.7	-166.6	-179.3	-172.3	-146.6	-0.2	109.4
618	P	35.9	Very low	40.4	Very low	117 Å²	117	120.8 Å²	120.8	76%	0.76	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-61.5	137.5	172	-21.8	33.3	0	0	0	111.3
619	S	27.1	Very low	37.9	Very low	105 Å²	105	121.2 Å²	121.2	73%	0.734	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-69.5	135.2	171.8	52.8	0	0	0	0	110.8
620	P	35.5	Very low	36.1	Very low	108 Å²	108	126 Å²	126	70%	0.701	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-61.5	141.1	167.7	-17	30.5	0	0	0	110.4	P622	P620-P622 WeakPolarHBondContact O-CD 3.42Å
621	V	34.1	Very low	33.6	Very low	132 Å²	132	126.8 Å²	126.8	80%	0.8	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-80	128.4	176.1	-164.1	0	0	0	0	109.7
622	P	32.4	Very low	31.8	Very low	117 Å²	117	128.4 Å²	128.4	76%	0.76	77%	0.766	S	S	*	*			trans	-109.1	101.9	164.4	33	-18.8	0	0	0	110	P620	P620-P622 WeakPolarHBondContact O-CD 3.42Å
623	S	31	Very low	31.1	Very low	107 Å²	107	131 Å²	131	75%	0.748	77%	0.767	S	S	*	*			trans	-92.8	133.4	158.2	-58.6	0	0	0	0	108.5
624	P	36.8	Very low	30.5	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	75%	0.753	S	S	*	*				-134.2	129.6	120.8	35.4	-26.4	0	0	0	113.7
625	S	26.5	Very low	30.2	Very low	104 Å²	104	130 Å²	130	73%	0.727	75%	0.754	S	S	*	*				37.4	106.2	122	-45.4	0	0	0	0	120.2
626	S	27.8	Very low	29.8	Very low	103 Å²	103	130 Å²	130	72%	0.72	75%	0.75	S	S	*	*				59.3	135	122.8	64.6	0	0	0	0	122.8
627	S	27.1	Very low	30.6	Very low	117 Å²	117	126.8 Å²	126.8	82%	0.818	74%	0.738	S	S	*	*			trans	69.7	150.9	149.6	73.2	0	0	0	0	118.3
628	S	27.2	Very low	30.8	Very low	99 Å²	99	125.2 Å²	125.2	69%	0.692	74%	0.737	S	S	*	*			cis	-159.6	170.5	-31	-155.3	0	0	0	0	109.8
629	D	25.5	Very low	30.6	Very low	110 Å²	110	127 Å²	127	59%	0.588	74%	0.739	S	S	*	*			trans	52.6	117.5	153.8	-77.1	-90.3	0	0	0	123.2
630	R	30.9	Very low	30.7	Very low	235 Å²	235	130.7 Å²	130.7	89%	0.887	74%	0.742	S	S	*	*			trans	78.6	143.7	130.2	-62.9	169.6	-174.1	-125.8	-4.6	122.4
631	G	26.3	Very low	30.6	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	75%	0.749	S	S	*	*			trans	111	75.9	166.6	0	0	0	0	0	114.6
632	F	24.7	Very low	30.4	Very low	191 Å²	191	132.5 Å²	132.5	84%	0.838	74%	0.744	S	S	*	*			cis	80.1	102.2	48.3	-107.3	-94.1	0	0	0	117
633	L	29.2	Very low	30.2	Very low	143 Å²	143	136.4 Å²	136.4	75%	0.749	75%	0.749	S	S	*	*			trans	66.1	158.1	160.6	-61.2	171.2	0	0	0	117.8
634	S	27.4	Very low	30.4	Very low	84 Å²	84	137.2 Å²	137.2	59%	0.587	75%	0.75	S	S	*	*			cis	-146.5	148	7.2	-166.7	0	0	0	0	109.1	Y636	S634-Y636 WeakPolarHBondContact OG-CD2 3.34Å
635	S	27.1	Very low	30.9	Very low	106 Å²	106	138 Å²	138	74%	0.741	76%	0.755	S	S	*	*				173.6	118.5	77.4	-170.6	0	0	0	0	107.8
636	Y	32.5	Very low	30.8	Very low	188 Å²	188	136.5 Å²	136.5	74%	0.737	76%	0.757	S	S	*	*				83.5	157	77.3	-77.6	-52.6	0	0	0	115.4	S634	S634-Y636 WeakPolarHBondContact OG-CD2 3.34Å
637	P	49.9	Very low	30.8	Very low	95 Å²	95	138.7 Å²	138.7	62%	0.617	76%	0.759	S	S	*	*				-146.9	-173.1	-71.3	35.6	-12.8	0	0	0	117.6
638	K	31.5	Very low	30.8	Very low	185 Å²	185	141.3 Å²	141.3	80%	0.804	76%	0.756	S	S	*	*			trans	129.7	153.3	144.7	-70.6	159.8	-175.7	175.5	0	113.5
639	L	31.5	Very low	30.8	Very low	154 Å²	154	143.2 Å²	143.2	81%	0.806	76%	0.763	S	S	*	*			cis	-175	160.3	-26.2	-101.8	175.8	0	0	0	105.8
640	K	30.3	Very low	30.6	Very low	182 Å²	182	143.1 Å²	143.1	79%	0.791	77%	0.772	S	S	*	*			cis	-120.3	-152.4	2.9	-62.4	176	-179.3	175.1	0	108.3
641	K	33.8	Very low	31.4	Very low	193 Å²	193	136.5 Å²	136.5	84%	0.839	76%	0.759	S	S	*	*			cis	73.7	146.2	3.7	-58.5	-170.3	176.6	-177.1	0	118.3
642	A	29	Very low	31.6	Very low	85 Å²	85	140.6 Å²	140.6	70%	0.702	76%	0.764	S	S	*	*			cis	-156.9	154.3	16.7	0	0	0	0	0	115.3
643	F	29.1	Very low	31.8	Very low	199 Å²	199	135 Å²	135	87%	0.873	75%	0.753	S	S	*	*			trans	39.4	158.3	143.6	-75	-84.2	0	0	0	126.5
644	T	33.5	Very low	31.9	Very low	124 Å²	124	138.1 Å²	138.1	76%	0.761	76%	0.757	S	S	*	*			trans	-89.1	-170.4	179	53.4	0	0	0	0	112.4
645	P	47.3	Very low	32.3	Very low	128 Å²	128	141.3 Å²	141.3	83%	0.831	77%	0.766	S	S	*	*			cis	-134.9	-169.8	-0.7	44.1	-26.1	0	0	0	115.3
646	G	26.3	Very low	32.3	Very low	74 Å²	74	141.6 Å²	141.6	76%	0.763	77%	0.768	S	S	*	*			trans	171.9	147.8	165.8	0	0	0	0	0	117
647	L	27.6	Very low	32.1	Very low	148 Å²	148	137.5 Å²	137.5	78%	0.775	77%	0.773	S	S	*	*			trans	-100.7	142.2	-172	-96.1	70.1	0	0	0	115.3
648	K	26.1	Very low	31.3	Very low	172 Å²	172	143.2 Å²	143.2	75%	0.748	78%	0.782	S	S	*	*			trans	58.5	142.4	135	-61.5	-176.9	-176	178.8	0	123.7
649	T	26.4	Very low	31.3	Very low	139 Å²	139	140 Å²	140	85%	0.853	78%	0.78	S	S	*	*			trans	82.7	135	139.7	37.3	0	0	0	0	123.2
650	S	22.2	Very low	31.1	Very low	109 Å²	109	136.5 Å²	136.5	76%	0.762	77%	0.769	S	S	*	*			trans	-82.3	-174.4	165.7	-140.4	0	0	0	0	110.3
651	P	47.4	Very low	31.2	Very low	96 Å²	96	133.4 Å²	133.4	62%	0.623	77%	0.77	S	S	*	*			cis	-142.1	175.9	3.6	43.1	-24.7	0	0	0	118.2
652	N	31.4	Very low	30.9	Very low	158 Å²	158	129 Å²	129	85%	0.845	76%	0.764	S	S	*	*			trans	62.6	149.5	144.6	-76.8	-15.9	0	0	0	121.2
653	A	29.4	Very low	30.8	Very low	74 Å²	74	132 Å²	132	61%	0.612	77%	0.768	S	S	*	*			cis	-165.4	-179.2	-8.9	0	0	0	0	0	112.6
654	Y	29.5	Very low	31.6	Very low	208 Å²	208	127.1 Å²	127.1	82%	0.816	76%	0.756	S	S	*	*			trans	81.3	101.2	161.3	-83.8	-85.5	0	0	0	121.7
655	L	36.3	Very low	31.3	Very low	151 Å²	151	127.1 Å²	127.1	79%	0.791	76%	0.756	S	S	*	*			trans	50.4	144.2	137.3	-56.4	-178.1	0	0	0	120.5
656	S	28.1	Very low	30.3	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	75%	0.753	S	S	*	*			cis	-156.3	-174.2	18.5	-154.7	0	0	0	0	113.6
657	A	28.2	Very low	30.3	Very low	101 Å²	101	132 Å²	132	84%	0.835	75%	0.753	S	S	*	*			trans	82	156.5	172.7	0	0	0	0	0	118.5
658	R	31.6	Very low	31.3	Very low	215 Å²	215	130.4 Å²	130.4	81%	0.811	75%	0.751	S	S	*	*			trans	-142.8	158.2	-164.6	-131.9	-173.7	-175	-157.9	3.9	109.3
659	P	32.3	Very low	31.3	Very low	117 Å²	117	131 Å²	131	76%	0.76	76%	0.759	S	S	*	*				-142.3	114.6	78.2	30	-9.9	0	0	0	113.8
660	S	28.5	Very low	31.5	Very low	81 Å²	81	130.8 Å²	130.8	57%	0.566	75%	0.753	S	S	*	*				66.9	116.2	93.3	66.3	0	0	0	0	115.5
661	S	30.6	Very low	32	Very low	117 Å²	117	132.2 Å²	132.2	82%	0.818	75%	0.751	S	S	*	*			trans	-118.7	-175.1	-162.5	60.1	0	0	0	0	114.5
662	S	27.5	Very low	31.2	Very low	101 Å²	101	132.7 Å²	132.7	71%	0.706	76%	0.755	S	S	*	*			trans	-61	167.7	161.9	53.8	0	0	0	0	114.8
663	D	27.4	Very low	31.1	Very low	149 Å²	149	132.2 Å²	132.2	80%	0.797	76%	0.758	S	S	*	*			trans	-12.5	162.3	145.3	-94.1	-46.4	0	0	0	119.3
664	P	46.2	Very low	31.2	Very low	96 Å²	96	140 Å²	140	62%	0.623	77%	0.771	S	S	*	*			cis	-143.4	-159.8	12.7	37.5	-14.5	0	0	0	116.2
665	T	26.9	Very low	31.2	Very low	123 Å²	123	134.4 Å²	134.4	76%	0.755	77%	0.769	S	S	*	*			trans	69.4	158.2	148.8	47	0	0	0	0	120.5
666	M	27.4	Very low	30.8	Very low	157 Å²	157	135.2 Å²	135.2	77%	0.773	77%	0.774	S	S	*	*			cis	-172.2	167	-28.5	-111.7	-69.6	-137.2	0	0	109.9
667	I	26.4	Very low	30.8	Very low	149 Å²	149	133.2 Å²	133.2	76%	0.764	77%	0.771	S	S	*	*			trans	76.6	154	152.1	-78.6	163.9	0	0	0	119.6
668	P	47	Very low	30.9	Very low	113 Å²	113	135.1 Å²	135.1	73%	0.734	77%	0.765	S	S	*	*			trans	-129.3	-150.3	-155.5	44.3	-25.8	0	0	0	115.6
669	M	25.7	Very low	30.7	Very low	184 Å²	184	136.4 Å²	136.4	91%	0.906	77%	0.77	S	S	*	*			trans	98.4	168.7	177.8	-64.7	-64	-166.5	0	0	117.2
670	D	31.9	Very low	30.5	Very low	136 Å²	136	134 Å²	134	73%	0.727	77%	0.766	S	S	*	*				-144	163.8	-125	-163	19.5	0	0	0	117.4
671	L	31.7	Very low	31.1	Very low	139 Å²	139	137.6 Å²	137.6	73%	0.728	79%	0.785	S	S	*	*			trans	69.6	142.3	156.4	-83.5	168.2	0	0	0	125.6
672	C	32.1	Very low	30.8	Very low	105 Å²	105	136.6 Å²	136.6	71%	0.709	78%	0.783	S	S	*	*			trans	78.6	118.2	143	-83.3	0	0	0	0	124.2
673	V	28.2	Very low	31.4	Very low	148 Å²	148	137.5 Å²	137.5	90%	0.897	79%	0.789	S	S	*	*				-148.3	160	126.4	168.8	0	0	0	0	109
674	R	32.4	Very low	31.4	Very low	237 Å²	237	138.2 Å²	138.2	89%	0.894	79%	0.792	S	S	*	*			trans	-116.8	154.3	-167	-64.2	165.1	-80	-156.9	-8.5	114.2
675	A	28	Very low	30.9	Very low	92 Å²	92	139.6 Å²	139.6	76%	0.76	80%	0.799	S	S	*	*			trans	-164.8	120.7	144.9	0	0	0	0	0	115.5
676	N	28.6	Very low	31.3	Very low	168 Å²	168	142.1 Å²	142.1	90%	0.898	81%	0.807	S	S	*	*			trans	38.6	112.4	143.6	-55.2	-6.8	0	0	0	123.7
677	G	27.1	Very low	31.5	Very low	70 Å²	70	139.5 Å²	139.5	72%	0.722	80%	0.795	S	S	*	*				113.2	122.8	95.6	0	0	0	0	0	122.4
678	I	30.7	Very low	32.2	Very low	141 Å²	141	140.5 Å²	140.5	72%	0.723	79%	0.794	S	S	*	*			trans	79.5	115.9	146.9	-52.1	174.6	0	0	0	120
679	R	28.5	Very low	32	Very low	242 Å²	242	142.3 Å²	142.3	91%	0.913	79%	0.791	S	S	*	*			trans	59.9	150.2	162.9	-76	177.6	-93	-127	-3.4	117
680	G	27.5	Very low	32.8	Very low	65 Å²	65	141.4 Å²	141.4	67%	0.67	79%	0.79	S	S	*	*			cis	166.1	130.5	-7.3	0	0	0	0	0	111.6
681	V	40.3	Very low	33.9	Very low	158 Å²	158	141 Å²	141	96%	0.958	79%	0.787	S	S	*	*			trans	21.3	96.3	170	-168.5	0	0	0	0	117.6
682	A	26.3	Very low	34.9	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	78%	0.78	S	S	*	*			trans	-155.4	123.5	152.5	0	0	0	0	0	111.9
683	S	38.5	Very low	36.4	Very low	120 Å²	120	136.5 Å²	136.5	84%	0.839	77%	0.766	S	S	*	*			trans	-80.3	133.4	158.6	-59.6	0	0	0	0	108.9
684	I	27.8	Very low	38.4	Very low	165 Å²	165	132.8 Å²	132.8	85%	0.846	74%	0.739	S	S	*	*			trans	-155.5	144	150.3	-96.9	135.2	0	0	0	109.6
685	T	36.4	Very low	40.5	Very low	125 Å²	125	129.2 Å²	129.2	77%	0.767	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-47.6	138	-173.1	50.1	0	0	0	0	117.3
686	L	34.5	Very low	43	Very low	176 Å²	176	125.3 Å²	125.3	92%	0.921	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-95.5	148.6	147.4	-153.6	79.6	0	0	0	110.3
687	D	32.8	Very low	45.2	Very low	101 Å²	101	122.4 Å²	122.4	54%	0.54	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-93.4	118.8	-147.5	-144.2	-21.9	0	0	0	114.9	K689	D687-K689 VanDerWaalsContact C-N 3.29Å; D687-K689 VanDerWaalsContact CG-CE 3.49Å; D687-K689 PolarHBondContact O-N 3.09Å; D687-K689 VanDerWaalsContact O-N 3.16Å; D687-K689 VanDerWaalsContact OD1-CD 3.26Å; D687-K689 WeakPolarHBondContact OD1-CD 3.49Å; D687-K689 WeakPolarHBondContact OD1-CE 3.39Å; D687-K689 WeakPolarHBondContact OD1-CG 3.48Å; D687-K689 IonicContact OD1-NZ 2.66Å; D687-K689 PolarHBondContact OD1-NZ 3.3Å; D687-K689 WeakPolarHBondContact OD2-CD 3.37Å; D687-K689 VanDerWaalsContact OD2-CE 3.24Å; D687-K689 WeakPolarHBondContact OD2-CE 3.33Å; D687-K689 IonicContact OD2-NZ 3.23Å; D687-K689 PolarHBondContact OD2-NZ 3.21Å
688	K	39.3	Very low	47.3	Very low	171 Å²	171	124.5 Å²	124.5	74%	0.743	68%	0.679	S	S	*	*			trans	-89.9	53.1	179.8	-69.5	-177.4	180	173.5	0	112.3
689	K	42.8	Very low	49.7	Very low	150 Å²	150	119.9 Å²	119.9	65%	0.652	66%	0.659	S	S	*	*			trans	-96.8	155.9	177	-71.2	167.4	-171.9	156.9	0	111.2	D687	D687-K689 VanDerWaalsContact C-N 3.29Å; D687-K689 VanDerWaalsContact CG-CE 3.49Å; D687-K689 PolarHBondContact O-N 3.09Å; D687-K689 VanDerWaalsContact O-N 3.16Å; D687-K689 VanDerWaalsContact OD1-CD 3.26Å; D687-K689 WeakPolarHBondContact OD1-CD 3.49Å; D687-K689 WeakPolarHBondContact OD1-CE 3.39Å; D687-K689 WeakPolarHBondContact OD1-CG 3.48Å; D687-K689 IonicContact OD1-NZ 2.66Å; D687-K689 PolarHBondContact OD1-NZ 3.3Å; D687-K689 WeakPolarHBondContact OD2-CD 3.37Å; D687-K689 VanDerWaalsContact OD2-CE 3.24Å; D687-K689 WeakPolarHBondContact OD2-CE 3.33Å; D687-K689 IonicContact OD2-NZ 3.23Å; D687-K689 PolarHBondContact OD2-NZ 3.21Å
690	N	44.5	Very low	51.8	Low	166 Å²	166	114.6 Å²	114.6	89%	0.888	66%	0.659	S	S	*	*	S	Bend	trans	71.4	36.3	178.9	-53.8	-16.4	0	0	0	117.7
691	L	53.6	Low	54.1	Low	127 Å²	127	115 Å²	115	67%	0.665	64%	0.643	S	S	*	*	S	Bend	trans	-131.2	124.9	153.9	-93.6	162	0	0	0	108.7	S693	L691-S693 PolarHBondContact O-N 3.11Å
692	P	53.1	Low	56	Low	91 Å²	91	110.3 Å²	110.3	59%	0.591	62%	0.617	S	S	*	*			trans	-59.7	129.9	-176.2	-25.9	35.2	0	0	0	113.2
693	S	63.5	Low	58.5	Low	58 Å²	58	106.5 Å²	106.5	41%	0.406	58%	0.584	S	S	.	*			trans	-102.8	114.2	170.6	-174.5	0	0	0	0	109.3	L691 K695	L691-S693 PolarHBondContact O-N 3.11Å; S693-K695 PolarHBondContact O-N 3.39Å
694	H	70.3	Confident	60.3	Low	71 Å²	71	106.6 Å²	106.6	33%	0.329	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.9	112.6	179.1	-59.9	-84.3	0	0	0	109	S702 T703 L709	H694-S702 WeakPolarHBondContact O-CA 3.38Å; H694-T703 PolarHBondContact N-O 2.63Å; H694-T703 PolarHBondContact O-N 3.01Å; H694-L709 HydrophobicContact CB-CD2 3.61Å
695	K	77.6	Confident	62.4	Low	161 Å²	161	105.6 Å²	105.6	70%	0.7	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87	143.6	177.5	-56.7	-170.8	178.3	-178.9	0	110.5	S693	S693-K695 PolarHBondContact O-N 3.39Å
696	C	80.4	Confident	64.1	Low	11 Å²	11	101.5 Å²	101.5	7%	0.074	53%	0.528	C	S	.	.			trans	-71.2	136.5	170.4	-161.2	0	0	0	0	110	F698 C699 H701 L709	C696-F698 PolarHBondContact O-N 2.82Å; C696-C699 VanDerWaalsContact CB-SG 3.59Å; C696-H701 WeakPolarHBondContact CB-O 3.46Å; C696-H701 PolarHBondContact N-O 3.18Å; C696-L709 HydrophobicContact CB-CD1 3.76Å
697	S	74.3	Confident	66.3	Low	107 Å²	107	97.1 Å²	97.1	75%	0.748	50%	0.503	S	S	*	.	S	Bend	trans	-76.7	-1.5	175.6	-41.9	0	0	0	0	113.5
698	F	70.7	Confident	68.6	Low	114 Å²	114	95.4 Å²	95.4	50%	0.5	50%	0.496	S	S	.	.	S	Bend	trans	-124.7	-5.6	-169.7	-62.3	-88.9	0	0	0	113.8	C696 Q713 H717 I719	C696-F698 PolarHBondContact O-N 2.82Å; F698-Q713 HydrophobicContact CD2-CG 4.38Å; F698-Q713 VanDerWaalsContact CE2-NE2 3.3Å; F698-H717 HydrophobicContact CB-CB 4.44Å; F698-H717 PolarHBondContact O-CE1 3.35Å; F698-I719 HydrophobicContact CD1-CD1 3.83Å; F698-I719 HydrophobicContact CD2-CD1 3.53Å; F698-I719 HydrophobicContact CE1-CD1 3.68Å; F698-I719 HydrophobicContact CE2-CD1 3.39Å; F698-I719 HydrophobicContact CG-CD1 3.77Å; F698-I719 HydrophobicContact CZ-CD1 3.46Å; F698-I719 VanDerWaalsContact CZ-CD1 3.46Å
699	C	80.9	Confident	70.4	Confident	44 Å²	44	87.8 Å²	87.8	30%	0.297	46%	0.463	S	S	.	.	S	Bend	trans	-162.7	172.5	175.6	65.6	0	0	0	0	110.4	C696 H701 H712 H717	C696-C699 VanDerWaalsContact CB-SG 3.59Å; C699-H701 PolarHBondContact O-N 2.77Å; C699-H701 WeakPolarHBondContact SG-CB 3.45Å; C699-H712 PolarHBondContact SG-NE2 3.14Å; C699-H717 WeakPolarHBondContact CB-NE2 3.42Å; C699-H717 PolarHBondContact SG-NE2 3.04Å
700	S	73.5	Confident	72	Confident	130 Å²	130	82.5 Å²	82.5	91%	0.909	44%	0.439	S	S	*	.	S	Bend	trans	-70.5	-3	177.5	50.3	0	0	0	0	115.1	S702	S700-S702 PolarHBondContact O-N 3.18Å
701	H	75.4	Confident	73.5	Confident	73 Å²	73	79.8 Å²	79.8	34%	0.338	42%	0.423	S	S	.	.			trans	-67.3	131.8	-178.4	-167.1	-96.6	0	0	0	111.5	C696 C699 T703 H712	C696-H701 WeakPolarHBondContact CB-O 3.46Å; C696-H701 PolarHBondContact N-O 3.18Å; C699-H701 PolarHBondContact O-N 2.77Å; C699-H701 WeakPolarHBondContact SG-CB 3.45Å; H701-T703 WeakPolarHBondContact CE1-CG2 3.44Å; H701-H712 AromaticContact CD2-CE1 3.63Å; H701-H712 AromaticContact CD2-ND1 3.82Å; H701-H712 AromaticContact CE1-CG 3.95Å; H701-H712 AromaticContact CE1-ND1 3.52Å; H701-H712 AromaticContact CG-CE1 3.44Å; H701-H712 VanDerWaalsContact CG-CE1 3.44Å; H701-H712 AromaticContact CG-ND1 3.66Å; H701-H712 AromaticContact CG-NE2 3.76Å; H701-H712 AromaticContact ND1-CD2 3.97Å; H701-H712 AromaticContact ND1-CE1 3.74Å; H701-H712 AromaticContact ND1-CG 3.63Å; H701-H712 AromaticContact ND1-ND1 3.47Å; H701-H712 PolarHBondContact ND1-ND1 2.83Å; H701-H712 AromaticContact NE2-ND1 3.74Å
702	S	79.9	Confident	74.8	Confident	60 Å²	60	75.9 Å²	75.9	42%	0.42	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	139.4	177.2	63.5	0	0	0	0	111.1	H694 S700	H694-S702 WeakPolarHBondContact O-CA 3.38Å; S700-S702 PolarHBondContact O-N 3.18Å
703	T	79.5	Confident	75.8	Confident	16 Å²	16	73 Å²	73	10%	0.098	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156.3	-177.5	64.8	0	0	0	0	110.8	H694 H701 Y705 V708	H694-T703 PolarHBondContact N-O 2.63Å; H694-T703 PolarHBondContact O-N 3.01Å; H701-T703 WeakPolarHBondContact CE1-CG2 3.44Å; T703-Y705 PolarHBondContact OG1-O 3.09Å; T703-V708 HydrophobicContact CG2-CB 4.31Å; T703-V708 HydrophobicContact CG2-CG1 3.98Å
704	R	75.1	Confident	76.3	Confident	122 Å²	122	72 Å²	72	46%	0.46	37%	0.371	S	S	.	.	S	Bend	trans	-87.3	5	170	-62.2	175.8	-178.1	-107.2	-9	112.4
705	Y	72.2	Confident	76.4	Confident	144 Å²	144	73.8 Å²	73.8	57%	0.565	39%	0.387	S	S	*	.			trans	-134.6	108.5	-166.5	-67.1	-70.5	0	0	0	109.7	T703 E707 V708 L709	T703-Y705 PolarHBondContact OG1-O 3.09Å; Y705-E707 VanDerWaalsContact C-N 3.35Å; Y705-E707 WeakPolarHBondContact CB-OE1 3.42Å; Y705-E707 PolarHBondContact O-N 3.33Å; Y705-V708 PolarHBondContact O-N 3.38Å; Y705-L709 PolarHBondContact O-N 2.97Å; Y705-L709 VanDerWaalsContact O-N 3.13Å
706	P	72.8	Confident	76.2	Confident	38 Å²	38	69.2 Å²	69.2	25%	0.247	38%	0.379	C	S	.	.	H	α-helix	trans	-62	-35.8	-174.2	-24.4	33.8	0	0	0	114.4	L709 W710 L726	P706-L709 WeakPolarHBondContact O-CB 3.47Å; P706-L709 PolarHBondContact O-N 3.36Å; P706-W710 PolarHBondContact O-N 2.87Å; P706-L726 HydrophobicContact CB-CD2 4.2Å
707	E	79.6	Confident	75.7	Confident	84 Å²	84	71.9 Å²	71.9	39%	0.393	39%	0.39	S	S	.	.	H	α-helix	trans	-67.4	-35.6	178	65.3	-70.8	167.3	0	0	112.2	Y705 L709 W710 M711 P728	Y705-E707 VanDerWaalsContact C-N 3.35Å; Y705-E707 WeakPolarHBondContact CB-OE1 3.42Å; Y705-E707 PolarHBondContact O-N 3.33Å; E707-L709 VanDerWaalsContact C-N 3.34Å; E707-W710 PolarHBondContact O-N 3.45Å; E707-M711 WeakPolarHBondContact O-CB 3.21Å; E707-M711 PolarHBondContact O-N 3.17Å; E707-P728 HydrophobicContact CB-CG 4.21Å
708	V	80.8	Confident	75.2	Confident	66 Å²	66	77.1 Å²	77.1	40%	0.4	39%	0.394	S	S	.	.	H	α-helix	trans	-69	-35.6	171.9	-173.9	0	0	0	0	110.4	T703 Y705 H712	T703-V708 HydrophobicContact CG2-CB 4.31Å; T703-V708 HydrophobicContact CG2-CG1 3.98Å; Y705-V708 PolarHBondContact O-N 3.38Å; V708-H712 WeakPolarHBondContact O-CB 3.41Å; V708-H712 PolarHBondContact O-N 3.32Å
709	L	77.8	Confident	75	Confident	10 Å²	10	73.9 Å²	73.9	5%	0.052	38%	0.381	C	S	.	.	H	α-helix	trans	-66.6	-43	173.5	-170.5	62.6	0	0	0	111.8	H694 C696 Y705 P706 E707 H712 Q713	H694-L709 HydrophobicContact CB-CD2 3.61Å; C696-L709 HydrophobicContact CB-CD1 3.76Å; Y705-L709 PolarHBondContact O-N 2.97Å; Y705-L709 VanDerWaalsContact O-N 3.13Å; P706-L709 WeakPolarHBondContact O-CB 3.47Å; P706-L709 PolarHBondContact O-N 3.36Å; E707-L709 VanDerWaalsContact C-N 3.34Å; L709-H712 PolarHBondContact O-N 3.38Å; L709-Q713 VanDerWaalsContact O-CB 3.28Å; L709-Q713 WeakPolarHBondContact O-CB 3.32Å; L709-Q713 PolarHBondContact O-N 3.36Å
710	W	77.3	Confident	73.9	Confident	39 Å²	39	78.9 Å²	78.9	15%	0.148	41%	0.405	C	S	.	.	H	α-helix	trans	-63.2	-41.9	176.7	-174.6	86.8	0	0	0	111.5	P706 E707 Q713 T714 S724 A727 A731	P706-W710 PolarHBondContact O-N 2.87Å; E707-W710 PolarHBondContact O-N 3.45Å; W710-Q713 PolarHBondContact O-N 3.25Å; W710-T714 HydrophobicContact CD2-CG2 4.06Å; W710-T714 HydrophobicContact CE3-CG2 4.39Å; W710-T714 HydrophobicContact CH2-CG2 4.36Å; W710-T714 HydrophobicContact CZ2-CG2 4.01Å; W710-T714 WeakPolarHBondContact O-CB 3.5Å; W710-T714 VanDerWaalsContact O-CG2 3.27Å; W710-T714 WeakPolarHBondContact O-CG2 3.27Å; W710-T714 PolarHBondContact O-N 2.94Å; W710-T714 PolarHBondContact O-OG1 3.49Å; W710-S724 PolarHBondContact NE1-OG 3.47Å; W710-A727 HydrophobicContact CZ2-CB 4.17Å; W710-A731 HydrophobicContact CH2-CB 4.35Å
711	M	74.9	Confident	72.8	Confident	109 Å²	109	73.8 Å²	73.8	54%	0.537	37%	0.369	S	S	.	.	H	α-helix	trans	-62.6	-44.2	171	-79.9	177.4	52.3	0	0	112.3	E707 Q713 T714 V715	E707-M711 WeakPolarHBondContact O-CB 3.21Å; E707-M711 PolarHBondContact O-N 3.17Å; M711-Q713 PolarHBondContact O-N 3.34Å; M711-T714 WeakPolarHBondContact CA-OG1 3.34Å; M711-T714 PolarHBondContact O-N 2.95Å; M711-T714 PolarHBondContact O-OG1 3.22Å; M711-T714 VanDerWaalsContact O-OG1 3.13Å; M711-V715 VanDerWaalsContact O-CB 3.25Å; M711-V715 WeakPolarHBondContact O-CB 3.3Å; M711-V715 VanDerWaalsContact O-CG2 3.27Å; M711-V715 WeakPolarHBondContact O-CG2 3.15Å; M711-V715 PolarHBondContact O-N 3.46Å
712	H	81.5	Confident	71.5	Confident	45 Å²	45	75.1 Å²	75.1	21%	0.208	39%	0.387	C	S	.	.	H	α-helix	trans	-60.7	-45.5	176.2	-173.6	94.4	0	0	0	111.6	C699 H701 V708 L709 V715 A716 H717	C699-H712 PolarHBondContact SG-NE2 3.14Å; H701-H712 AromaticContact CD2-CE1 3.63Å; H701-H712 AromaticContact CD2-ND1 3.82Å; H701-H712 AromaticContact CE1-CG 3.95Å; H701-H712 AromaticContact CE1-ND1 3.52Å; H701-H712 AromaticContact CG-CE1 3.44Å; H701-H712 VanDerWaalsContact CG-CE1 3.44Å; H701-H712 AromaticContact CG-ND1 3.66Å; H701-H712 AromaticContact CG-NE2 3.76Å; H701-H712 AromaticContact ND1-CD2 3.97Å; H701-H712 AromaticContact ND1-CE1 3.74Å; H701-H712 AromaticContact ND1-CG 3.63Å; H701-H712 AromaticContact ND1-ND1 3.47Å; H701-H712 PolarHBondContact ND1-ND1 2.83Å; H701-H712 AromaticContact NE2-ND1 3.74Å; V708-H712 WeakPolarHBondContact O-CB 3.41Å; V708-H712 PolarHBondContact O-N 3.32Å; L709-H712 PolarHBondContact O-N 3.38Å; H712-V715 PolarHBondContact O-N 3.39Å; H712-A716 VanDerWaalsContact O-CB 3.23Å; H712-A716 WeakPolarHBondContact O-CB 3.39Å; H712-A716 PolarHBondContact O-N 3.48Å; H712-H717 AromaticContact NE2-NE2 3.97Å
713	Q	74.3	Confident	70	Confident	31 Å²	31	77.6 Å²	77.6	15%	0.145	40%	0.404	C	S	.	.	H	α-helix	trans	-69	-36.6	-178.7	-167.8	178.3	10.3	0	0	112.9	F698 L709 W710 M711 H717 I719	F698-Q713 HydrophobicContact CD2-CG 4.38Å; F698-Q713 VanDerWaalsContact CE2-NE2 3.3Å; L709-Q713 VanDerWaalsContact O-CB 3.28Å; L709-Q713 WeakPolarHBondContact O-CB 3.32Å; L709-Q713 PolarHBondContact O-N 3.36Å; W710-Q713 PolarHBondContact O-N 3.25Å; M711-Q713 PolarHBondContact O-N 3.34Å; Q713-H717 WeakPolarHBondContact O-CB 3.41Å; Q713-I719 HydrophobicContact CG-CB 4.24Å; Q713-I719 HydrophobicContact CG-CD1 3.85Å; Q713-I719 HydrophobicContact CG-CG1 4.36Å; Q713-I719 PolarHBondContact O-N 3.02Å
714	T	73.1	Confident	68.4	Low	37 Å²	37	78.4 Å²	78.4	23%	0.227	41%	0.41	C	S	.	.	H	α-helix	trans	-76.7	-33.5	176.1	51.7	0	0	0	0	112.9	W710 M711 R718 I719	W710-T714 HydrophobicContact CD2-CG2 4.06Å; W710-T714 HydrophobicContact CE3-CG2 4.39Å; W710-T714 HydrophobicContact CH2-CG2 4.36Å; W710-T714 HydrophobicContact CZ2-CG2 4.01Å; W710-T714 WeakPolarHBondContact O-CB 3.5Å; W710-T714 VanDerWaalsContact O-CG2 3.27Å; W710-T714 WeakPolarHBondContact O-CG2 3.27Å; W710-T714 PolarHBondContact O-N 2.94Å; W710-T714 PolarHBondContact O-OG1 3.49Å; M711-T714 WeakPolarHBondContact CA-OG1 3.34Å; M711-T714 PolarHBondContact O-N 2.95Å; M711-T714 PolarHBondContact O-OG1 3.22Å; M711-T714 VanDerWaalsContact O-OG1 3.13Å; T714-R718 VanDerWaalsContact O-CA 3.25Å; T714-R718 WeakPolarHBondContact O-CA 3.37Å; T714-R718 PolarHBondContact O-N 2.76Å; T714-I719 WeakPolarHBondContact CG2-O 3.42Å
715	V	73.9	Confident	67.1	Low	109 Å²	109	80.6 Å²	80.6	66%	0.661	43%	0.431	S	S	*	.	H	α-helix	trans	-90.2	-53.1	-176.9	177.4	0	0	0	0	112.5	M711 H712	M711-V715 VanDerWaalsContact O-CB 3.25Å; M711-V715 WeakPolarHBondContact O-CB 3.3Å; M711-V715 VanDerWaalsContact O-CG2 3.27Å; M711-V715 WeakPolarHBondContact O-CG2 3.15Å; M711-V715 PolarHBondContact O-N 3.46Å; H712-V715 PolarHBondContact O-N 3.39Å
716	A	71.3	Confident	66.2	Low	65 Å²	65	77.5 Å²	77.5	54%	0.537	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-43	-175.9	0	0	0	0	0	112.1	H712	H712-A716 VanDerWaalsContact O-CB 3.23Å; H712-A716 WeakPolarHBondContact O-CB 3.39Å; H712-A716 PolarHBondContact O-N 3.48Å
717	H	71.4	Confident	65.2	Low	66 Å²	66	77.7 Å²	77.7	31%	0.306	43%	0.429	S	S	.	.	S	Bend	trans	-98.3	-0.2	-178.5	-61.6	-77	0	0	0	114	F698 C699 H712 Q713 I719	F698-H717 HydrophobicContact CB-CB 4.44Å; F698-H717 PolarHBondContact O-CE1 3.35Å; C699-H717 WeakPolarHBondContact CB-NE2 3.42Å; C699-H717 PolarHBondContact SG-NE2 3.04Å; H712-H717 AromaticContact NE2-NE2 3.97Å; Q713-H717 WeakPolarHBondContact O-CB 3.41Å; H717-I719 HydrophobicContact CB-CD1 3.99Å; H717-I719 HydrophobicContact CB-CG1 3.83Å; H717-I719 WeakPolarHBondContact O-CG1 3.41Å; H717-I719 PolarHBondContact O-N 3.47Å; H717-I719 VanDerWaalsContact O-N 3.11Å
718	R	63.9	Low	63.9	Low	217 Å²	217	75.1 Å²	75.1	82%	0.819	42%	0.42	S	S	*	.			trans	53.1	28.8	179.6	-64	-173	172.4	-167.6	-1.1	114.4	T714 N720	T714-R718 VanDerWaalsContact O-CA 3.25Å; T714-R718 WeakPolarHBondContact O-CA 3.37Å; T714-R718 PolarHBondContact O-N 2.76Å; R718-N720 PolarHBondContact O-N 3.5Å
719	I	65.4	Low	62.2	Low	47 Å²	47	82.8 Å²	82.8	24%	0.241	45%	0.447	C	S	.	.			trans	-78.9	111.8	-178.3	-55.7	-174.5	0	0	0	108.7	F698 Q713 T714 H717 S721	F698-I719 HydrophobicContact CD1-CD1 3.83Å; F698-I719 HydrophobicContact CD2-CD1 3.53Å; F698-I719 HydrophobicContact CE1-CD1 3.68Å; F698-I719 HydrophobicContact CE2-CD1 3.39Å; F698-I719 HydrophobicContact CG-CD1 3.77Å; F698-I719 HydrophobicContact CZ-CD1 3.46Å; F698-I719 VanDerWaalsContact CZ-CD1 3.46Å; Q713-I719 HydrophobicContact CG-CB 4.24Å; Q713-I719 HydrophobicContact CG-CD1 3.85Å; Q713-I719 HydrophobicContact CG-CG1 4.36Å; Q713-I719 PolarHBondContact O-N 3.02Å; T714-I719 WeakPolarHBondContact CG2-O 3.42Å; H717-I719 HydrophobicContact CB-CD1 3.99Å; H717-I719 HydrophobicContact CB-CG1 3.83Å; H717-I719 WeakPolarHBondContact O-CG1 3.41Å; H717-I719 PolarHBondContact O-N 3.47Å; H717-I719 VanDerWaalsContact O-N 3.11Å; I719-S721 VanDerWaalsContact C-N 3.26Å; I719-S721 WeakPolarHBondContact CG2-OG 3.35Å; I719-S721 PolarHBondContact O-N 3.25Å; I719-S721 PolarHBondContact O-OG 3.11Å
720	N	57.9	Low	60.7	Low	149 Å²	149	91.8 Å²	91.8	80%	0.797	48%	0.481	S	S	*	.			trans	-82.1	70.7	-175	-136.3	89.6	0	0	0	110.5	R718 S722	R718-N720 PolarHBondContact O-N 3.5Å; N720-S722 VanDerWaalsContact C-N 3.34Å; N720-S722 PolarHBondContact O-N 2.8Å
721	S	51.4	Low	59.1	Low	23 Å²	23	91.5 Å²	91.5	16%	0.161	49%	0.487	C	S	.	.			trans	-72.2	69.8	-167.2	-57.8	0	0	0	0	115.2	I719 S723 S724	I719-S721 VanDerWaalsContact C-N 3.26Å; I719-S721 WeakPolarHBondContact CG2-OG 3.35Å; I719-S721 PolarHBondContact O-N 3.25Å; I719-S721 PolarHBondContact O-OG 3.11Å; S721-S723 PolarHBondContact O-N 3.03Å; S721-S723 VanDerWaalsContact O-N 3.12Å; S721-S724 WeakPolarHBondContact CB-OG 3.46Å; S721-S724 PolarHBondContact O-OG 3.23Å
722	S	47.1	Very low	57.6	Low	100 Å²	100	92.4 Å²	92.4	70%	0.699	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-4.2	176.8	-55.4	0	0	0	0	115.2	N720	N720-S722 VanDerWaalsContact C-N 3.34Å; N720-S722 PolarHBondContact O-N 2.8Å
723	S	48.1	Very low	55.6	Low	112 Å²	112	98 Å²	98	78%	0.783	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.9	3.9	-172	54.3	0	0	0	0	114.9	S721	S721-S723 PolarHBondContact O-N 3.03Å; S721-S723 VanDerWaalsContact O-N 3.12Å
724	S	46.5	Very low	53.8	Low	33 Å²	33	103.5 Å²	103.5	23%	0.231	55%	0.552	C	S	.	*			trans	-78.3	124.9	178.4	59.2	0	0	0	0	111.5	W710 S721 L726 A727	W710-S724 PolarHBondContact NE1-OG 3.47Å; S721-S724 WeakPolarHBondContact CB-OG 3.46Å; S721-S724 PolarHBondContact O-OG 3.23Å; S724-L726 PolarHBondContact O-N 3.39Å; S724-A727 PolarHBondContact O-N 2.96Å; S724-A727 VanDerWaalsContact O-N 3.14Å
725	N	49.1	Very low	51.7	Low	169 Å²	169	108.6 Å²	108.6	90%	0.904	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	0.5	175.3	-69.2	-29.4	0	0	0	114.7
726	L	51.8	Low	49.9	Very low	79 Å²	79	108.2 Å²	108.2	41%	0.414	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.5	3.2	174.5	-53.9	-177.5	0	0	0	113.6	P706 S724 P728	P706-L726 HydrophobicContact CB-CD2 4.2Å; S724-L726 PolarHBondContact O-N 3.39Å; L726-P728 WeakPolarHBondContact O-CD 3.4Å
727	A	53.2	Low	48	Very low	42 Å²	42	115.4 Å²	115.4	35%	0.347	60%	0.6	S	S	.	*	S	Bend	trans	-70.7	126.3	177.4	0	0	0	0	0	111.1	W710 S724 A731	W710-A727 HydrophobicContact CZ2-CB 4.17Å; S724-A727 PolarHBondContact O-N 2.96Å; S724-A727 VanDerWaalsContact O-N 3.14Å; A727-A731 HydrophobicContact CB-CB 4.43Å
728	P	51.6	Low	46.4	Very low	30 Å²	30	117.4 Å²	117.4	20%	0.195	62%	0.617	C	S	.	*			trans	-60	149.8	178.3	-26	35.6	0	0	0	113.3	E707 L726 W730 A731	E707-P728 HydrophobicContact CB-CG 4.21Å; L726-P728 WeakPolarHBondContact O-CD 3.4Å; P728-W730 PolarHBondContact O-N 3.39Å; P728-A731 VanDerWaalsContact O-CB 3.3Å; P728-A731 WeakPolarHBondContact O-CB 3.49Å; P728-A731 PolarHBondContact O-N 2.97Å
729	K	44.4	Very low	44.7	Very low	226 Å²	226	112.4 Å²	112.4	98%	0.983	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-16.9	-174.3	-68.6	-176.1	177.8	179.3	0	115.9
730	W	45.9	Very low	43.3	Very low	199 Å²	199	119.2 Å²	119.2	75%	0.754	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-6.9	176.1	59.1	-98	0	0	0	114.1	P728 V732	P728-W730 PolarHBondContact O-N 3.39Å; W730-V732 PolarHBondContact O-N 3Å
731	A	44	Very low	42	Very low	34 Å²	34	117.4 Å²	117.4	28%	0.281	63%	0.628	S	S	.	*	S	Bend	trans	-75.3	103	174.6	0	0	0	0	0	110.2	W710 A727 P728 K733	W710-A731 HydrophobicContact CH2-CB 4.35Å; A727-A731 HydrophobicContact CB-CB 4.43Å; P728-A731 VanDerWaalsContact O-CB 3.3Å; P728-A731 WeakPolarHBondContact O-CB 3.49Å; P728-A731 PolarHBondContact O-N 2.97Å; A731-K733 PolarHBondContact O-N 3.4Å
732	V	43	Very low	40.8	Very low	128 Å²	128	122.5 Å²	122.5	78%	0.776	65%	0.653	S	S	*	*			trans	-60.8	120.7	-174.3	179.1	0	0	0	0	111.6	W730 N734	W730-V732 PolarHBondContact O-N 3Å; V732-N734 PolarHBondContact O-N 2.69Å
733	K	41.1	Very low	39.9	Very low	163 Å²	163	122.5 Å²	122.5	71%	0.709	65%	0.653	S	S	*	*			trans	-83.9	99	-177.8	-169.2	172.1	-175.8	174.3	0	110.7	A731 N735	A731-K733 PolarHBondContact O-N 3.4Å; K733-N735 VanDerWaalsContact C-N 3.33Å; K733-N735 PolarHBondContact O-N 2.89Å
734	N	34.8	Very low	39	Very low	145 Å²	145	123.1 Å²	123.1	78%	0.775	66%	0.658	S	S	*	*			trans	-70.2	79.4	-179.1	-80.9	0.3	0	0	0	113.2	V732	V732-N734 PolarHBondContact O-N 2.69Å
735	N	29.7	Very low	38.2	Very low	144 Å²	144	126.6 Å²	126.6	77%	0.77	68%	0.682	S	S	*	*			trans	-89.6	93.4	164.3	-93.7	26.4	0	0	0	110.4	K733	K733-N735 VanDerWaalsContact C-N 3.33Å; K733-N735 PolarHBondContact O-N 2.89Å
736	S	37	Very low	37.2	Very low	101 Å²	101	124.9 Å²	124.9	71%	0.706	68%	0.683	S	S	*	*			trans	-99	108.6	165.5	58.6	0	0	0	0	110.1
737	K	29.9	Very low	36.5	Very low	217 Å²	217	130.9 Å²	130.9	94%	0.943	71%	0.706	S	S	*	*			trans	-94.5	124.6	163.8	-167.1	166.5	-176	176.3	0	109
738	T	37.6	Very low	35.5	Very low	108 Å²	108	140.4 Å²	140.4	66%	0.663	73%	0.732	S	S	*	*			trans	-116.4	154.4	-169.6	51.2	0	0	0	0	111.7
739	S	29.4	Very low	34.5	Very low	111 Å²	111	150.7 Å²	150.7	78%	0.776	77%	0.767	S	S	*	*			trans	-147.5	112.2	149.4	-145.4	0	0	0	0	105.7
740	R	36.2	Very low	34	Very low	191 Å²	191	146.4 Å²	146.4	72%	0.721	76%	0.761	S	S	*	*				72.1	138.5	63.4	-69	-170.8	67.1	177.1	-3.2	111.5
741	D	29.9	Very low	33.1	Very low	110 Å²	110	140.5 Å²	140.5	59%	0.588	76%	0.761	S	S	*	*			cis	-127.1	179.2	12.2	-90.6	-59.5	0	0	0	111.5
742	N	26.6	Very low	32.9	Very low	131 Å²	131	144.8 Å²	144.8	70%	0.701	79%	0.786	S	S	*	*			cis	-150.9	165.4	15.3	-149.4	-12.6	0	0	0	113.7
743	S	27.7	Very low	33.6	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	79%	0.785	S	S	*	*			trans	29.9	136.4	152.5	61.7	0	0	0	0	121.4
744	S	29.5	Very low	33.4	Very low	125 Å²	125	141.7 Å²	141.7	87%	0.874	79%	0.786	S	S	*	*			cis	-142.2	175.4	18.1	64.7	0	0	0	0	112.6
745	S	29.5	Very low	33.5	Very low	106 Å²	106	141 Å²	141	74%	0.741	79%	0.786	S	S	*	*			trans	-138.2	142.3	-167.3	65.1	0	0	0	0	115
746	S	29.4	Very low	33.8	Very low	132 Å²	132	141.8 Å²	141.8	92%	0.923	79%	0.789	S	S	*	*			trans	-138.6	145	151	-86	0	0	0	0	109.7
747	K	35.2	Very low	33.5	Very low	205 Å²	205	145.7 Å²	145.7	89%	0.891	80%	0.797	S	S	*	*			trans	-112.6	151.3	-165.1	-93.3	174.1	178.2	168.1	0	114.1
748	R	33.7	Very low	33.7	Very low	242 Å²	242	138.5 Å²	138.5	91%	0.913	78%	0.784	S	S	*	*			trans	-49.6	149.8	172.6	-45.6	158.9	-178.3	-123.2	1.4	113
749	R	29.1	Very low	33.5	Very low	246 Å²	246	141.1 Å²	141.1	93%	0.928	79%	0.786	S	S	*	*				-161.9	166.2	110	-123	-175	-178.3	-158.2	0.6	113.6
750	T	35.5	Very low	33.8	Very low	137 Å²	137	143.1 Å²	143.1	84%	0.84	78%	0.783	S	S	*	*			trans	-114.4	139.1	171.1	48.9	0	0	0	0	109.2
751	G	25.6	Very low	33.5	Very low	74 Å²	74	139.8 Å²	139.8	76%	0.763	79%	0.788	S	S	*	*			trans	-165.6	152.8	172	0	0	0	0	0	111.6
752	P	40.4	Very low	33.8	Very low	125 Å²	125	141 Å²	141	81%	0.812	79%	0.79	S	S	*	*			trans	-121.5	-155.3	-168.8	40.1	-20.9	0	0	0	112.6
753	P	57.9	Low	34.3	Very low	114 Å²	114	140.5 Å²	140.5	74%	0.74	79%	0.794	S	S	*	*				-100.3	-177.7	-101.7	42.2	-29.4	0	0	0	113.6
754	P	37.3	Very low	34.4	Very low	112 Å²	112	142.5 Å²	142.5	73%	0.727	80%	0.796	S	S	*	*			trans	-124.2	138.7	153.8	35.7	-24.1	0	0	0	113.9
755	V	36	Very low	35.8	Very low	129 Å²	129	141.5 Å²	141.5	78%	0.782	79%	0.786	S	S	*	*			trans	-79.8	152.1	151.4	172.4	0	0	0	0	107.6
756	L	36.4	Very low	36.6	Very low	161 Å²	161	141.9 Å²	141.9	84%	0.843	79%	0.786	S	S	*	*			trans	-133.2	116.2	170.3	-70.3	175.6	0	0	0	111.4
757	E	31.7	Very low	37	Very low	184 Å²	184	139.4 Å²	139.4	86%	0.86	77%	0.766	S	S	*	*			trans	-122.9	157.4	162	-71.4	-173.1	92.9	0	0	108.4
758	G	33.3	Very low	36.8	Very low	65 Å²	65	133.6 Å²	133.6	67%	0.67	75%	0.747	S	S	*	*			trans	99.6	111.5	177.5	0	0	0	0	0	113.3
759	K	34.1	Very low	37	Very low	164 Å²	164	128.6 Å²	128.6	71%	0.713	73%	0.728	S	S	*	*			cis	98.9	139.7	26.4	-64.9	176.4	156	-75.6	0	113.4
760	E	35.7	Very low	37.4	Very low	153 Å²	153	120.2 Å²	120.2	72%	0.715	71%	0.708	S	S	*	*			cis	-164.2	124.1	-14.3	-118.2	152.8	-172	0	0	111.3
761	C	29.6	Very low	37.4	Very low	121 Å²	121	121.9 Å²	121.9	82%	0.818	71%	0.706	S	S	*	*			trans	-171.9	154.8	160.7	-117.8	0	0	0	0	109.6
762	Q	34.7	Very low	38.1	Very low	134 Å²	134	128.2 Å²	128.2	63%	0.626	71%	0.707	S	S	*	*			cis	91.3	136.8	5.2	-56.1	-60.3	-22.3	0	0	116.8
763	P	38.9	Very low	37.7	Very low	122 Å²	122	128.1 Å²	128.1	79%	0.792	70%	0.704	S	S	*	*			cis	-122.4	131.1	30.5	38.6	-25.2	0	0	0	119.9
764	L	28.6	Very low	36.4	Very low	142 Å²	142	134.3 Å²	134.3	74%	0.743	71%	0.712	S	S	*	*			trans	53.3	155.2	133.1	-61.2	-179.3	0	0	0	124.5
765	P	58.6	Low	36.8	Very low	103 Å²	103	134.4 Å²	134.4	67%	0.669	71%	0.713	S	S	*	*			trans	-125.8	-148.2	-160.3	34	-9.2	0	0	0	113.3
766	P	46.8	Very low	37	Very low	114 Å²	114	133.4 Å²	133.4	74%	0.74	71%	0.709	S	S	*	*				-145.5	128.8	91.1	36	-18	0	0	0	118.4
767	T	37.4	Very low	36.6	Very low	80 Å²	80	132.3 Å²	132.3	49%	0.491	71%	0.71	S	S	.	*			trans	52.7	120.6	137.8	59.1	0	0	0	0	124.8	H791	T767-H791 VanDerWaalsContact CB-CE1 3.49Å; T767-H791 WeakPolarHBondContact CB-CE1 3.49Å; T767-H791 WeakPolarHBondContact CG2-CE1 3.45Å
768	V	32.1	Very low	36.5	Very low	84 Å²	84	129.1 Å²	129.1	51%	0.509	71%	0.706	S	S	.	*			trans	-170.6	148.8	139.3	-90.4	0	0	0	0	111.4	V789 S790	V768-V789 HydrophobicContact CB-CB 3.98Å; V768-V789 HydrophobicContact CB-CG1 4.42Å; V768-V789 HydrophobicContact CB-CG2 4.16Å; V768-V789 HydrophobicContact CG1-CB 3.74Å; V768-V789 HydrophobicContact CG1-CG2 3.52Å; V768-V789 HydrophobicContact CG2-CB 4.24Å; V768-V789 HydrophobicContact CG2-CG1 4.26Å; V768-V789 HydrophobicContact CG2-CG2 4.2Å; V768-S790 CarbonylContact C-O 3.54Å; V768-S790 WeakPolarHBondContact CA-O 3.28Å; V768-S790 VanDerWaalsContact CB-O 3.28Å; V768-S790 WeakPolarHBondContact CB-O 3.26Å; V768-S790 VanDerWaalsContact CG1-O 3.26Å; V768-S790 WeakPolarHBondContact CG1-O 3.35Å
769	R	37.9	Very low	36.4	Very low	136 Å²	136	133 Å²	133	51%	0.513	72%	0.717	S	S	.	*			trans	-158.3	-178.1	-167	-85.6	151.3	91.7	-162.6	10.9	114.8	S790 H791 A792 V793	R769-S790 PolarHBondContact N-O 2.81Å; R769-S790 CarbonylContact O-C 3.57Å; R769-S790 VanDerWaalsContact O-C 3.25Å; R769-S790 VanDerWaalsContact O-O 3.1Å; R769-H791 VanDerWaalsContact CD-CE1 3.42Å; R769-H791 WeakPolarHBondContact CD-CE1 3.3Å; R769-H791 PolarHBondContact O-N 3.15Å; R769-A792 HydrophobicContact CB-CB 3.9Å; R769-V793 VanDerWaalsContact NH1-CG2 3.25Å
770	S	36.4	Very low	36.3	Very low	71 Å²	71	130.1 Å²	130.1	50%	0.497	72%	0.718	S	S	.	*			trans	82.9	162.5	167.6	-58	0	0	0	0	117.9	H791 A792	S770-H791 VanDerWaalsContact CB-O 3.3Å; S770-H791 WeakPolarHBondContact CB-O 3.26Å; S770-H791 PolarHBondContact OG-O 2.93Å; S770-A792 WeakPolarHBondContact OG-CA 2.36Å; S770-A792 WeakPolarHBondContact OG-CB 2.51Å; S770-A792 PolarHBondContact OG-N 3.07Å
771	Q	35.6	Very low	36.1	Very low	171 Å²	171	130.6 Å²	130.6	80%	0.799	72%	0.72	S	S	*	*			cis	-153.2	177.9	-2.8	-133.7	-62.2	80.4	0	0	110.8
772	R	39.8	Very low	36.2	Very low	208 Å²	208	129.9 Å²	129.9	79%	0.785	71%	0.711	S	S	*	*			trans	-152.4	151.3	177.6	-149.1	-177.1	-168	166.1	4.9	117.6
773	T	33.4	Very low	36.1	Very low	122 Å²	122	129 Å²	129	75%	0.748	72%	0.715	S	S	*	*			trans	104.7	124.3	152.7	67.3	0	0	0	0	123.3
774	R	30.2	Very low	35.8	Very low	244 Å²	244	132.3 Å²	132.3	92%	0.921	72%	0.717	S	S	*	*			trans	75.7	155.7	151.4	-78.1	-170	174.6	-160.3	-3.3	122
775	P	44.7	Very low	36.1	Very low	114 Å²	114	134.9 Å²	134.9	74%	0.74	72%	0.722	S	S	*	*			trans	-102.9	-171.4	-161.9	45.4	-38.7	0	0	0	112.8
776	P	41.7	Very low	34.9	Very low	108 Å²	108	135.7 Å²	135.7	70%	0.701	73%	0.73	S	S	*	*			cis	-142.6	-155.4	15	42.8	-19.9	0	0	0	116.8
777	T	27.8	Very low	34.1	Very low	139 Å²	139	141.6 Å²	141.6	85%	0.853	74%	0.738	S	S	*	*			trans	94.3	156.5	171	72.4	0	0	0	0	118.7
778	C	28.3	Very low	34.5	Very low	117 Å²	117	142.4 Å²	142.4	79%	0.791	75%	0.745	S	S	*	*			trans	-104.8	149.2	-167.4	-51.6	0	0	0	0	113
779	T	32.3	Very low	34.5	Very low	145 Å²	145	143.9 Å²	143.9	89%	0.89	75%	0.753	S	S	*	*			trans	-176.8	141.9	135.1	17.5	0	0	0	0	113.5
780	S	32	Very low	34.3	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	75%	0.753	S	S	*	*			trans	47.9	125.8	134.5	-132	0	0	0	0	123.5
781	E	31.4	Very low	34.3	Very low	163 Å²	163	142.8 Å²	142.8	76%	0.762	75%	0.754	S	S	*	*			trans	64.8	123.1	133.4	-66.1	-72.1	89.4	0	0	123.6
782	V	32	Very low	34.2	Very low	106 Å²	106	136.3 Å²	136.3	64%	0.642	73%	0.73	S	S	*	*				77.9	97	129.6	179.1	0	0	0	0	122.1
783	V	31.6	Very low	33.8	Very low	117 Å²	117	130.7 Å²	130.7	71%	0.709	72%	0.718	S	S	*	*				69.8	142.2	123.6	174.8	0	0	0	0	122.9
784	K	32.8	Very low	33.7	Very low	190 Å²	190	130.7 Å²	130.7	83%	0.826	72%	0.719	S	S	*	*			trans	85.6	92.7	161.7	-80.9	156.1	-167.2	171.3	0	121.5
785	K	35	Very low	34.7	Very low	197 Å²	197	124.2 Å²	124.2	86%	0.857	71%	0.708	S	S	*	*				53.4	130.9	114.2	-157.2	173	-175.3	174.7	0	121.4
786	S	33.8	Very low	34	Very low	119 Å²	119	124 Å²	124	83%	0.832	71%	0.709	S	S	*	*			trans	116.5	155.1	155.2	-50.9	0	0	0	0	117
787	R	29.9	Very low	33.7	Very low	238 Å²	238	123.6 Å²	123.6	90%	0.898	71%	0.709	S	S	*	*			trans	-126.7	174.5	-176.3	-119.7	-174.8	-178.1	-172.1	2.3	107.5
788	P	45.6	Very low	34.1	Very low	98 Å²	98	122.4 Å²	122.4	64%	0.636	71%	0.707	S	S	*	*			cis	-137.2	168.9	-2.8	34.3	-13.5	0	0	0	117.5
789	V	32.8	Very low	34.3	Very low	114 Å²	114	121.6 Å²	121.6	69%	0.691	70%	0.702	S	S	*	*			trans	63.7	165.4	157	-67.5	0	0	0	0	120.9	V768	V768-V789 HydrophobicContact CB-CB 3.98Å; V768-V789 HydrophobicContact CB-CG1 4.42Å; V768-V789 HydrophobicContact CB-CG2 4.16Å; V768-V789 HydrophobicContact CG1-CB 3.74Å; V768-V789 HydrophobicContact CG1-CG2 3.52Å; V768-V789 HydrophobicContact CG2-CB 4.24Å; V768-V789 HydrophobicContact CG2-CG1 4.26Å; V768-V789 HydrophobicContact CG2-CG2 4.2Å
790	S	33.6	Very low	34.4	Very low	74 Å²	74	120.7 Å²	120.7	52%	0.517	70%	0.696	S	S	.	*			trans	-156.4	-165.2	-179.4	62.7	0	0	0	0	110.8	V768 R769	V768-S790 CarbonylContact C-O 3.54Å; V768-S790 WeakPolarHBondContact CA-O 3.28Å; V768-S790 VanDerWaalsContact CB-O 3.28Å; V768-S790 WeakPolarHBondContact CB-O 3.26Å; V768-S790 VanDerWaalsContact CG1-O 3.26Å; V768-S790 WeakPolarHBondContact CG1-O 3.35Å; R769-S790 PolarHBondContact N-O 2.81Å; R769-S790 CarbonylContact O-C 3.57Å; R769-S790 VanDerWaalsContact O-C 3.25Å; R769-S790 VanDerWaalsContact O-O 3.1Å
791	H	35.6	Very low	35.3	Very low	110 Å²	110	121 Å²	121	51%	0.509	70%	0.696	S	S	.	*			trans	-146.4	-177.3	-171.8	-160.4	45.2	0	0	0	114.9	T767 R769 S770	T767-H791 VanDerWaalsContact CB-CE1 3.49Å; T767-H791 WeakPolarHBondContact CB-CE1 3.49Å; T767-H791 WeakPolarHBondContact CG2-CE1 3.45Å; R769-H791 VanDerWaalsContact CD-CE1 3.42Å; R769-H791 WeakPolarHBondContact CD-CE1 3.3Å; R769-H791 PolarHBondContact O-N 3.15Å; S770-H791 VanDerWaalsContact CB-O 3.3Å; S770-H791 WeakPolarHBondContact CB-O 3.26Å; S770-H791 PolarHBondContact OG-O 2.93Å
792	A	33.4	Very low	35.1	Very low	35 Å²	35	119.1 Å²	119.1	29%	0.289	70%	0.699	S	S	.	*			trans	-115.8	170.1	-178.6	0	0	0	0	0	110.8	R769 S770	R769-A792 HydrophobicContact CB-CB 3.9Å; S770-A792 WeakPolarHBondContact OG-CA 2.36Å; S770-A792 WeakPolarHBondContact OG-CB 2.51Å; S770-A792 PolarHBondContact OG-N 3.07Å
793	V	32.7	Very low	35.3	Very low	90 Å²	90	120.3 Å²	120.3	55%	0.545	71%	0.707	S	S	.	*			cis	-161.5	130.3	45.5	165.8	0	0	0	0	110.9	R769	R769-V793 VanDerWaalsContact NH1-CG2 3.25Å
794	T	30	Very low	36.3	Very low	123 Å²	123	120 Å²	120	76%	0.755	71%	0.707	S	S	*	*			trans	24.5	166.7	149.9	68.5	0	0	0	0	123.7
795	P	50.5	Low	36.4	Very low	107 Å²	107	116.1 Å²	116.1	70%	0.695	70%	0.704	S	S	*	*			cis	-138.9	-157.3	-35.3	36.8	-15	0	0	0	113.5
796	S	30.4	Very low	36.6	Very low	110 Å²	110	112.1 Å²	112.1	77%	0.769	70%	0.701	S	S	*	*			trans	80.8	151.1	162	-53.3	0	0	0	0	118.1
797	S	36.1	Very low	36.8	Very low	99 Å²	99	117.8 Å²	117.8	69%	0.692	70%	0.704	S	S	*	*			cis	-175	150.1	-25.7	50.4	0	0	0	0	111.4
798	S	37	Very low	36.8	Very low	115 Å²	115	114.9 Å²	114.9	80%	0.804	71%	0.705	S	S	*	*			trans	65.1	158.4	167.2	21	0	0	0	0	117.6
799	S	31.7	Very low	36.2	Very low	100 Å²	100	115.2 Å²	115.2	70%	0.699	71%	0.71	S	S	*	*			cis	-170.8	145.7	-6.3	45.5	0	0	0	0	113
800	T	34.2	Very low	36.4	Very low	125 Å²	125	115 Å²	115	77%	0.767	71%	0.713	S	S	*	*			trans	27.3	163.8	140.7	57.4	0	0	0	0	124.3
801	P	50	Low	36.6	Very low	111 Å²	111	117.2 Å²	117.2	72%	0.721	73%	0.729	S	S	*	*			cis	-145.9	-168.5	-29.5	40.2	-19.6	0	0	0	116.5
802	C	28.8	Very low	36.6	Very low	123 Å²	123	116.3 Å²	116.3	83%	0.831	74%	0.74	S	S	*	*			trans	87.8	167.7	150.5	-71.3	0	0	0	0	122.9
803	T	34.7	Very low	36.6	Very low	132 Å²	132	121 Å²	121	81%	0.81	77%	0.771	S	S	*	*			trans	-131.4	-167.5	-154.4	54.8	0	0	0	0	111.8
804	P	53	Low	36.6	Very low	109 Å²	109	120.1 Å²	120.1	71%	0.708	78%	0.78	S	S	*	*			cis	-148.4	172.7	7	45.2	-24.2	0	0	0	121.5
805	S	36.3	Very low	36.8	Very low	109 Å²	109	123.4 Å²	123.4	76%	0.762	78%	0.784	S	S	*	*			trans	65.9	133.6	140.6	-69	0	0	0	0	128.3
806	S	38.4	Very low	35.9	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	79%	0.787	S	S	*	*			trans	78.1	163.1	145.4	77.8	0	0	0	0	121.5
807	R	38.2	Very low	35.9	Very low	237 Å²	237	128 Å²	128	89%	0.894	79%	0.793	S	S	*	*			cis	-174.8	130.6	-33.7	-97.3	-167.4	-171.8	-166.3	5.5	109.9
808	I	28.9	Very low	35.5	Very low	177 Å²	177	126.9 Å²	126.9	91%	0.908	80%	0.798	S	S	*	*			trans	-147.4	166.5	167.1	-59.7	-173.5	0	0	0	111.7
809	S	34.3	Very low	35	Very low	106 Å²	106	132.9 Å²	132.9	74%	0.741	80%	0.803	S	S	*	*			trans	-142.2	156	-161.4	-42.2	0	0	0	0	118.5
810	S	37.4	Very low	35.1	Very low	109 Å²	109	134 Å²	134	76%	0.762	81%	0.805	S	S	*	*			trans	76.4	137.6	139.1	-61	0	0	0	0	126.8
811	S	36.5	Very low	35.7	Very low	121 Å²	121	133.5 Å²	133.5	85%	0.846	80%	0.804	S	S	*	*			trans	74	153.8	144.5	67.6	0	0	0	0	121.6
812	A	36.9	Very low	34.7	Very low	90 Å²	90	134.2 Å²	134.2	74%	0.744	81%	0.806	S	S	*	*			cis	-173.5	172.9	-21	0	0	0	0	0	112
813	S	31.9	Very low	35.4	Very low	134 Å²	134	139.5 Å²	139.5	94%	0.937	81%	0.809	S	S	*	*			trans	128.7	161	153.4	-59.4	0	0	0	0	118.3
814	G	33	Very low	35.9	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	81%	0.805	S	S	*	*			trans	177.7	169	172.1	0	0	0	0	0	114.6
815	K	34.4	Very low	34.8	Very low	193 Å²	193	139.9 Å²	139.9	84%	0.839	81%	0.811	S	S	*	*			trans	-172.1	147.9	173.1	-111.2	167.7	-173.6	177.4	0	116
816	Q	31.6	Very low	34.6	Very low	163 Å²	163	139.3 Å²	139.3	76%	0.762	81%	0.807	S	S	*	*			trans	41.3	120.9	145.5	-75.7	169.2	-41.8	0	0	121.8
817	V	29.6	Very low	34.3	Very low	149 Å²	149	138.8 Å²	138.8	90%	0.903	80%	0.803	S	S	*	*				95.5	125	72.7	163	0	0	0	0	114.9
818	G	28.4	Very low	33.9	Very low	77 Å²	77	132.2 Å²	132.2	79%	0.794	79%	0.794	S	S	*	*			trans	-169.6	170.1	177.8	0	0	0	0	0	113.7
819	R	26.1	Very low	33.9	Very low	241 Å²	241	128.4 Å²	128.4	91%	0.909	78%	0.782	S	S	*	*			trans	-126.3	141.7	-167.8	-89.3	-178.3	169.2	177.2	-3.3	114.8
820	V	35.1	Very low	33.7	Very low	122 Å²	122	129.2 Å²	129.2	74%	0.739	78%	0.783	S	S	*	*			trans	53.8	124	132.6	179.9	0	0	0	0	118.1
821	P	45.1	Very low	33.3	Very low	115 Å²	115	128.7 Å²	128.7	75%	0.747	78%	0.78	S	S	*	*				-152	148.4	76.6	38.3	-17.2	0	0	0	121.3
822	V	30.6	Very low	33.1	Very low	127 Å²	127	132.7 Å²	132.7	77%	0.77	78%	0.782	S	S	*	*				57.2	117.9	129.4	-175.3	0	0	0	0	122.6
823	R	42.1	Very low	33	Very low	233 Å²	233	138.8 Å²	138.8	88%	0.879	79%	0.785	S	S	*	*			trans	24.5	154.8	132.4	-79.4	-174.9	175.4	-170.1	-0.7	121.5
824	P	45.3	Very low	33	Very low	111 Å²	111	138.2 Å²	138.2	72%	0.721	77%	0.769	S	S	*	*			cis	-148.5	179.3	35.4	42.4	-21.3	0	0	0	120.1
825	V	30.7	Very low	32.9	Very low	139 Å²	139	141.9 Å²	141.9	84%	0.842	77%	0.767	S	S	*	*			trans	75.4	145.7	162.2	-157.1	0	0	0	0	120
826	S	32.6	Very low	32.6	Very low	97 Å²	97	139 Å²	139	68%	0.678	76%	0.761	S	S	*	*			trans	-91.3	-175.8	178.7	54.9	0	0	0	0	112
827	S	31.2	Very low	32.5	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	76%	0.763	S	S	*	*			cis	-162.5	161.2	24.4	-35.3	0	0	0	0	109.6
828	S	29.3	Very low	32.5	Very low	100 Å²	100	137.4 Å²	137.4	70%	0.699	76%	0.756	S	S	*	*			cis	-173.2	174.5	-21	52.3	0	0	0	0	110
829	S	30	Very low	32.5	Very low	96 Å²	96	142.5 Å²	142.5	67%	0.671	76%	0.759	S	S	*	*			trans	53.3	127.4	144.6	57.1	0	0	0	0	121.8
830	T	29.6	Very low	32.5	Very low	124 Å²	124	141.1 Å²	141.1	76%	0.761	75%	0.754	S	S	*	*			cis	-165.8	124.6	-7.2	8.7	0	0	0	0	106.8
831	S	29.1	Very low	32.1	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	76%	0.758	S	S	*	*				53.5	133.2	85.3	125.2	0	0	0	0	114.2
832	K	32.4	Very low	31.3	Very low	205 Å²	205	150.1 Å²	150.1	89%	0.891	77%	0.765	S	S	*	*			cis	-156.7	-179	30.8	-133.2	170.2	-175.9	-179.8	0	113.7
833	R	33.9	Very low	32	Very low	217 Å²	217	149.1 Å²	149.1	82%	0.819	76%	0.762	S	S	*	*			trans	-139.8	147.4	-171.8	-150.9	-159.8	-173	-154.9	5.4	112.4
834	M	33.8	Very low	31.2	Very low	122 Å²	122	147.3 Å²	147.3	60%	0.601	76%	0.76	S	S	*	*			trans	68.4	153.7	151.4	-83	170.2	82.1	0	0	123.9
835	E	30.8	Very low	30.4	Very low	148 Å²	148	145.8 Å²	145.8	69%	0.692	76%	0.757	S	S	*	*			trans	54.7	116.3	155.2	-99.3	71.1	145.3	0	0	125.1
836	D	27	Very low	30.3	Very low	132 Å²	132	147.9 Å²	147.9	71%	0.706	76%	0.757	S	S	*	*				65.8	158.4	123.9	-160.8	40	0	0	0	123.5
837	Q	29	Very low	30	Very low	170 Å²	170	151.2 Å²	151.2	79%	0.794	77%	0.766	S	S	*	*			trans	80.4	166.9	163.2	-97.8	161.3	83.9	0	0	119.2
838	S	29.6	Very low	29.9	Very low	110 Å²	110	156.9 Å²	156.9	77%	0.769	77%	0.773	S	S	*	*			trans	-142	170.1	-138.1	-73.6	0	0	0	0	115.1
839	Q	28.4	Very low	30.8	Very low	183 Å²	183	157.7 Å²	157.7	86%	0.855	78%	0.776	S	S	*	*			trans	90.9	167	161.2	-51.6	-168.1	3	0	0	119.1
840	R	26.7	Very low	30.8	Very low	213 Å²	213	163.7 Å²	163.7	80%	0.804	78%	0.784	S	S	*	*			trans	77.3	139.5	-174.2	-45.1	-177.4	-176.6	-173.1	0.4	113.1
841	F	27.3	Very low	30.6	Very low	189 Å²	189	163.6 Å²	163.6	83%	0.829	78%	0.783	S	S	*	*			cis	-130.2	165.2	12.8	-82.9	-88.8	0	0	0	114.9
842	R	27.4	Very low	30.7	Very low	236 Å²	236	163.5 Å²	163.5	89%	0.891	78%	0.782	S	S	*	*			trans	-120	171.3	163	-124.9	-174.4	-177.4	-170.9	2.7	105.6
843	P	46.8	Very low	30.7	Very low	107 Å²	107	159.9 Å²	159.9	70%	0.695	78%	0.778	S	S	*	*			cis	-145.1	-175.5	7.9	42	-21.5	0	0	0	117.5
844	K	24.9	Very low	30.4	Very low	195 Å²	195	158.5 Å²	158.5	85%	0.848	78%	0.781	S	S	*	*			trans	81.4	113.8	138.6	-141.7	75.7	178	-175.9	0	122.4
845	A	28.9	Very low	30.3	Very low	78 Å²	78	157 Å²	157	65%	0.645	79%	0.787	S	S	*	*			trans	59.1	123.5	137.3	0	0	0	0	0	124.3
846	E	27.1	Very low	31.2	Very low	183 Å²	183	155.7 Å²	155.7	86%	0.855	79%	0.792	S	S	*	*			trans	42	125.8	135.2	-56	-170.6	154.4	0	0	122.9
847	I	26.7	Very low	31.3	Very low	167 Å²	167	154.5 Å²	154.5	86%	0.856	79%	0.794	S	S	*	*				174.6	143.8	116.7	-88.2	158.5	0	0	0	110.3
848	Y	28.5	Very low	31.2	Very low	221 Å²	221	150 Å²	150	87%	0.867	79%	0.793	S	S	*	*			trans	-95.9	160.9	170.2	-91.2	-81.4	0	0	0	109.7
849	P	49	Very low	31.2	Very low	118 Å²	118	150.7 Å²	150.7	77%	0.766	80%	0.798	S	S	*	*			cis	-154.4	170.3	41.1	43.7	-22	0	0	0	120.7
850	R	29.6	Very low	31	Very low	221 Å²	221	147.4 Å²	147.4	83%	0.834	80%	0.795	S	S	*	*			trans	23.4	136.3	137.6	-176.2	-170.6	-91	178.4	-7.6	122.6
851	V	25.7	Very low	31.2	Very low	123 Å²	123	144.2 Å²	144.2	75%	0.745	79%	0.789	S	S	*	*				174.2	113.8	129.3	145.8	0	0	0	0	108.7
852	S	31.8	Very low	31.4	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	79%	0.785	S	S	*	*				60.5	144.9	98.2	-46	0	0	0	0	115.3
853	T	31.1	Very low	31.5	Very low	130 Å²	130	139.5 Å²	139.5	80%	0.798	78%	0.782	S	S	*	*			cis	-156.2	167.3	23.2	-17.2	0	0	0	0	108.1
854	Q	28.5	Very low	30.7	Very low	188 Å²	188	141.5 Å²	141.5	88%	0.879	79%	0.793	S	S	*	*				-157.1	176.4	59.1	-70.1	-174.8	6.9	0	0	112.4
855	A	31.3	Very low	31.1	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	79%	0.785	S	S	*	*			trans	-128.1	-156.4	178.4	0	0	0	0	0	109.1
856	P	49.5	Very low	31.4	Very low	121 Å²	121	137.6 Å²	137.6	79%	0.786	80%	0.796	S	S	*	*			cis	-128.5	-145.1	2.1	44.7	-24.1	0	0	0	111.3
857	S	29.7	Very low	31.8	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	80%	0.797	S	S	*	*			cis	-161.8	131.4	-2.3	42.3	0	0	0	0	112.3
858	G	27.8	Very low	32	Very low	76 Å²	76	137 Å²	137	78%	0.784	79%	0.79	S	S	*	*			trans	66.7	174.3	148.8	0	0	0	0	0	119.6
859	S	28.3	Very low	32	Very low	125 Å²	125	138.1 Å²	138.1	87%	0.874	79%	0.793	S	S	*	*			cis	-165.9	162.9	-22.2	44.2	0	0	0	0	110
860	S	25.5	Very low	32.6	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	79%	0.787	S	S	*	*			trans	-96.2	151.8	178.7	176.6	0	0	0	0	112.1
861	E	30.1	Very low	34	Very low	147 Å²	147	132.4 Å²	132.4	69%	0.687	79%	0.785	S	S	*	*			trans	-176.8	150.5	136.8	-107.6	-168.9	148.5	0	0	117.9
862	K	31.6	Very low	34.5	Very low	171 Å²	171	131.7 Å²	131.7	74%	0.743	79%	0.792	S	S	*	*			trans	78.6	160.5	145.9	-74.3	162.3	179.6	147.7	0	122.6
863	N	30	Very low	34.4	Very low	155 Å²	155	133.1 Å²	133.1	83%	0.829	80%	0.802	S	S	*	*			trans	-115.9	152.8	-161	-78.2	-50.3	0	0	0	113.6
864	T	29.8	Very low	34.3	Very low	148 Å²	148	130.6 Å²	130.6	91%	0.908	80%	0.801	S	S	*	*				179.9	131.7	122.3	30.8	0	0	0	0	114.8
865	G	32.9	Very low	34.4	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	80%	0.802	S	S	*	*			trans	64.6	112.2	142.4	0	0	0	0	0	125
866	S	35	Very low	34.6	Very low	126 Å²	126	130.6 Å²	130.6	88%	0.881	80%	0.802	S	S	*	*			trans	61.7	147.7	143	39.3	0	0	0	0	122.1
867	R	34.8	Very low	33.7	Very low	236 Å²	236	130 Å²	130	89%	0.891	80%	0.801	S	S	*	*			cis	-166.6	126.6	-18.5	-159.4	-169.4	-173.2	-171	2.3	112.8
868	S	31	Very low	33.9	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	80%	0.799	S	S	*	*			trans	62.2	126.8	147.2	61.4	0	0	0	0	127.3
869	R	30	Very low	34.2	Very low	245 Å²	245	132.4 Å²	132.4	93%	0.925	80%	0.8	S	S	*	*			trans	94.2	158.5	133.9	-87.1	-142.3	150.7	-158.8	-4.6	122.9
870	P	60.3	Low	34.3	Very low	100 Å²	100	130.7 Å²	130.7	65%	0.649	79%	0.794	S	S	*	*			trans	-137.2	-140.2	-149.7	48.4	-27.7	0	0	0	112.4
871	P	59.4	Low	34.6	Very low	120 Å²	120	129.6 Å²	129.6	78%	0.779	79%	0.786	S	S	*	*			cis	-130	165.8	-27.6	38.5	-22.4	0	0	0	115.4
872	A	36.3	Very low	34.8	Very low	108 Å²	108	132.5 Å²	132.5	89%	0.893	79%	0.791	S	S	*	*			trans	-155.9	172.2	161.6	0	0	0	0	0	112.8
873	S	30.6	Very low	34.7	Very low	125 Å²	125	132.2 Å²	132.2	87%	0.874	79%	0.794	S	S	*	*			trans	-92.5	144	-175	54.5	0	0	0	0	114.8
874	G	27.3	Very low	34.7	Very low	77 Å²	77	129.3 Å²	129.3	79%	0.794	79%	0.791	S	S	*	*			trans	162.1	132.4	162.2	0	0	0	0	0	116.1
875	L	31.8	Very low	34.5	Very low	171 Å²	171	128.9 Å²	128.9	90%	0.895	78%	0.784	S	S	*	*			trans	-88.1	156.2	160.5	-90.5	75.9	0	0	0	108.5
876	S	35.8	Very low	34.4	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	79%	0.786	S	S	*	*			cis	-174.1	179.7	-3.1	50.5	0	0	0	0	110.1
877	S	30.8	Very low	34.2	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	78%	0.781	S	S	*	*			trans	124.4	162.9	140.5	-160.1	0	0	0	0	118.3
878	S	33.1	Very low	34.1	Very low	99 Å²	99	134.8 Å²	134.8	69%	0.692	78%	0.776	S	S	*	*			trans	82.7	156.5	160.1	88.5	0	0	0	0	118.1
879	T	33.9	Very low	34.1	Very low	132 Å²	132	138.3 Å²	138.3	81%	0.81	78%	0.784	S	S	*	*			cis	-154.8	-178.2	-2.6	-10.8	0	0	0	0	113.7
880	A	30	Very low	34.8	Very low	90 Å²	90	131.7 Å²	131.7	74%	0.744	77%	0.772	S	S	*	*			trans	81	136.4	168.6	0	0	0	0	0	115.2
881	S	31.4	Very low	33.5	Very low	90 Å²	90	134.1 Å²	134.1	63%	0.629	78%	0.775	S	S	*	*			cis	-152.3	171.6	3.5	-86.3	0	0	0	0	107.9
882	R	34.4	Very low	32.1	Very low	208 Å²	208	136.6 Å²	136.6	79%	0.785	78%	0.776	S	S	*	*			cis	-178.4	169.3	-15.3	-91.8	175.6	-151.2	-144.8	4.5	104.3
883	M	29.6	Very low	31.9	Very low	165 Å²	165	135 Å²	135	81%	0.813	77%	0.77	S	S	*	*			cis	-172.7	168.7	-23.3	-100.2	170.4	162	0	0	105.7
884	A	31.1	Very low	32.1	Very low	93 Å²	93	137.1 Å²	137.1	77%	0.769	77%	0.771	S	S	*	*			cis	-178.2	136.2	-42.4	0	0	0	0	0	108.1
885	D	25.9	Very low	32.1	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	77%	0.766	S	S	*	*			trans	-145.2	163.6	162.2	-150.8	-5.3	0	0	0	111.6
886	R	29.1	Very low	32.1	Very low	193 Å²	193	138.3 Å²	138.3	73%	0.728	77%	0.766	S	S	*	*			trans	-58	143.8	-153.9	-46.4	119.9	-158.8	-117.1	1.8	116.5
887	Y	30.8	Very low	31.8	Very low	199 Å²	199	140.9 Å²	140.9	78%	0.78	77%	0.768	S	S	*	*				-174.4	124.4	90.7	-110.3	-90.1	0	0	0	113.9
888	M	33.5	Very low	31.9	Very low	161 Å²	161	142.3 Å²	142.3	79%	0.793	77%	0.767	S	S	*	*			trans	52.6	126	156.3	-63.6	-66	101.6	0	0	123.3
889	M	31.6	Very low	31.7	Very low	173 Å²	173	142.5 Å²	142.5	85%	0.852	76%	0.764	S	S	*	*			trans	-123.1	162	154.5	-103.4	-73.6	-175.9	0	0	107.7
890	P	44.8	Very low	31.5	Very low	106 Å²	106	141.6 Å²	141.6	69%	0.688	75%	0.754	S	S	*	*				-145.4	141.2	127.4	36.7	-22.1	0	0	0	116.4
891	Q	31.3	Very low	31.6	Very low	151 Å²	151	145.1 Å²	145.1	71%	0.706	76%	0.755	S	S	*	*			trans	44.9	127.6	133.1	-67.5	174.1	-86	0	0	123.4
892	E	31.6	Very low	31.7	Very low	172 Å²	172	148.7 Å²	148.7	80%	0.804	76%	0.761	S	S	*	*				72.4	146.8	127.6	-66.7	156.1	-152.6	0	0	121.1
893	G	32.1	Very low	31.4	Very low	74 Å²	74	142.2 Å²	142.2	76%	0.763	75%	0.748	S	S	*	*			trans	165.1	65.5	-174.7	0	0	0	0	0	113.6
894	L	34.9	Very low	31.5	Very low	170 Å²	170	141.2 Å²	141.2	89%	0.89	75%	0.746	S	S	*	*			trans	-37.1	140.4	169.8	-54.2	165.3	0	0	0	111.9
895	G	26.3	Very low	31.5	Very low	66 Å²	66	141 Å²	141	68%	0.68	74%	0.738	S	S	*	*			cis	89.7	83.8	36.8	0	0	0	0	0	109.7
896	F	31.2	Very low	31.7	Very low	208 Å²	208	142.6 Å²	142.6	91%	0.912	74%	0.741	S	S	*	*			trans	-138	115.6	164.6	-103.8	-79.3	0	0	0	109.8
897	M	31	Very low	31.6	Very low	160 Å²	160	142.5 Å²	142.5	79%	0.788	74%	0.742	S	S	*	*			trans	-86.6	-166.7	167.9	-59	-171.5	-61.3	0	0	109.7
898	L	31.3	Very low	31.4	Very low	140 Å²	140	138.7 Å²	138.7	73%	0.733	74%	0.744	S	S	*	*			trans	87	132.9	156	-54.9	-165.8	0	0	0	117.5
899	T	29.9	Very low	31.5	Very low	102 Å²	102	141.8 Å²	141.8	63%	0.626	75%	0.747	S	S	*	*			cis	-166.8	177.3	-33.9	4	0	0	0	0	108.9
900	N	29.3	Very low	31.2	Very low	114 Å²	114	138.6 Å²	138.6	61%	0.61	75%	0.748	S	S	*	*			trans	64.6	106.6	148.8	-70.7	8.8	0	0	0	116.1
901	Q	32.3	Very low	30.5	Very low	163 Å²	163	145.6 Å²	145.6	76%	0.762	76%	0.761	S	S	*	*				49.8	117.1	59.7	-47.2	-179	27.2	0	0	112.5
902	H	33.7	Very low	30.2	Very low	165 Å²	165	142.1 Å²	142.1	76%	0.764	77%	0.766	S	S	*	*				176.6	145.8	126.5	-104.1	-132.4	0	0	0	108
903	S	29	Very low	29.8	Very low	73 Å²	73	139.7 Å²	139.7	51%	0.51	77%	0.768	S	S	.	*			cis	-167	175.2	-18.5	-121.1	0	0	0	0	110.5
904	L	30.5	Very low	29.5	Very low	144 Å²	144	141 Å²	141	75%	0.754	77%	0.766	S	S	*	*			trans	41.4	114.7	141.7	-61.7	168.7	0	0	0	117.7
905	S	32.3	Very low	29.2	Very low	88 Å²	88	141.9 Å²	141.9	62%	0.615	77%	0.765	S	S	*	*				107.2	168.1	95.5	-86.5	0	0	0	0	111.1
906	E	28.2	Very low	29.5	Very low	172 Å²	172	146.9 Å²	146.9	80%	0.804	77%	0.77	S	S	*	*			cis	-140.3	168.2	9.3	-151.9	115.9	-100.2	0	0	113.2
907	Y	27.8	Very low	29.9	Very low	192 Å²	192	142.4 Å²	142.4	75%	0.753	76%	0.762	S	S	*	*			trans	-77.6	153.9	171	-110.7	-107.6	0	0	0	112.5
908	S	27.6	Very low	29.8	Very low	118 Å²	118	142.3 Å²	142.3	83%	0.825	76%	0.764	S	S	*	*			trans	-154.8	151.4	140.2	51.1	0	0	0	0	111.9
909	R	34.3	Very low	30.6	Very low	226 Å²	226	141.1 Å²	141.1	85%	0.853	76%	0.764	S	S	*	*			trans	-134.3	134.2	169.1	-83.9	-175.5	175.6	142.1	-5	108.4
910	A	26.6	Very low	30.3	Very low	106 Å²	106	141.2 Å²	141.2	88%	0.876	77%	0.77	S	S	*	*			trans	-150	159.4	159.6	0	0	0	0	0	110.1
911	R	28.5	Very low	30.2	Very low	253 Å²	253	140 Å²	140	96%	0.955	77%	0.77	S	S	*	*			trans	-128	153.6	170.6	-84.9	-173	173.6	-169.3	-0.1	108.7
912	G	25.4	Very low	30.2	Very low	78 Å²	78	140.7 Å²	140.7	80%	0.804	77%	0.773	S	S	*	*			trans	89.8	157.7	166.6	0	0	0	0	0	114.3
913	S	23.7	Very low	29.8	Very low	122 Å²	122	138.7 Å²	138.7	85%	0.853	77%	0.767	S	S	*	*			cis	-146.9	167.8	-1.9	-157.8	0	0	0	0	112.1
914	S	26.7	Very low	29.7	Very low	102 Å²	102	142.9 Å²	142.9	71%	0.713	78%	0.778	S	S	*	*			trans	-76.3	165.4	-179.6	-48.9	0	0	0	0	113.3
915	H	28.4	Very low	29.5	Very low	187 Å²	187	142 Å²	142	87%	0.866	78%	0.784	S	S	*	*				-171.3	172	115.2	-106.7	-81.8	0	0	0	113.9
916	Q	31.9	Very low	29.6	Very low	172 Å²	172	149 Å²	149	80%	0.804	80%	0.797	S	S	*	*			trans	-73.4	-175.2	178.3	-108.1	-176.3	-13.1	0	0	113.7
917	P	40	Very low	30.1	Very low	114 Å²	114	146.9 Å²	146.9	74%	0.74	80%	0.798	S	S	*	*			cis	-136.2	-171.2	0.9	25.8	0.4	0	0	0	116.9
918	L	27.9	Very low	30.1	Very low	158 Å²	158	144 Å²	144	83%	0.827	80%	0.795	S	S	*	*			trans	-61.1	-178.9	157.8	-75.2	158.6	0	0	0	113.6
919	P	47.9	Very low	31.1	Very low	114 Å²	114	143.6 Å²	143.6	74%	0.74	79%	0.79	S	S	*	*			cis	-136.7	-173.5	-1.2	27.1	-2.1	0	0	0	116.8
920	S	24.5	Very low	30.9	Very low	105 Å²	105	136.9 Å²	136.9	73%	0.734	78%	0.777	S	S	*	*			trans	103.4	102.9	135.3	-128.9	0	0	0	0	123.4
921	S	27.6	Very low	31.3	Very low	88 Å²	88	141.3 Å²	141.3	62%	0.615	77%	0.771	S	S	*	*				52.8	127.5	123.9	66	0	0	0	0	125.1
922	Q	32	Very low	32.4	Very low	177 Å²	177	134.5 Å²	134.5	83%	0.827	76%	0.76	S	S	*	*			trans	70.5	156	143.4	-68.4	178.6	-9.9	0	0	117.5
923	I	24.8	Very low	32.6	Very low	124 Å²	124	136.6 Å²	136.6	64%	0.636	75%	0.753	S	S	*	*			cis	-152.6	165.1	2.7	-133.5	164.3	0	0	0	112.6
924	H	27.8	Very low	33.1	Very low	160 Å²	160	134.5 Å²	134.5	74%	0.741	74%	0.743	S	S	*	*			trans	21.2	131.4	166.2	-57.9	-58.8	0	0	0	123.6
925	S	26.4	Very low	33.4	Very low	125 Å²	125	137.3 Å²	137.3	87%	0.874	75%	0.748	S	S	*	*				171.3	167.8	112.6	-79.3	0	0	0	0	115.8
926	R	33.8	Very low	33.5	Very low	237 Å²	237	134.1 Å²	134.1	89%	0.894	74%	0.738	S	S	*	*			trans	-99.3	166	179	-120.2	180	-173.9	-171.2	3.2	110.6
927	P	38.5	Very low	33.5	Very low	126 Å²	126	133.4 Å²	133.4	82%	0.818	73%	0.734	S	S	*	*				-149	-168.6	64.8	41.2	-19.7	0	0	0	117
928	N	28.9	Very low	33	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	73%	0.732	S	S	*	*			trans	-106.9	-160.7	179.5	-139.7	21.4	0	0	0	109.1
929	P	48	Very low	33.2	Very low	110 Å²	110	132.9 Å²	132.9	71%	0.714	73%	0.732	S	S	*	*			cis	-99.2	-173.7	9.9	44.5	-38.3	0	0	0	112.2
930	S	28.8	Very low	33.3	Very low	84 Å²	84	132 Å²	132	59%	0.587	73%	0.727	S	S	*	*			cis	-136.7	-163.5	14.5	-63.4	0	0	0	0	109.7
931	R	35.3	Very low	33.7	Very low	199 Å²	199	132.6 Å²	132.6	75%	0.751	73%	0.726	S	S	*	*			cis	66.8	165.2	12.1	-78.5	-166.2	76.5	-162.3	2.7	117.2	N933	R931-N933 PolarHBondContact NH2-OD1 2.76Å
932	P	52.5	Low	33.7	Very low	111 Å²	111	134.6 Å²	134.6	72%	0.721	73%	0.734	S	S	*	*			cis	-105.8	179.5	-15.5	42.8	-32.9	0	0	0	111.1
933	N	30.2	Very low	33.7	Very low	121 Å²	121	134.8 Å²	134.8	65%	0.647	74%	0.735	S	S	*	*			cis	-134.2	-136	-3.2	-155.2	48.1	0	0	0	111.3	R931	R931-N933 PolarHBondContact NH2-OD1 2.76Å
934	A	33.2	Very low	33.9	Very low	79 Å²	79	133 Å²	133	65%	0.653	73%	0.734	S	S	*	*			trans	-158	-168.2	177.4	0	0	0	0	0	111
935	I	33.1	Very low	34	Very low	160 Å²	160	136.7 Å²	136.7	82%	0.821	74%	0.743	S	S	*	*			trans	100.9	114.1	-163.9	-64.4	170.2	0	0	0	109.6
936	N	30.6	Very low	34.1	Very low	121 Å²	121	133.8 Å²	133.8	65%	0.647	73%	0.732	S	S	*	*			cis	-155	-163.8	-6.4	-148.4	4.1	0	0	0	114.9
937	H	32.4	Very low	33.9	Very low	156 Å²	156	130.5 Å²	130.5	72%	0.722	73%	0.731	S	S	*	*			trans	-35.4	155.2	177.5	-53.2	-42.5	0	0	0	119.5
938	C	28.8	Very low	33.7	Very low	103 Å²	103	129.2 Å²	129.2	70%	0.696	73%	0.725	S	S	*	*			cis	-166.6	111.8	-33.5	-140.5	0	0	0	0	112.3
939	L	31.4	Very low	34	Very low	158 Å²	158	131.2 Å²	131.2	83%	0.827	73%	0.73	S	S	*	*			trans	65.6	158.8	142	-98.6	80.6	0	0	0	120.6
940	P	49.8	Very low	33.3	Very low	97 Å²	97	131.2 Å²	131.2	63%	0.63	73%	0.728	S	S	*	*				-143.5	-161.3	-100.2	42.6	-22	0	0	0	116.4
941	T	32.9	Very low	33.6	Very low	117 Å²	117	136.4 Å²	136.4	72%	0.718	74%	0.743	S	S	*	*			trans	79.4	133.9	139.6	-76.3	0	0	0	0	118.1
942	T	28.6	Very low	33.4	Very low	129 Å²	129	130.9 Å²	130.9	79%	0.791	75%	0.748	S	S	*	*			cis	-154.6	175.8	-3.4	14.6	0	0	0	0	113.4
943	H	32.3	Very low	32.4	Very low	181 Å²	181	130.2 Å²	130.2	84%	0.838	75%	0.752	S	S	*	*			trans	-66.5	146.6	178.1	-100.7	-113.6	0	0	0	117.9
944	S	28.3	Very low	32.5	Very low	88 Å²	88	131.5 Å²	131.5	62%	0.615	76%	0.764	S	S	*	*				74.9	105.8	124.9	-168.9	0	0	0	0	122.9
945	Y	30.5	Very low	32.5	Very low	236 Å²	236	131.8 Å²	131.8	93%	0.925	77%	0.767	S	S	*	*			trans	56.1	121.8	137.3	-78.5	-84.6	0	0	0	121.9
946	G	28.3	Very low	32.5	Very low	64 Å²	64	133.6 Å²	133.6	66%	0.66	77%	0.772	S	S	*	*			trans	-177.6	132.8	151.2	0	0	0	0	0	113.6
947	I	30.6	Very low	32.4	Very low	168 Å²	168	132.1 Å²	132.1	86%	0.862	78%	0.776	S	S	*	*			trans	65.5	151.1	151	-58.9	164	0	0	0	117.4
948	S	32.8	Very low	32.3	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	78%	0.777	S	S	*	*			trans	-118.1	128.7	163.9	-75.9	0	0	0	0	110.2
949	Q	35.7	Very low	32.3	Very low	173 Å²	173	129.8 Å²	129.8	81%	0.808	78%	0.779	S	S	*	*			trans	69.1	143.7	156.7	-65.7	178.2	57.5	0	0	116.6
950	T	33.4	Very low	32.3	Very low	110 Å²	110	127.6 Å²	127.6	68%	0.675	78%	0.776	S	S	*	*			cis	-150.5	149.6	1.4	8.3	0	0	0	0	111.4
951	Q	35.6	Very low	32.2	Very low	194 Å²	194	128.2 Å²	128.2	91%	0.907	78%	0.78	S	S	*	*			trans	34.4	135	148.7	-60.1	-177.4	1.8	0	0	122.3
952	G	30.4	Very low	32	Very low	83 Å²	83	127.5 Å²	127.5	86%	0.856	78%	0.78	S	S	*	*			trans	148.5	144.4	165.2	0	0	0	0	0	112.2
953	A	30.9	Very low	32	Very low	96 Å²	96	126.8 Å²	126.8	79%	0.793	78%	0.78	S	S	*	*			trans	-142.3	137	-166.4	0	0	0	0	0	116.5
954	V	33.4	Very low	31.8	Very low	148 Å²	148	123.5 Å²	123.5	90%	0.897	78%	0.778	S	S	*	*			trans	78.1	140.2	150	172	0	0	0	0	120.1
955	A	32.4	Very low	31.7	Very low	86 Å²	86	124.4 Å²	124.4	71%	0.711	78%	0.784	S	S	*	*			trans	105.4	79.1	158.1	0	0	0	0	0	121.6
956	Q	33	Very low	31.6	Very low	198 Å²	198	121 Å²	121	93%	0.925	78%	0.78	S	S	*	*			trans	63.5	146.2	131.4	-60.3	-168.5	7.8	0	0	124.7
957	A	29.7	Very low	32.4	Very low	90 Å²	90	123 Å²	123	74%	0.744	78%	0.782	S	S	*	*			trans	97.5	123.3	147.8	0	0	0	0	0	122
958	S	28.9	Very low	32.4	Very low	105 Å²	105	120.3 Å²	120.3	73%	0.734	78%	0.777	S	S	*	*			trans	53	116.8	144.8	53.3	0	0	0	0	123.6
959	S	30.5	Very low	32.1	Very low	105 Å²	105	123.9 Å²	123.9	73%	0.734	78%	0.783	S	S	*	*			trans	41.8	122.9	136.3	60.1	0	0	0	0	123.1
960	S	30.1	Very low	32	Very low	112 Å²	112	119.6 Å²	119.6	78%	0.783	77%	0.772	S	S	*	*			trans	21.7	152.3	132.1	-50.4	0	0	0	0	122.6
961	P	47.1	Very low	31.7	Very low	110 Å²	110	123.3 Å²	123.3	71%	0.714	77%	0.774	S	S	*	*			cis	-138.5	174.5	-26.8	39	-20.7	0	0	0	115.2
962	S	29	Very low	31.7	Very low	101 Å²	101	123 Å²	123	71%	0.706	77%	0.765	S	S	*	*			trans	47.8	104.2	152.5	57.1	0	0	0	0	122.1
963	S	30.3	Very low	31.7	Very low	114 Å²	114	125 Å²	125	80%	0.797	76%	0.755	S	S	*	*			trans	55.9	109.4	135.3	62.1	0	0	0	0	123.1
964	S	26.6	Very low	31.7	Very low	113 Å²	113	126.1 Å²	126.1	79%	0.79	75%	0.753	S	S	*	*			trans	-173.1	105	138.6	40.2	0	0	0	0	116.1
965	S	26.3	Very low	31.4	Very low	107 Å²	107	127 Å²	127	75%	0.748	74%	0.744	S	S	*	*				31.2	142	127.5	68.2	0	0	0	0	125.8
966	I	28.8	Very low	31.1	Very low	165 Å²	165	130.4 Å²	130.4	85%	0.846	75%	0.745	S	S	*	*			trans	81.5	164.1	155	13.3	177.3	0	0	0	121.1
967	P	45.1	Very low	30.7	Very low	106 Å²	106	129.1 Å²	129.1	69%	0.688	74%	0.739	S	S	*	*				-141.6	-151.6	-117.6	50.2	-29.3	0	0	0	117.5
968	S	31.3	Very low	31.6	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	73%	0.732	S	S	*	*			trans	94.8	142.1	166.9	-33.9	0	0	0	0	115.4
969	E	26.3	Very low	31.4	Very low	176 Å²	176	132.2 Å²	132.2	82%	0.822	74%	0.738	S	S	*	*			cis	-156	169.5	-1.7	-102.1	-130.8	104.3	0	0	108
970	S	32.8	Very low	31.2	Very low	83 Å²	83	130.6 Å²	130.6	58%	0.58	74%	0.739	S	S	*	*			cis	-171.8	-133.7	-33.2	73.4	0	0	0	0	110.4
971	R	28.3	Very low	31.4	Very low	187 Å²	187	134.4 Å²	134.4	71%	0.706	74%	0.744	S	S	*	*			trans	52.1	109.2	172	-81	-163.8	171.3	-152.1	2.9	122
972	R	33.9	Very low	30.5	Very low	188 Å²	188	136 Å²	136	71%	0.709	75%	0.752	S	S	*	*				68	145.7	128.4	-62.4	-175.3	-173.2	-167.7	-0.8	119.5
973	D	31.7	Very low	31.1	Very low	124 Å²	124	137.1 Å²	137.1	66%	0.663	76%	0.757	S	S	*	*			cis	-159.9	142.4	-5.4	-115.5	-45.3	0	0	0	111.7
974	V	31.1	Very low	31.4	Very low	121 Å²	121	138.3 Å²	138.3	73%	0.733	75%	0.754	S	S	*	*			trans	45.8	126.3	141.8	167.7	0	0	0	0	120.1
975	K	26.8	Very low	31.6	Very low	167 Å²	167	141 Å²	141	73%	0.726	76%	0.756	S	S	*	*				-177.2	137.2	63.1	-155.9	160.1	172.8	176.9	0	116.9
976	Q	26.2	Very low	32	Very low	156 Å²	156	140.6 Å²	140.6	73%	0.729	75%	0.754	S	S	*	*			trans	48.8	119.7	145.4	-66.1	171	-23.7	0	0	125.2
977	E	24.2	Very low	33	Very low	171 Å²	171	138.5 Å²	138.5	80%	0.799	75%	0.748	S	S	*	*				39.3	160.1	97.6	-64.5	-70.2	95.9	0	0	121.5
978	P	47.8	Very low	32.8	Very low	91 Å²	91	138.5 Å²	138.5	59%	0.591	74%	0.743	S	S	*	*			cis	-147	-163.2	-33.6	41.2	-20.7	0	0	0	115.2
979	I	24.7	Very low	33.6	Very low	169 Å²	169	138 Å²	138	87%	0.867	74%	0.735	S	S	*	*			trans	75.6	141.9	159.2	-63.6	161.7	0	0	0	119.4
980	G	27.7	Very low	34.6	Very low	72 Å²	72	136.1 Å²	136.1	74%	0.742	73%	0.73	S	S	*	*			trans	166.5	113.7	159.4	0	0	0	0	0	116.5
981	E	32.9	Very low	35.4	Very low	192 Å²	192	134.2 Å²	134.2	90%	0.897	72%	0.724	S	S	*	*			trans	-87.5	158.8	168	-58.4	173.6	123.7	0	0	111.4
982	T	29	Very low	36.6	Very low	143 Å²	143	133.7 Å²	133.7	88%	0.877	72%	0.723	S	S	*	*			trans	-156.8	154.4	158.2	16.6	0	0	0	0	112.7
983	P	40.9	Very low	37.6	Very low	125 Å²	125	130.6 Å²	130.6	81%	0.812	72%	0.719	S	S	*	*			trans	-106.8	-178.3	-170.3	42.1	-36.7	0	0	0	115.5
984	D	37.2	Very low	38.6	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	73%	0.728	S	S	*	*			trans	-73	153.2	177.3	-178.2	27.3	0	0	0	114.2
985	M	31	Very low	39.8	Very low	170 Å²	170	136.6 Å²	136.6	84%	0.837	73%	0.73	S	S	*	*			trans	-154.8	132	162.7	-107.3	-143.7	71.9	0	0	112.9
986	S	34.8	Very low	41.4	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	73%	0.725	S	S	*	*			trans	-86.1	155.4	-171.6	-34.1	0	0	0	0	114.1
987	T	48.3	Very low	42.6	Very low	120 Å²	120	134.1 Å²	134.1	74%	0.736	72%	0.719	S	S	*	*			trans	-125.6	136.5	174.1	-61.3	0	0	0	0	111.5
988	D	42.5	Very low	44	Very low	106 Å²	106	130.7 Å²	130.7	57%	0.567	71%	0.711	S	S	*	*			trans	-79.5	123.4	-175.3	176.3	24.9	0	0	0	113.5	L990	D988-L990 WeakPolarHBondContact OD1-CB 2.93Å; D988-L990 PolarHBondContact OD1-N 3.28Å
989	V	47.8	Very low	44	Very low	100 Å²	100	134.1 Å²	134.1	61%	0.606	72%	0.719	S	S	*	*	S	Bend	trans	-81	-26	179.9	-179	0	0	0	0	112.4	G991 Y992 L993	V989-G991 VanDerWaalsContact C-N 3.34Å; V989-G991 PolarHBondContact O-N 3.06Å; V989-Y992 PolarHBondContact O-N 3.03Å; V989-Y992 VanDerWaalsContact O-N 3.14Å; V989-L993 HydrophobicContact CG1-CD1 4.32Å; V989-L993 PolarHBondContact O-N 2.86Å
990	L	46.2	Very low	45.4	Very low	136 Å²	136	130.9 Å²	130.9	71%	0.712	70%	0.703	S	S	*	*	H	α-helix	trans	-71.4	-28.8	-173.3	-71	165.8	0	0	0	112.6	D988 Y992	D988-L990 WeakPolarHBondContact OD1-CB 2.93Å; D988-L990 PolarHBondContact OD1-N 3.28Å; L990-Y992 VanDerWaalsContact C-N 3.3Å; L990-Y992 PolarHBondContact O-N 3.13Å
991	G	50.3	Low	46.8	Very low	44 Å²	44	131.1 Å²	131.1	45%	0.454	69%	0.687	S	S	.	*	H	α-helix	trans	-64.9	-28.7	170.6	0	0	0	0	0	114.4	V989	V989-G991 VanDerWaalsContact C-N 3.34Å; V989-G991 PolarHBondContact O-N 3.06Å
992	Y	54.3	Low	47.6	Very low	175 Å²	175	124 Å²	124	69%	0.686	66%	0.661	S	S	*	*	H	α-helix	trans	-78	-43.1	-178.6	-88.3	-95	0	0	0	112.8	V989 L990 K994 K995	V989-Y992 PolarHBondContact O-N 3.03Å; V989-Y992 VanDerWaalsContact O-N 3.14Å; L990-Y992 VanDerWaalsContact C-N 3.3Å; L990-Y992 PolarHBondContact O-N 3.13Å; Y992-K994 PolarHBondContact O-N 3.3Å; Y992-K995 PolarHBondContact O-N 3.36Å
993	L	54.3	Low	48.4	Very low	123 Å²	123	121 Å²	121	64%	0.644	64%	0.644	S	S	*	*	H	α-helix	trans	-67.5	-20.4	-176.8	-75.5	165.4	0	0	0	113.7	V989 K995	V989-L993 HydrophobicContact CG1-CD1 4.32Å; V989-L993 PolarHBondContact O-N 2.86Å; L993-K995 VanDerWaalsContact C-N 3.28Å; L993-K995 PolarHBondContact O-N 3.14Å
994	K	53	Low	48.8	Very low	193 Å²	193	122.1 Å²	122.1	84%	0.839	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	0.8	-178.3	-155.8	172.6	-179.8	179.1	0	114.5	Y992	Y992-K994 PolarHBondContact O-N 3.3Å
995	K	56.3	Low	49.2	Very low	179 Å²	179	124.8 Å²	124.8	78%	0.778	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-6.2	-175.8	-77.1	-171.8	175.1	-180	0	116.2	Y992 L993	Y992-K995 PolarHBondContact O-N 3.36Å; L993-K995 VanDerWaalsContact C-N 3.28Å; L993-K995 PolarHBondContact O-N 3.14Å
996	Y	59.3	Low	50	Low	160 Å²	160	123.6 Å²	123.6	63%	0.627	63%	0.63	S	S	*	*	S	Bend	trans	-110.3	142.2	-177.4	-80.2	-88.1	0	0	0	113.1	D1000	Y996-D1000 HydrophobicContact CD1-CB 4.4Å
997	N	52.8	Low	50.4	Low	111 Å²	111	125.7 Å²	125.7	59%	0.594	63%	0.628	S	S	*	*			trans	-84.9	139.5	178.3	-159.8	10.2	0	0	0	109.1	H999 D1000	N997-H999 PolarHBondContact O-N 3.25Å; N997-D1000 PolarHBondContact O-N 3.29Å
998	P	53	Low	50	Low	98 Å²	98	129.9 Å²	129.9	64%	0.636	63%	0.631	S	S	*	*	H	α-helix	trans	-59.5	-23.4	-166.2	-30.3	38.1	0	0	0	116.8
999	H	48.3	Very low	50	Low	164 Å²	164	128.2 Å²	128.2	76%	0.759	64%	0.639	S	S	*	*	H	α-helix	trans	-68.4	-31.9	176.1	-87.5	-79.8	0	0	0	113.6	N997 L1001 A1002	N997-H999 PolarHBondContact O-N 3.25Å; H999-L1001 VanDerWaalsContact C-N 3.26Å; H999-L1001 PolarHBondContact O-N 3.08Å; H999-A1002 PolarHBondContact O-N 3.47Å
1000	D	53.2	Low	49.7	Very low	100 Å²	100	127.3 Å²	127.3	54%	0.535	64%	0.641	S	S	.	*	H	α-helix	trans	-78.2	-12.2	-178.2	-59	-49.8	0	0	0	112.9	Y996 N997	Y996-D1000 HydrophobicContact CD1-CB 4.4Å; N997-D1000 PolarHBondContact O-N 3.29Å
1001	L	58.1	Low	49.5	Very low	77 Å²	77	124.5 Å²	124.5	40%	0.403	64%	0.638	S	S	.	*	H	α-helix	trans	-84.9	-21.7	176.9	-66	173.5	0	0	0	113	H999 F1004 Y1005	H999-L1001 VanDerWaalsContact C-N 3.26Å; H999-L1001 PolarHBondContact O-N 3.08Å; L1001-F1004 PolarHBondContact O-N 3.36Å; L1001-Y1005 PolarHBondContact O-N 3.39Å
1002	A	48.4	Very low	48.8	Very low	43 Å²	43	127.7 Å²	127.7	36%	0.355	65%	0.645	S	S	.	*	H	α-helix	trans	-61.5	-44.9	-178.4	0	0	0	0	0	113.6	H999 F1004 Y1005 H1006	H999-A1002 PolarHBondContact O-N 3.47Å; A1002-F1004 VanDerWaalsContact C-N 3.27Å; A1002-F1004 PolarHBondContact O-N 3.4Å; A1002-Y1005 PolarHBondContact O-N 3.28Å; A1002-H1006 PolarHBondContact O-CD2 3.47Å; A1002-H1006 PolarHBondContact O-N 3.17Å
1003	P	45.3	Very low	47.9	Very low	79 Å²	79	124.5 Å²	124.5	51%	0.513	65%	0.648	S	S	.	*	H	α-helix	trans	-60.8	-35.5	176.6	-23.4	34.8	0	0	0	113.2	H1007	P1003-H1007 PolarHBondContact O-N 2.67Å
1004	F	49.4	Very low	47.3	Very low	149 Å²	149	122.7 Å²	122.7	65%	0.654	64%	0.639	S	S	*	*	H	α-helix	trans	-67.9	-42.8	177	-113.9	-89.6	0	0	0	111.9	L1001 A1002 H1007 W1008	L1001-F1004 PolarHBondContact O-N 3.36Å; A1002-F1004 VanDerWaalsContact C-N 3.27Å; A1002-F1004 PolarHBondContact O-N 3.4Å; F1004-H1007 PolarHBondContact O-N 3.29Å; F1004-W1008 PolarHBondContact O-N 3.45Å
1005	Y	45.8	Very low	46.5	Very low	194 Å²	194	117.6 Å²	117.6	76%	0.761	62%	0.619	S	S	*	*	H	α-helix	trans	-61.7	-42.3	175.3	-118.3	-94.3	0	0	0	112.1	L1001 A1002 W1008 G1009	L1001-Y1005 PolarHBondContact O-N 3.39Å; A1002-Y1005 PolarHBondContact O-N 3.28Å; Y1005-W1008 PolarHBondContact O-N 2.71Å; Y1005-G1009 PolarHBondContact O-N 2.9Å
1006	H	47.6	Very low	45.8	Very low	145 Å²	145	114.1 Å²	114.1	67%	0.671	61%	0.608	S	S	*	*	H	α-helix	trans	-68.1	-35.1	176.9	-72.4	-63.4	0	0	0	113.2	A1002 G1009 A1010	A1002-H1006 PolarHBondContact O-CD2 3.47Å; A1002-H1006 PolarHBondContact O-N 3.17Å; H1006-G1009 PolarHBondContact O-N 3.49Å; H1006-A1010 PolarHBondContact O-N 3.12Å
1007	H	43.5	Very low	44.7	Very low	144 Å²	144	112.8 Å²	112.8	67%	0.667	62%	0.62	S	S	*	*	H	α-helix	trans	-68.8	-37.3	174.2	-106.3	73.9	0	0	0	113.1	P1003 F1004 G1009 A1010	P1003-H1007 PolarHBondContact O-N 2.67Å; F1004-H1007 PolarHBondContact O-N 3.29Å; H1007-G1009 VanDerWaalsContact C-N 3.28Å; H1007-G1009 PolarHBondContact O-N 2.93Å; H1007-A1010 PolarHBondContact O-N 3.22Å
1008	W	41.6	Very low	44.5	Very low	208 Å²	208	113.2 Å²	113.2	79%	0.788	63%	0.626	S	S	*	*	H	α-helix	trans	-62.5	-33.5	173.5	-95.8	51.3	0	0	0	112.9	F1004 Y1005 A1010	F1004-W1008 PolarHBondContact O-N 3.45Å; Y1005-W1008 PolarHBondContact O-N 2.71Å; W1008-A1010 VanDerWaalsContact C-N 3.33Å; W1008-A1010 PolarHBondContact O-N 3.35Å
1009	G	42	Very low	43.9	Very low	71 Å²	71	111.4 Å²	111.4	73%	0.732	63%	0.626	S	S	*	*	H	α-helix	trans	-70.6	-21.6	175.9	0	0	0	0	0	115.2	Y1005 H1006 H1007	Y1005-G1009 PolarHBondContact O-N 2.9Å; H1006-G1009 PolarHBondContact O-N 3.49Å; H1007-G1009 VanDerWaalsContact C-N 3.28Å; H1007-G1009 PolarHBondContact O-N 2.93Å
1010	A	41.6	Very low	43.3	Very low	80 Å²	80	110.5 Å²	110.5	66%	0.661	62%	0.623	S	S	*	*	H	α-helix	trans	-97.8	-17.3	-171.4	0	0	0	0	0	114.9	H1006 H1007 W1008	H1006-A1010 PolarHBondContact O-N 3.12Å; H1007-A1010 PolarHBondContact O-N 3.22Å; W1008-A1010 VanDerWaalsContact C-N 3.33Å; W1008-A1010 PolarHBondContact O-N 3.35Å
1011	A	40.5	Very low	42.4	Very low	77 Å²	77	111.8 Å²	111.8	64%	0.636	63%	0.63	S	S	*	*	S	Bend	trans	-119.6	36.7	-163.5	0	0	0	0	0	114.9
1012	N	36.1	Very low	41.4	Very low	112 Å²	112	114.9 Å²	114.9	60%	0.599	64%	0.636	S	S	*	*			trans	-147.6	47.5	-177.3	-116.9	-37.3	0	0	0	116.8	L1014 M1015	N1012-L1014 PolarHBondContact O-N 3.37Å; N1012-M1015 PolarHBondContact O-N 3.46Å
1013	S	36.2	Very low	40.9	Very low	108 Å²	108	117.4 Å²	117.4	76%	0.755	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	10.3	-178.7	-51.9	0	0	0	0	116.9	R1022	S1013-R1022 PolarHBondContact O-NH1 3.45Å; S1013-R1022 VanDerWaalsContact O-NH1 3.13Å; S1013-R1022 PolarHBondContact O-NH2 3.39Å
1014	L	41.9	Very low	40.8	Very low	85 Å²	85	122.2 Å²	122.2	45%	0.445	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.4	-11.1	-175.8	-153.8	69.8	0	0	0	114.4	N1012 L1021 R1022	N1012-L1014 PolarHBondContact O-N 3.37Å; L1014-L1021 HydrophobicContact CD2-CD1 4.43Å; L1014-R1022 HydrophobicContact CD1-CB 3.8Å; L1014-R1022 HydrophobicContact CG-CB 3.93Å
1015	M	35.7	Very low	39.9	Very low	85 Å²	85	122.9 Å²	122.9	42%	0.419	68%	0.678	S	S	.	*			trans	-96.6	155.6	176.9	-70.4	-74.8	96.8	0	0	112.8	N1012 M1020 L1021	N1012-M1015 PolarHBondContact O-N 3.46Å; M1015-M1020 WeakPolarHBondContact CE-O 2.77Å; M1015-L1021 HydrophobicContact CE-CB 4.44Å; M1015-L1021 HydrophobicContact CE-CD1 3.86Å
1016	D	41.2	Very low	39.4	Very low	106 Å²	106	124.9 Å²	124.9	57%	0.567	69%	0.685	S	S	*	*			trans	-127.9	152.3	166.4	179.8	81.5	0	0	0	106.8	T1018 G1019	D1016-T1018 PolarHBondContact O-N 2.9Å; D1016-G1019 PolarHBondContact O-N 3.04Å
1017	P	36.2	Very low	39.2	Very low	133 Å²	133	124.4 Å²	124.4	86%	0.864	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	3.5	-168.1	-26.6	37	0	0	0	117.6
1018	T	49.3	Very low	39.6	Very low	120 Å²	120	120 Å²	120	74%	0.736	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	5.8	174.2	-33.3	0	0	0	0	113.2	D1016	D1016-T1018 PolarHBondContact O-N 2.9Å
1019	G	39.1	Very low	40.2	Very low	60 Å²	60	115.5 Å²	115.5	62%	0.619	68%	0.676	S	S	*	*			trans	73.7	34.8	164.6	0	0	0	0	0	116.9	D1016	D1016-G1019 PolarHBondContact O-N 3.04Å
1020	M	36.8	Very low	41.4	Very low	144 Å²	144	114 Å²	114	71%	0.709	65%	0.653	S	S	*	*			trans	-109.1	132.5	175.6	-77.3	-177.1	60.6	0	0	113	M1015	M1015-M1020 WeakPolarHBondContact CE-O 2.77Å
1021	L	34.2	Very low	43	Very low	128 Å²	128	115.3 Å²	115.3	67%	0.67	65%	0.645	S	S	*	*			trans	-70	130.5	178.3	-160.8	75.8	0	0	0	112	L1014 M1015 S1023	L1014-L1021 HydrophobicContact CD2-CD1 4.43Å; M1015-L1021 HydrophobicContact CE-CB 4.44Å; M1015-L1021 HydrophobicContact CE-CD1 3.86Å; L1021-S1023 PolarHBondContact O-N 2.91Å; L1021-S1023 VanDerWaalsContact O-N 3.09Å
1022	R	37.4	Very low	45.1	Very low	142 Å²	142	111.7 Å²	111.7	54%	0.536	62%	0.615	S	S	.	*			trans	-86.1	76	-177.7	-149.7	-171.6	-57.1	157.2	5.6	111.2	S1013 L1014	S1013-R1022 PolarHBondContact O-NH1 3.45Å; S1013-R1022 VanDerWaalsContact O-NH1 3.13Å; S1013-R1022 PolarHBondContact O-NH2 3.39Å; L1014-R1022 HydrophobicContact CD1-CB 3.8Å; L1014-R1022 HydrophobicContact CG-CB 3.93Å
1023	S	36.5	Very low	46.8	Very low	96 Å²	96	118 Å²	118	67%	0.671	63%	0.63	S	S	*	*			trans	-58.2	141.1	-179.6	-58.4	0	0	0	0	113.4	L1021 M1025	L1021-S1023 PolarHBondContact O-N 2.91Å; L1021-S1023 VanDerWaalsContact O-N 3.09Å; S1023-M1025 PolarHBondContact O-N 3.17Å
1024	L	43.4	Very low	48.7	Very low	179 Å²	179	118 Å²	118	94%	0.937	62%	0.618	S	S	*	*			trans	-66.6	115.8	-174.7	-68.3	158.7	0	0	0	112.3
1025	M	32.2	Very low	50.7	Low	163 Å²	163	116.4 Å²	116.4	80%	0.803	61%	0.614	S	S	*	*			trans	-135.9	150.3	164.7	-64.4	-155.2	88	0	0	111.4	S1023	S1023-M1025 PolarHBondContact O-N 3.17Å
1026	R	35.2	Very low	52.6	Low	236 Å²	236	115 Å²	115	89%	0.891	62%	0.621	S	S	*	*			trans	-65.9	150	-174.1	-67.5	-177.8	-177.4	177.9	1.9	112
1027	P	42.3	Very low	54.6	Low	136 Å²	136	115.9 Å²	115.9	88%	0.883	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	135.9	-175.4	27.4	-35.4	0	0	0	112.1
1028	G	51.9	Low	56.6	Low	52 Å²	52	111.9 Å²	111.9	54%	0.536	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	117.4	3.3	161.4	0	0	0	0	0	117.9	S1040	G1028-S1040 VanDerWaalsContact O-CA 3.27Å; G1028-S1040 WeakPolarHBondContact O-CA 3.11Å
1029	Q	53.8	Low	58.1	Low	113 Å²	113	108.1 Å²	108.1	53%	0.528	57%	0.568	S	S	.	*			trans	-142.1	122.9	171	-101.3	165.2	-27.1	0	0	113	F1031 S1038 F1039	Q1029-F1031 HydrophobicContact CB-CE2 3.81Å; Q1029-F1031 HydrophobicContact CB-CZ 4.03Å; Q1029-F1031 WeakPolarHBondContact O-CE2 3.34Å; Q1029-S1038 PolarHBondContact NE2-OG 3.32Å; Q1029-F1039 WeakPolarHBondContact CA-O 3.08Å
1030	C	67.4	Low	59.7	Low	38 Å²	38	109.5 Å²	109.5	26%	0.257	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	126.8	174.1	-51.4	0	0	0	0	109.2	F1039 L1045	C1030-F1039 PolarHBondContact N-O 2.77Å; C1030-F1039 PolarHBondContact O-N 3.41Å; C1030-L1045 HydrophobicContact CB-CB 4.23Å; C1030-L1045 HydrophobicContact CB-CD2 3.67Å
1031	F	75.3	Confident	61.3	Low	109 Å²	109	107.4 Å²	107.4	48%	0.478	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.1	141.7	-173	-62.5	-102.2	0	0	0	112	Q1029 K1037	Q1029-F1031 HydrophobicContact CB-CE2 3.81Å; Q1029-F1031 HydrophobicContact CB-CZ 4.03Å; Q1029-F1031 WeakPolarHBondContact O-CE2 3.34Å; F1031-K1037 WeakPolarHBondContact CA-O 3.3Å
1032	C	84.6	Confident	63.1	Low	1 Å²	1	105.3 Å²	105.3	1%	0.007	55%	0.551	C	S	.	*			trans	-86.4	116.2	172.5	-174.3	0	0	0	0	110.9	E1034 C1035 G1036 K1037 F1039 L1045 H1048 H1052	C1032-E1034 PolarHBondContact O-N 3.14Å; C1032-C1035 PolarHBondContact O-N 3.23Å; C1032-G1036 WeakPolarHBondContact O-CA 3.5Å; C1032-G1036 PolarHBondContact O-N 2.86Å; C1032-K1037 PolarHBondContact N-O 2.97Å; C1032-F1039 HydrophobicContact CB-CE2 4.22Å; C1032-L1045 HydrophobicContact CB-CD1 3.61Å; C1032-H1048 PolarHBondContact SG-NE2 3.49Å; C1032-H1048 VanDerWaalsContact SG-NE2 3.43Å; C1032-H1052 PolarHBondContact SG-NE2 3.25Å
1033	R	72.8	Confident	64.9	Low	244 Å²	244	101.1 Å²	101.1	92%	0.921	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.4	177.5	-79.1	-171.9	165	-151.4	-4.9	114
1034	E	76.3	Confident	66.8	Low	108 Å²	108	101.6 Å²	101.6	51%	0.505	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-20.9	-176.6	-64.2	175	132.4	0	0	113.7	C1032 M1049 H1052	C1032-E1034 PolarHBondContact O-N 3.14Å; E1034-M1049 HydrophobicContact CG-CE 4.23Å; E1034-M1049 WeakPolarHBondContact OE2-CE 3.31Å; E1034-H1052 WeakPolarHBondContact OE2-CB 3.5Å; E1034-H1052 IonicContact OE2-CD2 2.69Å; E1034-H1052 PolarHBondContact OE2-CD2 3.16Å; E1034-H1052 IonicContact OE2-CG 3.1Å; E1034-H1052 VanDerWaalsContact OE2-CG 3.32Å; E1034-H1052 IonicContact OE2-NE2 3.72Å
1035	C	82.8	Confident	68.8	Low	52 Å²	52	94.5 Å²	94.5	35%	0.351	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.6	23.3	176.6	79.9	0	0	0	0	115.9	C1032 K1037 H1048	C1032-C1035 PolarHBondContact O-N 3.23Å; C1035-K1037 PolarHBondContact O-N 3.47Å; C1035-H1048 VanDerWaalsContact SG-CE1 3.54Å; C1035-H1048 PolarHBondContact SG-NE2 3.18Å
1036	G	76.7	Confident	71	Confident	55 Å²	55	95.4 Å²	95.4	57%	0.567	49%	0.492	S	S	*	.			trans	69.8	-11.6	172.7	0	0	0	0	0	117.3	C1032 S1038	C1032-G1036 WeakPolarHBondContact O-CA 3.5Å; C1032-G1036 PolarHBondContact O-N 2.86Å; G1036-S1038 PolarHBondContact O-N 3.1Å
1037	K	81.8	Confident	73.1	Confident	124 Å²	124	88.7 Å²	88.7	54%	0.539	48%	0.477	S	S	.	.			trans	-64.4	132.8	-172.6	-69.5	175.6	-171.5	172.6	0	112	F1031 C1032 C1035 F1039	F1031-K1037 WeakPolarHBondContact CA-O 3.3Å; C1032-K1037 PolarHBondContact N-O 2.97Å; C1035-K1037 PolarHBondContact O-N 3.47Å; K1037-F1039 HydrophobicContact CB-CE2 3.59Å; K1037-F1039 HydrophobicContact CB-CZ 3.73Å; K1037-F1039 WeakPolarHBondContact O-CD2 3.13Å; K1037-F1039 VanDerWaalsContact O-CE2 3.23Å; K1037-F1039 WeakPolarHBondContact O-CE2 3.22Å
1038	S	79.2	Confident	75.2	Confident	50 Å²	50	83.3 Å²	83.3	35%	0.35	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	145.1	177	74	0	0	0	0	111.7	Q1029 G1036	Q1029-S1038 PolarHBondContact NE2-OG 3.32Å; G1036-S1038 PolarHBondContact O-N 3.1Å
1039	F	81.6	Confident	76.5	Confident	41 Å²	41	84.5 Å²	84.5	18%	0.18	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	130.6	-176.1	-62.1	-84.7	0	0	0	110.1	Q1029 C1030 C1032 K1037 Q1041 H1044 L1045 H1048	Q1029-F1039 WeakPolarHBondContact CA-O 3.08Å; C1030-F1039 PolarHBondContact N-O 2.77Å; C1030-F1039 PolarHBondContact O-N 3.41Å; C1032-F1039 HydrophobicContact CB-CE2 4.22Å; K1037-F1039 HydrophobicContact CB-CE2 3.59Å; K1037-F1039 HydrophobicContact CB-CZ 3.73Å; K1037-F1039 WeakPolarHBondContact O-CD2 3.13Å; K1037-F1039 VanDerWaalsContact O-CE2 3.23Å; K1037-F1039 WeakPolarHBondContact O-CE2 3.22Å; F1039-Q1041 PolarHBondContact O-N 2.91Å; F1039-Q1041 VanDerWaalsContact O-N 3.15Å; F1039-H1044 HydrophobicContact CB-CB 4.07Å; F1039-H1044 HydrophobicContact CD1-CB 3.86Å; F1039-H1044 HydrophobicContact CG-CB 4.27Å; F1039-L1045 HydrophobicContact CB-CB 4.32Å; F1039-L1045 HydrophobicContact CD2-CB 4.14Å; F1039-L1045 HydrophobicContact CD2-CD1 4.06Å; F1039-L1045 HydrophobicContact CE2-CD1 4.31Å; F1039-L1045 HydrophobicContact CG-CB 4.39Å; F1039-H1048 HydrophobicContact CE1-CB 4.06Å; F1039-H1048 HydrophobicContact CE2-CB 4.12Å; F1039-H1048 AromaticContact CE2-CD2 3.19Å; F1039-H1048 WeakPolarHBondContact CE2-CD2 3.13Å; F1039-H1048 AromaticContact CE2-CG 3.81Å; F1039-H1048 AromaticContact CE2-NE2 3.95Å; F1039-H1048 HydrophobicContact CZ-CB 3.65Å; F1039-H1048 AromaticContact CZ-CD2 3.23Å; F1039-H1048 WeakPolarHBondContact CZ-CD2 3.39Å; F1039-H1048 AromaticContact CZ-CG 3.39Å; F1039-H1048 AromaticContact CZ-NE2 3.92Å
1040	S	71.4	Confident	77.8	Confident	88 Å²	88	87 Å²	87	62%	0.615	44%	0.438	S	S	*	.	S	Bend	trans	-72	-6.2	-178	53.6	0	0	0	0	115.1	G1028	G1028-S1040 VanDerWaalsContact O-CA 3.27Å; G1028-S1040 WeakPolarHBondContact O-CA 3.11Å
1041	Q	69.8	Low	77.9	Confident	100 Å²	100	88.3 Å²	88.3	47%	0.467	45%	0.447	S	S	.	.	S	Bend	trans	-139.8	140.7	176.9	-60.2	-171.3	7	0	0	112.3	F1039 S1043 H1044 L1045	F1039-Q1041 PolarHBondContact O-N 2.91Å; F1039-Q1041 VanDerWaalsContact O-N 3.15Å; Q1041-S1043 VanDerWaalsContact CB-OG 3.3Å; Q1041-S1043 WeakPolarHBondContact CB-OG 3.42Å; Q1041-S1043 PolarHBondContact O-N 3.12Å; Q1041-S1043 PolarHBondContact OE1-OG 3.49Å; Q1041-H1044 PolarHBondContact O-N 3.38Å; Q1041-L1045 PolarHBondContact O-N 2.84Å
1042	P	73.1	Confident	77.8	Confident	85 Å²	85	84.7 Å²	84.7	55%	0.552	43%	0.432	S	S	*	.	H	α-helix	trans	-59.3	-27	175.3	-24.3	32.7	0	0	0	114.3	R1046	P1042-R1046 VanDerWaalsContact O-CB 3.24Å; P1042-R1046 WeakPolarHBondContact O-CB 3.15Å; P1042-R1046 PolarHBondContact O-N 3.24Å
1043	S	74.8	Confident	76.7	Confident	54 Å²	54	90.2 Å²	90.2	38%	0.378	47%	0.465	S	S	.	.	H	α-helix	trans	-62.6	-40.1	173.9	47.3	0	0	0	0	112.3	Q1041 T1047	Q1041-S1043 VanDerWaalsContact CB-OG 3.3Å; Q1041-S1043 WeakPolarHBondContact CB-OG 3.42Å; Q1041-S1043 PolarHBondContact O-N 3.12Å; Q1041-S1043 PolarHBondContact OE1-OG 3.49Å; S1043-T1047 WeakPolarHBondContact O-CB 3.43Å; S1043-T1047 PolarHBondContact O-N 2.87Å; S1043-T1047 PolarHBondContact O-OG1 3.44Å
1044	H	77.4	Confident	75.6	Confident	105 Å²	105	84.9 Å²	84.9	49%	0.486	46%	0.46	S	S	.	.	H	α-helix	trans	-72.3	-44.5	178.1	-74.1	-139.1	0	0	0	110.2	F1039 Q1041 R1046 T1047 H1048	F1039-H1044 HydrophobicContact CB-CB 4.07Å; F1039-H1044 HydrophobicContact CD1-CB 3.86Å; F1039-H1044 HydrophobicContact CG-CB 4.27Å; Q1041-H1044 PolarHBondContact O-N 3.38Å; H1044-R1046 PolarHBondContact O-N 3.12Å; H1044-T1047 PolarHBondContact O-N 2.85Å; H1044-H1048 WeakPolarHBondContact O-CB 3.32Å; H1044-H1048 PolarHBondContact O-N 2.91Å
1045	L	83.8	Confident	74.1	Confident	31 Å²	31	82.4 Å²	82.4	16%	0.162	46%	0.463	C	S	.	.	H	α-helix	trans	-57.9	-47.4	172.3	175	58.4	0	0	0	111.6	C1030 C1032 F1039 Q1041 T1047 H1048 M1049	C1030-L1045 HydrophobicContact CB-CB 4.23Å; C1030-L1045 HydrophobicContact CB-CD2 3.67Å; C1032-L1045 HydrophobicContact CB-CD1 3.61Å; F1039-L1045 HydrophobicContact CB-CB 4.32Å; F1039-L1045 HydrophobicContact CD2-CB 4.14Å; F1039-L1045 HydrophobicContact CD2-CD1 4.06Å; F1039-L1045 HydrophobicContact CE2-CD1 4.31Å; F1039-L1045 HydrophobicContact CG-CB 4.39Å; Q1041-L1045 PolarHBondContact O-N 2.84Å; L1045-T1047 VanDerWaalsContact C-N 3.26Å; L1045-T1047 PolarHBondContact O-N 3.3Å; L1045-H1048 CarbonylContact O-C 3.21Å; L1045-H1048 PolarHBondContact O-N 3.41Å; L1045-H1048 VanDerWaalsContact O-N 3.14Å; L1045-M1049 HydrophobicContact CD1-CG 3.94Å; L1045-M1049 HydrophobicContact CG-CG 4.4Å; L1045-M1049 WeakPolarHBondContact O-CG 3.07Å; L1045-M1049 PolarHBondContact O-N 3.24Å
1046	R	78.9	Confident	72.1	Confident	182 Å²	182	87.9 Å²	87.9	69%	0.687	48%	0.481	S	S	*	.	H	α-helix	trans	-63.7	-29.7	179	-169.5	178.5	-65.5	-170.8	-1.1	113	P1042 H1044 R1050	P1042-R1046 VanDerWaalsContact O-CB 3.24Å; P1042-R1046 WeakPolarHBondContact O-CB 3.15Å; P1042-R1046 PolarHBondContact O-N 3.24Å; H1044-R1046 PolarHBondContact O-N 3.12Å; R1046-R1050 WeakPolarHBondContact O-CG 3.24Å
1047	T	80.3	Confident	70.1	Confident	94 Å²	94	92.7 Å²	92.7	58%	0.577	49%	0.494	S	S	*	.	H	α-helix	trans	-77.4	-38	173.7	-54.8	0	0	0	0	111.3	S1043 H1044 L1045 R1050 S1051	S1043-T1047 WeakPolarHBondContact O-CB 3.43Å; S1043-T1047 PolarHBondContact O-N 2.87Å; S1043-T1047 PolarHBondContact O-OG1 3.44Å; H1044-T1047 PolarHBondContact O-N 2.85Å; L1045-T1047 VanDerWaalsContact C-N 3.26Å; L1045-T1047 PolarHBondContact O-N 3.3Å; T1047-R1050 WeakPolarHBondContact O-CB 3.43Å; T1047-R1050 PolarHBondContact O-N 3.47Å; T1047-S1051 PolarHBondContact O-N 2.79Å
1048	H	86.4	Confident	67.8	Low	24 Å²	24	97.5 Å²	97.5	11%	0.111	51%	0.51	C	S	.	.	H	α-helix	trans	-69.1	-38.5	175.3	169.5	50.5	0	0	0	112.9	C1032 C1035 F1039 H1044 L1045 R1050 S1051 H1052	C1032-H1048 PolarHBondContact SG-NE2 3.49Å; C1032-H1048 VanDerWaalsContact SG-NE2 3.43Å; C1035-H1048 VanDerWaalsContact SG-CE1 3.54Å; C1035-H1048 PolarHBondContact SG-NE2 3.18Å; F1039-H1048 HydrophobicContact CE1-CB 4.06Å; F1039-H1048 HydrophobicContact CE2-CB 4.12Å; F1039-H1048 AromaticContact CE2-CD2 3.19Å; F1039-H1048 WeakPolarHBondContact CE2-CD2 3.13Å; F1039-H1048 AromaticContact CE2-CG 3.81Å; F1039-H1048 AromaticContact CE2-NE2 3.95Å; F1039-H1048 HydrophobicContact CZ-CB 3.65Å; F1039-H1048 AromaticContact CZ-CD2 3.23Å; F1039-H1048 WeakPolarHBondContact CZ-CD2 3.39Å; F1039-H1048 AromaticContact CZ-CG 3.39Å; F1039-H1048 AromaticContact CZ-NE2 3.92Å; H1044-H1048 WeakPolarHBondContact O-CB 3.32Å; H1044-H1048 PolarHBondContact O-N 2.91Å; L1045-H1048 CarbonylContact O-C 3.21Å; L1045-H1048 PolarHBondContact O-N 3.41Å; L1045-H1048 VanDerWaalsContact O-N 3.14Å; H1048-R1050 PolarHBondContact O-N 2.72Å; H1048-S1051 PolarHBondContact ND1-OG 3.47Å; H1048-S1051 VanDerWaalsContact ND1-OG 3.16Å; H1048-S1051 WeakPolarHBondContact O-CA 3.34Å; H1048-S1051 WeakPolarHBondContact O-CB 3.39Å; H1048-S1051 PolarHBondContact O-N 2.71Å; H1048-S1051 PolarHBondContact O-OG 2.89Å; H1048-H1052 AromaticContact CE1-CE1 3.84Å; H1048-H1052 AromaticContact CE1-NE2 3.27Å; H1048-H1052 PolarHBondContact CE1-NE2 3.05Å; H1048-H1052 VanDerWaalsContact CE1-NE2 3.27Å; H1048-H1052 AromaticContact NE2-NE2 3.3Å; H1048-H1052 PolarHBondContact NE2-NE2 3.29Å; H1048-H1052 PolarHBondContact O-N 2.82Å
1049	M	79.3	Confident	65.8	Low	76 Å²	76	102.7 Å²	102.7	37%	0.374	53%	0.534	S	S	.	.	H	α-helix	trans	-60.3	-29.6	172.4	-66.9	-144.6	75.2	0	0	112.3	E1034 L1045 S1051 H1052 T1053	E1034-M1049 HydrophobicContact CG-CE 4.23Å; E1034-M1049 WeakPolarHBondContact OE2-CE 3.31Å; L1045-M1049 HydrophobicContact CD1-CG 3.94Å; L1045-M1049 HydrophobicContact CG-CG 4.4Å; L1045-M1049 WeakPolarHBondContact O-CG 3.07Å; L1045-M1049 PolarHBondContact O-N 3.24Å; M1049-S1051 VanDerWaalsContact C-N 3.28Å; M1049-S1051 PolarHBondContact O-N 3.47Å; M1049-H1052 PolarHBondContact O-N 2.72Å; M1049-T1053 PolarHBondContact O-N 3.46Å
1050	R	80.4	Confident	63.4	Low	167 Å²	167	103.7 Å²	103.7	63%	0.63	56%	0.556	S	S	*	*	H	α-helix	trans	-66.8	-27.1	170.7	-67.2	171.4	175.8	-173.2	-3.1	113.1	R1046 T1047 H1048 H1052 T1053 V1054	R1046-R1050 WeakPolarHBondContact O-CG 3.24Å; T1047-R1050 WeakPolarHBondContact O-CB 3.43Å; T1047-R1050 PolarHBondContact O-N 3.47Å; H1048-R1050 PolarHBondContact O-N 2.72Å; R1050-H1052 VanDerWaalsContact C-N 3.34Å; R1050-T1053 WeakPolarHBondContact CA-OG1 3.49Å; R1050-T1053 PolarHBondContact O-N 2.99Å; R1050-T1053 PolarHBondContact O-OG1 2.79Å; R1050-V1054 WeakPolarHBondContact O-CG2 3.32Å; R1050-V1054 PolarHBondContact O-N 3.05Å
1051	S	69.4	Low	61.5	Low	65 Å²	65	107.3 Å²	107.3	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-68.1	-32.4	174.3	70.5	0	0	0	0	112.7	T1047 H1048 M1049 V1054 G1055	T1047-S1051 PolarHBondContact O-N 2.79Å; H1048-S1051 PolarHBondContact ND1-OG 3.47Å; H1048-S1051 VanDerWaalsContact ND1-OG 3.16Å; H1048-S1051 WeakPolarHBondContact O-CA 3.34Å; H1048-S1051 WeakPolarHBondContact O-CB 3.39Å; H1048-S1051 PolarHBondContact O-N 2.71Å; H1048-S1051 PolarHBondContact O-OG 2.89Å; M1049-S1051 VanDerWaalsContact C-N 3.28Å; M1049-S1051 PolarHBondContact O-N 3.47Å; S1051-V1054 PolarHBondContact O-N 3.05Å; S1051-G1055 PolarHBondContact O-N 2.62Å
1052	H	73.4	Confident	59.7	Low	33 Å²	33	110 Å²	110	15%	0.153	58%	0.58	C	S	.	*	H	α-helix	trans	-66.5	-41.5	170.1	-64.1	-58	0	0	0	111.3	C1032 E1034 H1048 M1049 R1050 V1054 G1055	C1032-H1052 PolarHBondContact SG-NE2 3.25Å; E1034-H1052 WeakPolarHBondContact OE2-CB 3.5Å; E1034-H1052 IonicContact OE2-CD2 2.69Å; E1034-H1052 PolarHBondContact OE2-CD2 3.16Å; E1034-H1052 IonicContact OE2-CG 3.1Å; E1034-H1052 VanDerWaalsContact OE2-CG 3.32Å; E1034-H1052 IonicContact OE2-NE2 3.72Å; H1048-H1052 AromaticContact CE1-CE1 3.84Å; H1048-H1052 AromaticContact CE1-NE2 3.27Å; H1048-H1052 PolarHBondContact CE1-NE2 3.05Å; H1048-H1052 VanDerWaalsContact CE1-NE2 3.27Å; H1048-H1052 AromaticContact NE2-NE2 3.3Å; H1048-H1052 PolarHBondContact NE2-NE2 3.29Å; H1048-H1052 PolarHBondContact O-N 2.82Å; M1049-H1052 PolarHBondContact O-N 2.72Å; R1050-H1052 VanDerWaalsContact C-N 3.34Å; H1052-V1054 PolarHBondContact O-N 2.66Å; H1052-G1055 PolarHBondContact O-N 2.92Å
1053	T	62.1	Low	57.6	Low	116 Å²	116	116.5 Å²	116.5	71%	0.712	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-2	176.1	65	0	0	0	0	115.8	M1049 R1050	M1049-T1053 PolarHBondContact O-N 3.46Å; R1050-T1053 WeakPolarHBondContact CA-OG1 3.49Å; R1050-T1053 PolarHBondContact O-N 2.99Å; R1050-T1053 PolarHBondContact O-OG1 2.79Å
1054	V	48.8	Very low	55.3	Low	132 Å²	132	117.3 Å²	117.3	80%	0.8	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	4.1	176	-178.5	0	0	0	0	111.4	R1050 S1051 H1052	R1050-V1054 WeakPolarHBondContact O-CG2 3.32Å; R1050-V1054 PolarHBondContact O-N 3.05Å; S1051-V1054 PolarHBondContact O-N 3.05Å; H1052-V1054 PolarHBondContact O-N 2.66Å
1055	G	44.9	Very low	53.1	Low	56 Å²	56	118.4 Å²	118.4	58%	0.577	62%	0.624	S	S	*	*	S	Bend	trans	-129.4	25	-170.1	0	0	0	0	0	116.2	S1051 H1052	S1051-G1055 PolarHBondContact O-N 2.62Å; H1052-G1055 PolarHBondContact O-N 2.92Å
1056	F	39.7	Very low	50.7	Low	168 Å²	168	125 Å²	125	74%	0.737	66%	0.659	S	S	*	*			trans	-120.9	72.3	179.6	-95.9	-80.2	0	0	0	113.1
1057	D	35.6	Very low	48.3	Very low	155 Å²	155	121 Å²	121	83%	0.829	67%	0.666	S	S	*	*			trans	-148.2	54.5	168.3	-127.2	-13.8	0	0	0	109.9
1058	Y	33.8	Very low	45.9	Very low	226 Å²	226	125.4 Å²	125.4	89%	0.886	68%	0.679	S	S	*	*	S	Bend	trans	-164.8	156.5	152.7	-101.6	-66.6	0	0	0	110.8
1059	N	36.2	Very low	43.2	Very low	159 Å²	159	131.2 Å²	131.2	85%	0.85	72%	0.717	S	S	*	*			trans	-75.9	156.2	-163.9	-63	-16.8	0	0	0	115.1
1060	G	32.4	Very low	40.8	Very low	61 Å²	61	133.9 Å²	133.9	63%	0.629	74%	0.737	S	S	*	*			trans	-86.8	-161.2	161.6	0	0	0	0	0	113.6
1061	L	30.3	Very low	38.2	Very low	164 Å²	164	130.4 Å²	130.4	86%	0.859	74%	0.744	S	S	*	*			trans	75.2	131	-166.2	-64.3	117.5	0	0	0	114.6
1062	H	32.6	Very low	36.4	Very low	158 Å²	158	132.7 Å²	132.7	73%	0.731	76%	0.76	S	S	*	*			cis	-166.4	167.8	-16.1	-141.4	-89.9	0	0	0	111.1
1063	R	28.6	Very low	34.2	Very low	221 Å²	221	140.9 Å²	140.9	83%	0.834	80%	0.799	S	S	*	*			trans	67.2	145.5	165.1	-63.5	-174.8	175.1	-141.1	-3	118.4
1064	G	27.3	Very low	32.7	Very low	71 Å²	71	139.8 Å²	139.8	73%	0.732	80%	0.801	S	S	*	*			trans	-119.8	165.4	146.3	0	0	0	0	0	109.5
1065	T	31.9	Very low	32.4	Very low	127 Å²	127	139.2 Å²	139.2	78%	0.779	80%	0.8	S	S	*	*			trans	-160.4	132.1	167.1	42.7	0	0	0	0	108
1066	D	32.1	Very low	31.7	Very low	169 Å²	169	145.9 Å²	145.9	90%	0.904	81%	0.813	S	S	*	*			trans	-78.1	148.1	179.7	-52.3	-85.7	0	0	0	112.9
1067	A	28.3	Very low	31.2	Very low	99 Å²	99	147 Å²	147	82%	0.818	82%	0.821	S	S	*	*			trans	-162.7	111.7	161	0	0	0	0	0	111
1068	H	31	Very low	30.8	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.866	81%	0.813	S	S	*	*			trans	-93.2	136.1	160.9	-91.1	-96.4	0	0	0	109.5
1069	T	28	Very low	30.6	Very low	146 Å²	146	141.7 Å²	141.7	90%	0.896	81%	0.813	S	S	*	*			trans	-167.6	165.5	145.4	4.9	0	0	0	0	111.5
1070	T	30.4	Very low	30.2	Very low	132 Å²	132	137 Å²	137	81%	0.81	80%	0.803	S	S	*	*			trans	-133.3	132.1	-162.3	50.3	0	0	0	0	113.3
1071	A	25.4	Very low	30.1	Very low	93 Å²	93	143 Å²	143	77%	0.769	81%	0.814	S	S	*	*			trans	-174.1	135.6	142.2	0	0	0	0	0	107.9
1072	S	30.9	Very low	30	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	81%	0.811	S	S	*	*			cis	85.7	87.7	21.6	86.7	0	0	0	0	116.1
1073	E	28.8	Very low	29.8	Very low	205 Å²	205	137.4 Å²	137.4	96%	0.958	81%	0.812	S	S	*	*			trans	-148.1	166.7	146.1	-126.1	178.8	170.6	0	0	111.1
1074	A	30.2	Very low	29.8	Very low	92 Å²	92	131.3 Å²	131.3	76%	0.76	81%	0.808	S	S	*	*			trans	-123.4	-158.7	-166.2	0	0	0	0	0	109.9
1075	P	41.5	Very low	29.8	Very low	121 Å²	121	133.2 Å²	133.2	79%	0.786	81%	0.811	S	S	*	*			cis	-135.8	-179.4	13.4	43.5	-24.3	0	0	0	117.5
1076	K	30.3	Very low	29.6	Very low	195 Å²	195	132.4 Å²	132.4	85%	0.848	81%	0.81	S	S	*	*			trans	-42.6	145.1	169	-49.8	155.7	-176.5	171.3	0	114.2
1077	Q	29.1	Very low	29.5	Very low	191 Å²	191	127.7 Å²	127.7	89%	0.893	80%	0.795	S	S	*	*				-161.8	161.5	119.4	-114	179.8	77.3	0	0	111.8
1078	G	27.3	Very low	29.5	Very low	64 Å²	64	130.4 Å²	130.4	66%	0.66	79%	0.79	S	S	*	*			trans	-144.5	139.8	179	0	0	0	0	0	112.5
1079	K	31.1	Very low	29.4	Very low	207 Å²	207	126 Å²	126	90%	0.9	78%	0.776	S	S	*	*			trans	-172.7	155	168.4	-99.2	157.8	-175.7	176.4	0	106.3
1080	G	27.4	Very low	29.4	Very low	61 Å²	61	126.5 Å²	126.5	63%	0.629	77%	0.769	S	S	*	*			cis	149	98.9	-5	0	0	0	0	0	112.4
1081	H	30	Very low	29.5	Very low	185 Å²	185	126.5 Å²	126.5	86%	0.856	76%	0.759	S	S	*	*			trans	69.1	145.4	160.4	-72.2	-92	0	0	0	121.4
1082	S	27.7	Very low	29.7	Very low	114 Å²	114	127.9 Å²	127.9	80%	0.797	75%	0.753	S	S	*	*			trans	69.1	159.3	149.7	-65.1	0	0	0	0	117.8
1083	A	28.3	Very low	29.6	Very low	92 Å²	92	132.1 Å²	132.1	76%	0.76	75%	0.752	S	S	*	*			cis	178.8	159.3	-21.4	0	0	0	0	0	105.9
1084	A	28.8	Very low	29.9	Very low	92 Å²	92	131.4 Å²	131.4	76%	0.76	75%	0.745	S	S	*	*			cis	-168	173.4	-21.8	0	0	0	0	0	108.6
1085	S	27.8	Very low	29.9	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	75%	0.745	S	S	*	*			trans	80.6	139.1	150.6	-148.7	0	0	0	0	121.1
1086	S	28.1	Very low	29.9	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	77%	0.772	S	S	*	*			trans	65.7	144.2	150.5	-70.5	0	0	0	0	121.8
1087	A	28.3	Very low	29.9	Very low	70 Å²	70	132.3 Å²	132.3	58%	0.579	77%	0.768	S	S	*	*			cis	-167.7	173.3	-17.7	0	0	0	0	0	111.5
1088	H	28.5	Very low	29.9	Very low	156 Å²	156	129.2 Å²	129.2	72%	0.722	76%	0.762	S	S	*	*			trans	73.3	88	153.2	-83.2	-67.4	0	0	0	121.4
1089	T	29.3	Very low	30	Very low	94 Å²	94	132.8 Å²	132.8	58%	0.577	77%	0.767	S	S	*	*				49.7	119.1	113.6	59.3	0	0	0	0	120.9
1090	E	28.5	Very low	30	Very low	158 Å²	158	128.4 Å²	128.4	74%	0.738	76%	0.759	S	S	*	*				56	155.1	119.1	-63.6	-141.1	82.4	0	0	120.3
1091	H	31.5	Very low	30.1	Very low	132 Å²	132	132.6 Å²	132.6	61%	0.611	77%	0.768	S	S	*	*			cis	-167.8	166.1	39.4	-152.8	30.8	0	0	0	112.9
1092	L	30.1	Very low	30.2	Very low	121 Å²	121	129.1 Å²	129.1	63%	0.634	76%	0.762	S	S	*	*			trans	72.4	137.8	161.7	-55.6	166.5	0	0	0	118.4
1093	R	29.8	Very low	30.3	Very low	204 Å²	204	130.2 Å²	130.2	77%	0.77	76%	0.759	S	S	*	*			cis	117.6	140.7	4.8	-177.6	-166	-174.2	-174.4	6.1	112.6
1094	K	33.8	Very low	30.5	Very low	190 Å²	190	133.2 Å²	133.2	83%	0.826	76%	0.759	S	S	*	*			trans	91.6	140.4	175.2	-53.2	177.5	-173.1	176.8	0	114.8
1095	G	31.6	Very low	30.6	Very low	74 Å²	74	136.6 Å²	136.6	76%	0.763	76%	0.759	S	S	*	*			cis	116.7	121.8	-15.6	0	0	0	0	0	116.1
1096	T	40.4	Very low	30.9	Very low	219 Å²	219	138.9 Å²	138.9	100%	1.344	76%	0.757	S	S	*	*			trans	-149.9	0	159.9	49.8	0	0	0	0	107.5

Retrieved 1,096 of 1,096 residues in 139.3 ms (Link to these results)

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