A0A5K4F0Q9_SCHMA Loading...

PAS domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F0Q9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,342 aa.

						>A0A5K4F0Q9_SCHMA|A0A5K4F0Q9
MCLPTTAPRSLPGCPTNYNKSRKKNVSSHEKEKLKVDNQSYNPSLPSDYNPIISKNCDLQVKSENNSKGKQTYERREKSRIAARQRRHRENQALVELYLTLPIQQNLAADVLKNKCHKVGQLGGDNHGQILDGLTESGSLLNTIGELDFAPTYRLATTIFRQHNLSTPVLEKAVIVRIASNSLCLYNWLYPSTESDSNTKPQNKLPLVGCYPTESDSSSSSITCMEMSDCCDNTTATTTSSSGTFGIQIPLTSSTTPVFPKSVLSVHSKCLVAIIVDATHNIIIYAPPAYTELIGLSWVTTIGLKLNELVSRQVSIGVSSELRSHNCCHYLRNLQYGKYSSVENMITNSKQKSIQTELGDMEYVEYDPVAISNHTLKSAQIHQQFEQPLSCEMIWPSSYGITNRPLCLSSVLPKPISVSPSHIECSEHLNDETNLGSVQGFQDPSIANTSVSKHIAEQFVLCWNSSNLSIRNKFSKHEDFTSDIGCSSLSSSSSSLSSSSPLPFSNNHINYKQTNNFSSNPNHNLNNRTDIGYRNSTEILLHNHNDSYPSNKNNSGDSEADYLFKSNRANDINLQIYLLQPIHLPNINNNTHNYVNKENYESCFTDNNNNIHNHSDRINNNIMNGNNISYNDHRNNTVQKNNTFIKFINNNNNSCCTSLSNSCRTYHSTKNLQFIDIANDFLIQSGYTKVDLLNKCLFDLIHIDDLVHVSEAINIVNENQPVVTSFYRLRLKCEKYCWARMLIFYCKQSYYHLSNTSSISTNNRLNNYQYPMNEISNYCMNFNEHYMIKNDKHFSSSELGNFDELNSFDKCTSSELLVCCHQLSHFYHCNDLSESSVTFEKEISNQLNVFKQPQFELINCEHLHGYNDSTSDSSIFTSQLLTTTTSTSQQNLMTKSNNNSDINNNDNNKTKYKYETTNFVSDSYESQCVSVPASSYVQGYSIFPSDEPNQLDELISSSSPSNEKEISSGSSFNSSISLSPSQHFQSYATTSPEKNIRITNDQEGFTLSTIGLKMKSDDHHLFNHSEHSVVANLTNTISDLTKKNITNLSCSTTKLCTHSSSSLQDVMYNKFGNSCSTTTTDSRMNPMVSCNVESQSTSQAFKQILPNKLFSFSKQCQNQRNPFNYNLPNNIKMPKFPNCGHYHPYTNCHSIRFNNSDSKRFLQKPHIESSNTSMNIFDYSPKGYKSTFLPQAHICPVFNDVVHKEPDDVYLVPPKKPRLYPPINNKDTNEFNPISNNINHSKESCNHMINELQFTNFINNRYFSTVNNDQHHLYKHVYDYTDNHIDNNNYDNEDYDFNNYSKNYIFQNSNRCQCCNNYELLNLDPQYYHQNSQYHLDYQQQQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	28.1	Very low	31.6	Very low	243 Å²	243	141.8 Å²	141.8	100%	1.197	81%	0.808	S	S	*	*				0	140.6	0	-62.5	168	-179.9	0	0	107
2	C	32.3	Very low	31.7	Very low	126 Å²	126	140.3 Å²	140.3	85%	0.851	81%	0.808	S	S	*	*			cis	-114	163.3	2.7	-65.5	0	0	0	0	112.3
3	L	30	Very low	31.5	Very low	146 Å²	146	135.5 Å²	135.5	76%	0.764	81%	0.807	S	S	*	*			trans	-85.6	160.8	166.2	-71.8	159.1	0	0	0	109.6	T5	L3-T5 HydrophobicContact CB-CG2 4.06Å
4	P	34.5	Very low	31.1	Very low	123 Å²	123	135 Å²	135	80%	0.799	81%	0.811	S	S	*	*				-123.1	121.3	93.1	0.8	20.3	0	0	0	111.3
5	T	33.6	Very low	31.2	Very low	94 Å²	94	133.1 Å²	133.1	58%	0.577	80%	0.803	S	S	*	*				69.9	112.5	73.8	62.7	0	0	0	0	116.2	L3	L3-T5 HydrophobicContact CB-CG2 4.06Å
6	T	33.3	Very low	31.1	Very low	131 Å²	131	131.5 Å²	131.5	80%	0.804	79%	0.794	S	S	*	*			trans	57.4	103.5	141.5	58.2	0	0	0	0	120
7	A	34.9	Very low	31	Very low	97 Å²	97	131.8 Å²	131.8	80%	0.802	79%	0.79	S	S	*	*			trans	-73.1	160.8	141.4	0	0	0	0	0	110.7
8	P	30.3	Very low	30.8	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	79%	0.788	S	S	*	*			trans	-134.4	145.5	134.3	36.9	-26.6	0	0	0	114
9	R	30.4	Very low	30.7	Very low	235 Å²	235	135 Å²	135	89%	0.887	78%	0.784	S	S	*	*			trans	33.9	134.1	136.3	-60.3	175.7	-179	177.9	-1	119.3
10	S	28.9	Very low	30.7	Very low	89 Å²	89	138.4 Å²	138.4	62%	0.622	79%	0.789	S	S	*	*			cis	147.7	135.2	-10.6	47.2	0	0	0	0	107.6
11	L	31.3	Very low	30.7	Very low	166 Å²	166	136.3 Å²	136.3	87%	0.869	78%	0.783	S	S	*	*			trans	66.8	166.8	161.2	-65.5	162	0	0	0	117.3
12	P	33.4	Very low	30.7	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	77%	0.766	S	S	*	*			cis	-129.8	178.5	-19.4	31.5	-12.1	0	0	0	114.4
13	G	28.1	Very low	30.6	Very low	78 Å²	78	137.5 Å²	137.5	80%	0.804	76%	0.761	S	S	*	*			trans	116.2	119.6	138.6	0	0	0	0	0	120.1
14	C	25.8	Very low	30.6	Very low	128 Å²	128	139.9 Å²	139.9	87%	0.865	77%	0.765	S	S	*	*			trans	-73.2	-171.3	166	-53.3	0	0	0	0	112.1
15	P	33.6	Very low	30.3	Very low	106 Å²	106	141 Å²	141	69%	0.688	77%	0.765	S	S	*	*			cis	-144.5	173.6	6.1	42.3	-21.4	0	0	0	119.1
16	T	28.9	Very low	30.2	Very low	108 Å²	108	142.8 Å²	142.8	66%	0.663	78%	0.775	S	S	*	*			trans	37	132.4	145.1	58.4	0	0	0	0	123.3
17	N	28.9	Very low	30.1	Very low	136 Å²	136	141.3 Å²	141.3	73%	0.727	77%	0.77	S	S	*	*				177.8	140	101.1	-92.3	-36.8	0	0	0	118.4
18	Y	27.7	Very low	29.7	Very low	191 Å²	191	141.4 Å²	141.4	75%	0.749	77%	0.765	S	S	*	*			trans	53.5	103.5	148.4	-78	-106.4	0	0	0	125
19	N	29	Very low	29.8	Very low	134 Å²	134	143.8 Å²	143.8	72%	0.717	77%	0.766	S	S	*	*				38.8	120.8	104.1	-71.3	-39.8	0	0	0	121.9
20	K	31.7	Very low	29.8	Very low	203 Å²	203	138.9 Å²	138.9	88%	0.883	75%	0.753	S	S	*	*			trans	160.6	150	133.6	-89.4	159.2	-176.5	175.2	0	109.7
21	S	29.5	Very low	30.1	Very low	94 Å²	94	141.4 Å²	141.4	66%	0.657	75%	0.753	S	S	*	*			cis	-170.1	-179.2	-12.3	58.9	0	0	0	0	110
22	R	28.8	Very low	30.1	Very low	224 Å²	224	139.4 Å²	139.4	85%	0.845	74%	0.739	S	S	*	*			trans	75.9	137.5	174.8	-57.7	-179	173.3	-178.1	-2	115.3
23	K	30.8	Very low	30.1	Very low	171 Å²	171	141.3 Å²	141.3	74%	0.743	74%	0.735	S	S	*	*			cis	-150.9	128.4	-6	-125.6	-179.1	-179.8	-168.8	0	110.3
24	K	29.7	Very low	30.1	Very low	196 Å²	196	144.3 Å²	144.3	85%	0.852	73%	0.732	S	S	*	*			trans	-79.8	143.6	153.3	-81.3	-172	175.5	-175.4	0	108.2
25	N	27	Very low	30.5	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	73%	0.73	S	S	*	*			trans	-134.4	73.5	159.8	-112.4	48.3	0	0	0	108.3
26	V	31.7	Very low	30.3	Very low	130 Å²	130	147.8 Å²	147.8	79%	0.788	73%	0.731	S	S	*	*			trans	-136.3	120.1	157.5	-178.5	0	0	0	0	105.9
27	S	30.7	Very low	30.4	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	74%	0.736	S	S	*	*			trans	-59.4	125	172.4	29.6	0	0	0	0	109.5
28	S	26.8	Very low	30.4	Very low	99 Å²	99	148.7 Å²	148.7	69%	0.692	73%	0.732	S	S	*	*				65	83	67	78.9	0	0	0	0	113.7
29	H	32.5	Very low	30.3	Very low	160 Å²	160	147.8 Å²	147.8	74%	0.741	73%	0.734	S	S	*	*				-151	128.4	124.5	-94	-77.3	0	0	0	105.2
30	E	30.6	Very low	30.1	Very low	132 Å²	132	146.2 Å²	146.2	62%	0.617	73%	0.734	S	S	*	*				62.7	132.7	87.4	-65	-161.9	138.5	0	0	113.4
31	K	34.6	Very low	29.9	Very low	142 Å²	142	147.5 Å²	147.5	62%	0.617	73%	0.734	S	S	*	*			cis	-155.2	151.5	7.9	-114.6	155.6	-177.6	139.3	0	111
32	E	32.1	Very low	29.7	Very low	124 Å²	124	149.8 Å²	149.8	58%	0.579	74%	0.74	S	S	*	*			trans	47.8	124.4	139.7	-66.5	-174.4	110.6	0	0	121.6
33	K	33.1	Very low	29.8	Very low	165 Å²	165	145.5 Å²	145.5	72%	0.717	74%	0.74	S	S	*	*				68.5	146.8	95.7	-63	174.7	-172.3	165.2	0	114
34	L	29.1	Very low	29.7	Very low	141 Å²	141	142 Å²	142	74%	0.738	74%	0.738	S	S	*	*			cis	-163.1	179.4	0.3	-119.4	168.8	0	0	0	108.9
35	K	33.2	Very low	29.5	Very low	191 Å²	191	140.8 Å²	140.8	83%	0.83	74%	0.74	S	S	*	*			trans	73.6	124	178.9	-53.7	-177	-179.7	-175.5	0	112.9
36	V	30.4	Very low	29.7	Very low	116 Å²	116	139.2 Å²	139.2	70%	0.703	74%	0.737	S	S	*	*			cis	66.1	98.8	22	-165	0	0	0	0	113.1
37	D	31.3	Very low	29.4	Very low	144 Å²	144	137 Å²	137	77%	0.77	73%	0.728	S	S	*	*				-155.8	-178.5	108.1	-124.2	-52.3	0	0	0	113.4
38	N	27.4	Very low	29.3	Very low	119 Å²	119	138.8 Å²	138.8	64%	0.636	73%	0.729	S	S	*	*			trans	-89	163.4	-152	-82.6	-85.5	0	0	0	118.8
39	Q	26.6	Very low	29.3	Very low	171 Å²	171	144.3 Å²	144.3	80%	0.799	74%	0.737	S	S	*	*			trans	83.8	133	143.9	-79.3	157.7	28.1	0	0	122.8
40	S	24	Very low	29.1	Very low	102 Å²	102	142.1 Å²	142.1	71%	0.713	73%	0.731	S	S	*	*			trans	38.5	100.4	153.6	59	0	0	0	0	120.1
41	Y	28.8	Very low	29.2	Very low	229 Å²	229	140.2 Å²	140.2	90%	0.898	73%	0.729	S	S	*	*			trans	-145.7	147.2	140.8	-112.9	-81.2	0	0	0	111.5
42	N	24.6	Very low	28.8	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	73%	0.725	S	S	*	*			trans	-77.3	138	-174.3	-62.8	-47.8	0	0	0	112.6	S44	N42-S44 VanDerWaalsContact C-N 3.32Å; N42-S44 PolarHBondContact O-N 3.39Å
43	P	31.6	Very low	28.8	Very low	133 Å²	133	138.2 Å²	138.2	86%	0.864	73%	0.727	S	S	*	*			trans	-81.7	81.8	153.8	33.5	-29.4	0	0	0	108.9
44	S	28.9	Very low	28.8	Very low	99 Å²	99	133.5 Å²	133.5	69%	0.692	72%	0.715	S	S	*	*			trans	-58.7	149.5	168.5	48.5	0	0	0	0	111.2	N42 P46	N42-S44 VanDerWaalsContact C-N 3.32Å; N42-S44 PolarHBondContact O-N 3.39Å; S44-P46 WeakPolarHBondContact O-CD 3.39Å
45	L	25.1	Very low	28.9	Very low	170 Å²	170	134 Å²	134	89%	0.89	71%	0.711	S	S	*	*			trans	-52.7	125.9	177.5	-71.1	137.1	0	0	0	111.8	S47	L45-S47 PolarHBondContact O-N 2.92Å
46	P	31	Very low	28.8	Very low	113 Å²	113	131.2 Å²	131.2	73%	0.734	71%	0.705	S	S	*	*			trans	-78.5	111.6	153.5	-3.2	22.1	0	0	0	107.7	S44	S44-P46 WeakPolarHBondContact O-CD 3.39Å
47	S	25.9	Very low	28.9	Very low	84 Å²	84	131.3 Å²	131.3	59%	0.587	71%	0.71	S	S	*	*			trans	-69.6	172.4	163.6	60.3	0	0	0	0	110.7	L45	L45-S47 PolarHBondContact O-N 2.92Å
48	D	26.8	Very low	28.8	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	71%	0.711	S	S	*	*			trans	61.8	50.4	156.3	-47.6	-47.9	0	0	0	118.5	N50	D48-N50 VanDerWaalsContact C-N 3.3Å; D48-N50 PolarHBondContact O-N 2.83Å; D48-N50 VanDerWaalsContact O-N 3.12Å
49	Y	28.7	Very low	29.1	Very low	215 Å²	215	133.5 Å²	133.5	84%	0.843	72%	0.721	S	S	*	*			trans	-85.8	66	165.2	-115.4	-78.5	0	0	0	113.8
50	N	27.4	Very low	29.2	Very low	115 Å²	115	133.5 Å²	133.5	62%	0.615	72%	0.72	S	S	*	*			trans	-58.4	129.1	159.1	-90.3	-57.1	0	0	0	109.4	D48 I52	D48-N50 VanDerWaalsContact C-N 3.3Å; D48-N50 PolarHBondContact O-N 2.83Å; D48-N50 VanDerWaalsContact O-N 3.12Å; N50-I52 HydrophobicContact CB-CD1 4.44Å; N50-I52 HydrophobicContact CB-CG1 4.28Å; N50-I52 PolarHBondContact O-N 3.3Å
51	P	32.7	Very low	29.9	Very low	91 Å²	91	134.8 Å²	134.8	59%	0.591	72%	0.724	S	S	*	*			trans	-76.7	63	172.4	33.3	-35.2	0	0	0	110.4	I53 T990	P51-I53 PolarHBondContact O-N 2.88Å; P51-I53 VanDerWaalsContact O-N 3.11Å; P51-T990 WeakPolarHBondContact O-CG2 3.49Å
52	I	26.5	Very low	30	Very low	104 Å²	104	132.9 Å²	132.9	53%	0.533	72%	0.72	S	S	.	*			trans	-68.8	100.4	162.3	-75.7	173.6	0	0	0	106.5	N50 S991 P992	N50-I52 HydrophobicContact CB-CD1 4.44Å; N50-I52 HydrophobicContact CB-CG1 4.28Å; N50-I52 PolarHBondContact O-N 3.3Å; I52-S991 WeakPolarHBondContact CA-OG 3.45Å; I52-P992 HydrophobicContact CG2-CB 3.54Å; I52-P992 HydrophobicContact CG2-CG 3.48Å; I52-P992 VanDerWaalsContact CG2-CG 3.48Å
53	I	32.3	Very low	30.7	Very low	121 Å²	121	130.9 Å²	130.9	62%	0.621	72%	0.718	S	S	*	*			trans	-99.3	109.3	171.3	-65.3	-179.4	0	0	0	106.7	P51 S991	P51-I53 PolarHBondContact O-N 2.88Å; P51-I53 VanDerWaalsContact O-N 3.11Å; I53-S991 PolarHBondContact N-OG 3.41Å; I53-S991 VanDerWaalsContact N-OG 3.08Å; I53-S991 PolarHBondContact O-OG 3.22Å
54	S	31.9	Very low	30.7	Very low	65 Å²	65	132.3 Å²	132.3	46%	0.455	71%	0.713	S	S	.	*			trans	-62.7	136.6	-178.9	51	0	0	0	0	112.1
55	K	31.3	Very low	31.2	Very low	153 Å²	153	135 Å²	135	67%	0.665	72%	0.719	S	S	*	*	S	Bend	trans	-60.2	161.7	152.2	-63.4	170.6	-175.4	171.1	0	108.7
56	N	30.9	Very low	32.2	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	71%	0.709	S	S	*	*			trans	66.8	84.7	171.5	-47.9	-13.1	0	0	0	115.1
57	C	32.2	Very low	33.2	Very low	117 Å²	117	132 Å²	132	79%	0.791	71%	0.705	S	S	*	*			trans	-143.7	76.2	154.7	-95.5	0	0	0	0	109	L59	C57-L59 PolarHBondContact O-N 3.22Å
58	D	29.1	Very low	34.6	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	71%	0.711	S	S	*	*			trans	-73.4	84.2	178.2	-74.9	-60.9	0	0	0	111.9
59	L	35	Very low	36.6	Very low	162 Å²	162	130.7 Å²	130.7	85%	0.848	69%	0.691	S	S	*	*			trans	-92.1	98.2	162.8	-82.9	169.2	0	0	0	109.9	C57 V61	C57-L59 PolarHBondContact O-N 3.22Å; L59-V61 PolarHBondContact O-N 3.22Å
60	Q	29.3	Very low	38.7	Very low	170 Å²	170	127.4 Å²	127.4	79%	0.794	68%	0.681	S	S	*	*			trans	-65.6	94.1	179	-63.5	-175.8	11.6	0	0	112.1
61	V	37.6	Very low	40.8	Very low	130 Å²	130	128.5 Å²	128.5	79%	0.788	68%	0.682	S	S	*	*			trans	-103	104.7	164.7	-177.7	0	0	0	0	109	L59 S63	L59-V61 PolarHBondContact O-N 3.22Å; V61-S63 PolarHBondContact O-N 3.26Å
62	K	32.2	Very low	42.8	Very low	189 Å²	189	128.5 Å²	128.5	82%	0.822	68%	0.681	S	S	*	*			trans	-76	116.8	178	-62.4	177	-178.1	177.4	0	111
63	S	38.2	Very low	45.3	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	69%	0.685	S	S	*	*			trans	-166.6	125.4	152.1	58.5	0	0	0	0	109.4	V61	V61-S63 PolarHBondContact O-N 3.26Å
64	E	32.5	Very low	47.6	Very low	163 Å²	163	129 Å²	129	76%	0.762	67%	0.673	S	S	*	*			trans	-72.5	178.3	-176	-60.6	98.6	146.4	0	0	114.4
65	N	39.5	Very low	49.9	Very low	154 Å²	154	135.3 Å²	135.3	82%	0.824	69%	0.687	S	S	*	*			trans	69.6	50.7	157	-56.6	-35.5	0	0	0	118.2
66	N	45.1	Very low	52.3	Low	126 Å²	126	137.6 Å²	137.6	67%	0.674	69%	0.691	S	S	*	*			trans	-146.5	44.2	167.3	-118.6	-42.7	0	0	0	117.3	K68 G69 K70	N66-K68 VanDerWaalsContact C-N 3.28Å; N66-K68 PolarHBondContact O-N 3.05Å; N66-G69 WeakPolarHBondContact O-CA 3.26Å; N66-G69 PolarHBondContact O-N 3.39Å; N66-K70 PolarHBondContact O-N 2.6Å
67	S	51.2	Low	54.7	Low	94 Å²	94	133.4 Å²	133.4	66%	0.657	67%	0.667	S	S	*	*	H	α-helix	trans	-55.7	-38.3	174.7	56	0	0	0	0	113.7	G69 K70 Q71	S67-G69 VanDerWaalsContact C-N 3.3Å; S67-G69 PolarHBondContact O-N 2.7Å; S67-K70 PolarHBondContact O-N 3.27Å; S67-Q71 PolarHBondContact O-N 3.37Å
68	K	55.4	Low	57.1	Low	165 Å²	165	131.7 Å²	131.7	72%	0.717	65%	0.646	S	S	*	*	H	α-helix	trans	-62	-34.9	173.2	-66.9	-178.1	179.1	177.9	0	112.5	N66 T72	N66-K68 VanDerWaalsContact C-N 3.28Å; N66-K68 PolarHBondContact O-N 3.05Å; K68-T72 WeakPolarHBondContact O-CB 3.46Å; K68-T72 WeakPolarHBondContact O-CG2 3.4Å; K68-T72 PolarHBondContact O-N 3.36Å; K68-T72 PolarHBondContact O-OG1 3.13Å
69	G	68.8	Low	59.5	Low	30 Å²	30	128.1 Å²	128.1	31%	0.309	63%	0.633	S	S	.	*	H	α-helix	trans	-64.1	-45.3	175.4	0	0	0	0	0	112.6	N66 S67 T72 Y73	N66-G69 WeakPolarHBondContact O-CA 3.26Å; N66-G69 PolarHBondContact O-N 3.39Å; S67-G69 VanDerWaalsContact C-N 3.3Å; S67-G69 PolarHBondContact O-N 2.7Å; G69-T72 WeakPolarHBondContact CA-OG1 3.22Å; G69-T72 PolarHBondContact O-N 3.02Å; G69-T72 PolarHBondContact O-OG1 3.25Å; G69-Y73 WeakPolarHBondContact O-CB 3.28Å; G69-Y73 PolarHBondContact O-N 3.1Å
70	K	72.6	Confident	61.8	Low	146 Å²	146	126 Å²	126	64%	0.635	61%	0.614	S	S	*	*	H	α-helix	trans	-65.3	-45.9	178.4	-167.7	173.5	179.1	178.4	0	112.1	N66 S67 T72 Y73 E74	N66-K70 PolarHBondContact O-N 2.6Å; S67-K70 PolarHBondContact O-N 3.27Å; K70-T72 PolarHBondContact O-N 3.06Å; K70-Y73 PolarHBondContact O-N 2.72Å; K70-E74 WeakPolarHBondContact CE-OE1 3.37Å; K70-E74 WeakPolarHBondContact O-CG 3.35Å; K70-E74 PolarHBondContact O-N 3.01Å
71	Q	73	Confident	64.3	Low	137 Å²	137	121.5 Å²	121.5	64%	0.64	59%	0.594	S	S	*	*	H	α-helix	trans	-62.9	-38.5	176.9	-72	-176	-11	0	0	113.2	S67 R75	S67-Q71 PolarHBondContact O-N 3.37Å; Q71-R75 VanDerWaalsContact O-CB 3.32Å; Q71-R75 WeakPolarHBondContact O-CB 3.42Å; Q71-R75 PolarHBondContact O-N 3.21Å
72	T	75.3	Confident	66.2	Low	92 Å²	92	116.9 Å²	116.9	56%	0.564	57%	0.57	S	S	*	*	H	α-helix	trans	-71	-35.4	177.1	48.1	0	0	0	0	112.4	K68 G69 K70 R76	K68-T72 WeakPolarHBondContact O-CB 3.46Å; K68-T72 WeakPolarHBondContact O-CG2 3.4Å; K68-T72 PolarHBondContact O-N 3.36Å; K68-T72 PolarHBondContact O-OG1 3.13Å; G69-T72 WeakPolarHBondContact CA-OG1 3.22Å; G69-T72 PolarHBondContact O-N 3.02Å; G69-T72 PolarHBondContact O-OG1 3.25Å; K70-T72 PolarHBondContact O-N 3.06Å; T72-R76 WeakPolarHBondContact O-CB 3.28Å; T72-R76 PolarHBondContact O-N 3.31Å
73	Y	78.6	Confident	68.4	Low	159 Å²	159	109.9 Å²	109.9	62%	0.624	55%	0.547	S	S	*	.	H	α-helix	trans	-62	-50.9	170.2	-177.3	-95	0	0	0	111.9	G69 K70 R75 R76 E77	G69-Y73 WeakPolarHBondContact O-CB 3.28Å; G69-Y73 PolarHBondContact O-N 3.1Å; K70-Y73 PolarHBondContact O-N 2.72Å; Y73-R75 VanDerWaalsContact C-N 3.33Å; Y73-R75 PolarHBondContact O-N 3.04Å; Y73-R76 WeakPolarHBondContact O-CB 3.48Å; Y73-R76 PolarHBondContact O-N 3.4Å; Y73-R76 VanDerWaalsContact O-N 3.1Å; Y73-E77 PolarHBondContact O-N 3.39Å
74	E	80.7	Confident	70.4	Confident	77 Å²	77	112.5 Å²	112.5	36%	0.36	54%	0.541	S	S	.	.	H	α-helix	trans	-60.3	-39.9	177.6	-73.3	178.8	-148.6	0	0	112.7	K70 E77 K78	K70-E74 WeakPolarHBondContact CE-OE1 3.37Å; K70-E74 WeakPolarHBondContact O-CG 3.35Å; K70-E74 PolarHBondContact O-N 3.01Å; E74-E77 PolarHBondContact O-N 3.04Å; E74-K78 WeakPolarHBondContact O-CB 3.43Å; E74-K78 WeakPolarHBondContact O-CG 3.42Å; E74-K78 PolarHBondContact O-N 3.04Å; E74-K78 IonicContact OE2-NZ 2.71Å
75	R	79.8	Confident	72.5	Confident	196 Å²	196	110.2 Å²	110.2	74%	0.74	53%	0.531	S	S	*	.	H	α-helix	trans	-64	-40.1	174.7	-171.8	176.9	-178.1	179.9	1.2	111.5	Q71 Y73 S79	Q71-R75 VanDerWaalsContact O-CB 3.32Å; Q71-R75 WeakPolarHBondContact O-CB 3.42Å; Q71-R75 PolarHBondContact O-N 3.21Å; Y73-R75 VanDerWaalsContact C-N 3.33Å; Y73-R75 PolarHBondContact O-N 3.04Å; R75-S79 WeakPolarHBondContact O-CB 3.27Å; R75-S79 PolarHBondContact O-N 3.17Å; R75-S79 VanDerWaalsContact O-N 3.09Å; R75-S79 PolarHBondContact O-OG 3.49Å
76	R	81.2	Confident	74.2	Confident	201 Å²	201	108.8 Å²	108.8	76%	0.758	51%	0.514	S	S	*	.	H	α-helix	trans	-65.8	-40.3	175.7	-169.7	177.9	-173.2	177.8	2.1	111.6	T72 Y73 S79 R80	T72-R76 WeakPolarHBondContact O-CB 3.28Å; T72-R76 PolarHBondContact O-N 3.31Å; Y73-R76 WeakPolarHBondContact O-CB 3.48Å; Y73-R76 PolarHBondContact O-N 3.4Å; Y73-R76 VanDerWaalsContact O-N 3.1Å; R76-S79 WeakPolarHBondContact O-CB 3.33Å; R76-S79 PolarHBondContact O-N 2.89Å; R76-R80 PolarHBondContact O-N 2.97Å
77	E	80.6	Confident	75.7	Confident	45 Å²	45	111 Å²	111	21%	0.21	51%	0.513	C	S	.	.	H	α-helix	trans	-73.4	-44.9	-179.3	-175.7	50.9	-147.7	0	0	112.6	Y73 E74 S79 R80 I81	Y73-E77 PolarHBondContact O-N 3.39Å; E74-E77 PolarHBondContact O-N 3.04Å; E77-S79 PolarHBondContact O-N 3.43Å; E77-R80 VanDerWaalsContact CD-NE 3.26Å; E77-R80 WeakPolarHBondContact O-CA 3.44Å; E77-R80 WeakPolarHBondContact O-CB 3.42Å; E77-R80 PolarHBondContact O-N 3.32Å; E77-R80 IonicContact OE1-CZ 2.61Å; E77-R80 IonicContact OE1-NE 2.67Å; E77-R80 PolarHBondContact OE1-NE 3.38Å; E77-R80 IonicContact OE1-NH2 3.22Å; E77-R80 PolarHBondContact OE1-NH2 3.1Å; E77-R80 WeakPolarHBondContact OE2-CD 3.47Å; E77-R80 IonicContact OE2-CZ 3.74Å; E77-R80 IonicContact OE2-NE 3.53Å; E77-R80 PolarHBondContact OE2-NE 3.39Å; E77-R80 IonicContact OE2-NH2 3.42Å; E77-I81 HydrophobicContact CG-CD1 4.19Å; E77-I81 WeakPolarHBondContact O-CG1 3.32Å; E77-I81 PolarHBondContact O-N 3.5Å; E77-I81 WeakPolarHBondContact OE1-CG1 3.35Å
78	K	83	Confident	76.9	Confident	81 Å²	81	110.7 Å²	110.7	35%	0.352	50%	0.501	S	S	.	.	H	α-helix	trans	-55.6	-38.6	170.2	-73.6	165.2	175.6	164.7	0	111.2	E74 A82 Y987	E74-K78 WeakPolarHBondContact O-CB 3.43Å; E74-K78 WeakPolarHBondContact O-CG 3.42Å; E74-K78 PolarHBondContact O-N 3.04Å; E74-K78 IonicContact OE2-NZ 2.71Å; K78-A82 WeakPolarHBondContact O-CB 3.28Å; K78-A82 PolarHBondContact O-N 3.09Å; K78-Y987 HydrophobicContact CD-CE1 3.91Å; K78-Y987 HydrophobicContact CD-CE2 4.17Å; K78-Y987 HydrophobicContact CG-CE1 3.94Å
79	S	80.7	Confident	77.8	Confident	72 Å²	72	107.6 Å²	107.6	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-65.9	-39.5	172.8	-54.4	0	0	0	0	113.1	R75 R76 E77 A83	R75-S79 WeakPolarHBondContact O-CB 3.27Å; R75-S79 PolarHBondContact O-N 3.17Å; R75-S79 VanDerWaalsContact O-N 3.09Å; R75-S79 PolarHBondContact O-OG 3.49Å; R76-S79 WeakPolarHBondContact O-CB 3.33Å; R76-S79 PolarHBondContact O-N 2.89Å; E77-S79 PolarHBondContact O-N 3.43Å; S79-A83 WeakPolarHBondContact O-CB 3.43Å; S79-A83 PolarHBondContact O-N 2.88Å
80	R	82.5	Confident	78.1	Confident	118 Å²	118	109.6 Å²	109.6	45%	0.445	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-43.6	177.2	-168.6	-173.3	73.5	128.6	1.3	111.7	R76 E77 A83 R84	R76-R80 PolarHBondContact O-N 2.97Å; E77-R80 VanDerWaalsContact CD-NE 3.26Å; E77-R80 WeakPolarHBondContact O-CA 3.44Å; E77-R80 WeakPolarHBondContact O-CB 3.42Å; E77-R80 PolarHBondContact O-N 3.32Å; E77-R80 IonicContact OE1-CZ 2.61Å; E77-R80 IonicContact OE1-NE 2.67Å; E77-R80 PolarHBondContact OE1-NE 3.38Å; E77-R80 IonicContact OE1-NH2 3.22Å; E77-R80 PolarHBondContact OE1-NH2 3.1Å; E77-R80 WeakPolarHBondContact OE2-CD 3.47Å; E77-R80 IonicContact OE2-CZ 3.74Å; E77-R80 IonicContact OE2-NE 3.53Å; E77-R80 PolarHBondContact OE2-NE 3.39Å; E77-R80 IonicContact OE2-NH2 3.42Å; R80-A83 PolarHBondContact O-N 3.48Å; R80-R84 WeakPolarHBondContact O-CG 3.4Å; R80-R84 PolarHBondContact O-N 2.91Å
81	I	82	Confident	78.3	Confident	75 Å²	75	104 Å²	104	39%	0.385	46%	0.463	S	S	.	.	H	α-helix	trans	-65.1	-48.4	177.4	-65.3	167.2	0	0	0	110.2	E77 A83 R84 Q85	E77-I81 HydrophobicContact CG-CD1 4.19Å; E77-I81 WeakPolarHBondContact O-CG1 3.32Å; E77-I81 PolarHBondContact O-N 3.5Å; E77-I81 WeakPolarHBondContact OE1-CG1 3.35Å; I81-A83 VanDerWaalsContact C-N 3.3Å; I81-A83 PolarHBondContact O-N 2.76Å; I81-R84 WeakPolarHBondContact O-CB 3.33Å; I81-R84 PolarHBondContact O-N 3.3Å; I81-R84 VanDerWaalsContact O-N 3.1Å; I81-Q85 PolarHBondContact O-N 2.73Å
82	A	77.5	Confident	78.3	Confident	33 Å²	33	101 Å²	101	27%	0.273	45%	0.449	S	S	.	.	H	α-helix	trans	-60.4	-37.3	176.6	0	0	0	0	0	112.7	K78 Q85 R86	K78-A82 WeakPolarHBondContact O-CB 3.28Å; K78-A82 PolarHBondContact O-N 3.09Å; A82-Q85 PolarHBondContact O-N 3.45Å; A82-R86 WeakPolarHBondContact O-CG 3.34Å; A82-R86 PolarHBondContact O-N 3.46Å
83	A	77.7	Confident	78.1	Confident	42 Å²	42	97.9 Å²	97.9	35%	0.347	43%	0.432	S	S	.	.	H	α-helix	trans	-66.6	-37.3	174.6	0	0	0	0	0	112.8	S79 R80 I81 R87	S79-A83 WeakPolarHBondContact O-CB 3.43Å; S79-A83 PolarHBondContact O-N 2.88Å; R80-A83 PolarHBondContact O-N 3.48Å; I81-A83 VanDerWaalsContact C-N 3.3Å; I81-A83 PolarHBondContact O-N 2.76Å; A83-R87 WeakPolarHBondContact O-CG 3.36Å; A83-R87 PolarHBondContact O-N 3.44Å
84	R	80	Confident	77.9	Confident	156 Å²	156	90.8 Å²	90.8	59%	0.589	41%	0.405	S	S	*	.	H	α-helix	trans	-64.2	-46.8	172.1	-74.9	174.4	164.6	-159.3	-9.1	111.5	R80 I81 R86 R87 H88	R80-R84 WeakPolarHBondContact O-CG 3.4Å; R80-R84 PolarHBondContact O-N 2.91Å; I81-R84 WeakPolarHBondContact O-CB 3.33Å; I81-R84 PolarHBondContact O-N 3.3Å; I81-R84 VanDerWaalsContact O-N 3.1Å; R84-R86 VanDerWaalsContact C-N 3.33Å; R84-R86 PolarHBondContact O-N 2.78Å; R84-R87 PolarHBondContact O-N 3.4Å; R84-H88 PolarHBondContact O-N 3.42Å
85	Q	78.4	Confident	77.4	Confident	115 Å²	115	87.6 Å²	87.6	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-64.9	-29.8	178.8	-72.5	175.9	-27.2	0	0	113.9	I81 A82 R89	I81-Q85 PolarHBondContact O-N 2.73Å; A82-Q85 PolarHBondContact O-N 3.45Å; Q85-R89 PolarHBondContact O-N 3.25Å; Q85-R89 PolarHBondContact O-NE 2.88Å
86	R	74.1	Confident	76.9	Confident	124 Å²	124	81.3 Å²	81.3	47%	0.468	37%	0.37	S	S	.	.	H	α-helix	trans	-66.9	-50.7	169.6	-76.1	-174.4	178.4	104.9	-7.2	111.4	A82 R84 H88 R89 E90 G303	A82-R86 WeakPolarHBondContact O-CG 3.34Å; A82-R86 PolarHBondContact O-N 3.46Å; R84-R86 VanDerWaalsContact C-N 3.33Å; R84-R86 PolarHBondContact O-N 2.78Å; R86-H88 VanDerWaalsContact C-N 3.31Å; R86-H88 PolarHBondContact O-N 3.4Å; R86-R89 PolarHBondContact O-N 3.37Å; R86-E90 WeakPolarHBondContact O-CB 3.33Å; R86-E90 PolarHBondContact O-N 2.86Å; R86-G303 PolarHBondContact NE-O 2.88Å
87	R	77.1	Confident	76.3	Confident	174 Å²	174	72.9 Å²	72.9	66%	0.657	34%	0.339	S	S	*	.	H	α-helix	trans	-63.7	-31.1	-179.1	-71.2	176.8	-179	179.6	0.2	114	A83 R84 N91	A83-R87 WeakPolarHBondContact O-CG 3.36Å; A83-R87 PolarHBondContact O-N 3.44Å; R84-R87 PolarHBondContact O-N 3.4Å; R87-N91 WeakPolarHBondContact O-CB 3.45Å; R87-N91 VanDerWaalsContact O-CG 3.29Å; R87-N91 PolarHBondContact O-N 3.15Å; R87-N91 VanDerWaalsContact O-N 3.11Å; R87-N91 PolarHBondContact O-ND2 2.86Å
88	H	76.4	Confident	75.7	Confident	86 Å²	86	71 Å²	71	40%	0.398	33%	0.331	S	S	.	.	H	α-helix	trans	-68.4	-50.3	176.2	-175.8	42.7	0	0	0	111.2	R84 R86 E90 N91 Q92 P151	R84-H88 PolarHBondContact O-N 3.42Å; R86-H88 VanDerWaalsContact C-N 3.31Å; R86-H88 PolarHBondContact O-N 3.4Å; H88-E90 PolarHBondContact O-N 2.94Å; H88-N91 WeakPolarHBondContact O-CA 3.29Å; H88-N91 WeakPolarHBondContact O-CB 3.32Å; H88-N91 PolarHBondContact O-N 3.24Å; H88-Q92 PolarHBondContact CD2-OE1 3.18Å; H88-Q92 WeakPolarHBondContact O-CG 3.38Å; H88-Q92 PolarHBondContact O-N 3.21Å; H88-P151 PolarHBondContact ND1-O 3.47Å
89	R	74.3	Confident	74.7	Confident	100 Å²	100	69.4 Å²	69.4	38%	0.377	33%	0.326	S	S	.	.	H	α-helix	trans	-62.1	-39.7	176	-72.1	-175	-71.3	168.6	-2.3	113.1	Q85 R86 N91 Q92 A93	Q85-R89 PolarHBondContact O-N 3.25Å; Q85-R89 PolarHBondContact O-NE 2.88Å; R86-R89 PolarHBondContact O-N 3.37Å; R89-N91 VanDerWaalsContact C-N 3.28Å; R89-N91 PolarHBondContact O-N 3.07Å; R89-Q92 PolarHBondContact O-N 3.03Å; R89-A93 WeakPolarHBondContact O-CB 3.13Å; R89-A93 PolarHBondContact O-N 2.89Å
90	E	74.2	Confident	73.9	Confident	73 Å²	73	68.4 Å²	68.4	34%	0.341	32%	0.316	S	S	.	.	H	α-helix	trans	-56.4	-41.8	171.2	-173.1	-144.1	129.7	0	0	111.7	R86 H88 L94 K172	R86-E90 WeakPolarHBondContact O-CB 3.33Å; R86-E90 PolarHBondContact O-N 2.86Å; H88-E90 PolarHBondContact O-N 2.94Å; E90-L94 HydrophobicContact CG-CD1 4.27Å; E90-L94 WeakPolarHBondContact O-CB 3.22Å; E90-L94 VanDerWaalsContact O-CD1 3.29Å; E90-L94 WeakPolarHBondContact O-CD1 3.45Å; E90-L94 WeakPolarHBondContact O-CG 3.18Å; E90-L94 PolarHBondContact O-N 3.02Å; E90-K172 IonicContact OE1-NZ 3.75Å; E90-K172 PolarHBondContact OE1-NZ 3.23Å
91	N	76.2	Confident	72.9	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.144	30%	0.298	C	S	.	.	H	α-helix	trans	-70.9	-39.6	177	-77.6	-28.1	0	0	0	113.2	R87 H88 R89 L94 V95 K172	R87-N91 WeakPolarHBondContact O-CB 3.45Å; R87-N91 VanDerWaalsContact O-CG 3.29Å; R87-N91 PolarHBondContact O-N 3.15Å; R87-N91 VanDerWaalsContact O-N 3.11Å; R87-N91 PolarHBondContact O-ND2 2.86Å; H88-N91 WeakPolarHBondContact O-CA 3.29Å; H88-N91 WeakPolarHBondContact O-CB 3.32Å; H88-N91 PolarHBondContact O-N 3.24Å; R89-N91 VanDerWaalsContact C-N 3.28Å; R89-N91 PolarHBondContact O-N 3.07Å; N91-L94 PolarHBondContact O-N 3.48Å; N91-V95 WeakPolarHBondContact O-CG2 3.44Å; N91-V95 PolarHBondContact O-N 2.74Å; N91-V95 VanDerWaalsContact O-N 3.14Å; N91-K172 WeakPolarHBondContact OD1-CE 3.49Å; N91-K172 PolarHBondContact OD1-NZ 3.36Å
92	Q	74	Confident	71.3	Confident	76 Å²	76	63.2 Å²	63.2	36%	0.355	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-52.4	178.8	-70.2	171.6	-73.8	0	0	110.6	H88 R89 L94 V95 E96	H88-Q92 PolarHBondContact CD2-OE1 3.18Å; H88-Q92 WeakPolarHBondContact O-CG 3.38Å; H88-Q92 PolarHBondContact O-N 3.21Å; R89-Q92 PolarHBondContact O-N 3.03Å; Q92-L94 PolarHBondContact O-N 3.21Å; Q92-L94 VanDerWaalsContact O-N 3.11Å; Q92-V95 WeakPolarHBondContact O-CA 3.26Å; Q92-V95 PolarHBondContact O-N 2.96Å; Q92-E96 WeakPolarHBondContact O-CG 3.21Å; Q92-E96 PolarHBondContact O-N 3.44Å
93	A	71.8	Confident	70.2	Confident	26 Å²	26	64 Å²	64	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-56.2	-31.8	176	0	0	0	0	0	112.9	R89 E96 L97	R89-A93 WeakPolarHBondContact O-CB 3.13Å; R89-A93 PolarHBondContact O-N 2.89Å; A93-E96 WeakPolarHBondContact CA-OE2 3.32Å; A93-L97 WeakPolarHBondContact O-CB 3.2Å; A93-L97 PolarHBondContact O-N 3.32Å
94	L	73.1	Confident	68.9	Low	10 Å²	10	65 Å²	65	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-79.1	-19.9	176	-74.6	168.4	0	0	0	114.6	E90 N91 Q92 Y98 Y153 K172 V176	E90-L94 HydrophobicContact CG-CD1 4.27Å; E90-L94 WeakPolarHBondContact O-CB 3.22Å; E90-L94 VanDerWaalsContact O-CD1 3.29Å; E90-L94 WeakPolarHBondContact O-CD1 3.45Å; E90-L94 WeakPolarHBondContact O-CG 3.18Å; E90-L94 PolarHBondContact O-N 3.02Å; N91-L94 PolarHBondContact O-N 3.48Å; Q92-L94 PolarHBondContact O-N 3.21Å; Q92-L94 VanDerWaalsContact O-N 3.11Å; L94-Y98 PolarHBondContact O-N 3.3Å; L94-Y153 HydrophobicContact CB-CD2 4.36Å; L94-K172 HydrophobicContact CD1-CB 4.14Å; L94-K172 HydrophobicContact CD1-CD 3.53Å; L94-K172 VanDerWaalsContact CD1-CE 3.42Å; L94-K172 HydrophobicContact CD1-CG 3.84Å; L94-V176 HydrophobicContact CD2-CG2 3.6Å
95	V	71.4	Confident	67	Low	9 Å²	9	63.9 Å²	63.9	6%	0.055	30%	0.3	C	S	.	.	H	α-helix	trans	-80.3	-48	169.8	173.2	0	0	0	0	109.3	N91 Q92 L97 Y98 L99 Y153 A156	N91-V95 WeakPolarHBondContact O-CG2 3.44Å; N91-V95 PolarHBondContact O-N 2.74Å; N91-V95 VanDerWaalsContact O-N 3.14Å; Q92-V95 WeakPolarHBondContact O-CA 3.26Å; Q92-V95 PolarHBondContact O-N 2.96Å; V95-L97 VanDerWaalsContact C-N 3.3Å; V95-L97 PolarHBondContact O-N 3.12Å; V95-Y98 WeakPolarHBondContact O-CA 3.42Å; V95-Y98 WeakPolarHBondContact O-CB 3.36Å; V95-Y98 PolarHBondContact O-N 3.33Å; V95-L99 HydrophobicContact CG1-CD1 4.08Å; V95-L99 WeakPolarHBondContact O-CG 3.33Å; V95-L99 PolarHBondContact O-N 3.3Å; V95-Y153 HydrophobicContact CG2-CD2 4.3Å; V95-A156 HydrophobicContact CG1-CB 4.19Å; V95-A156 HydrophobicContact CG2-CB 3.75Å
96	E	68.5	Low	65.1	Low	65 Å²	65	62.5 Å²	62.5	30%	0.304	30%	0.297	S	S	.	.	H	α-helix	trans	-55.8	-44.2	174.1	-65.8	165.6	157.2	0	0	111.4	Q92 A93 Y98 L99 T100 I572	Q92-E96 WeakPolarHBondContact O-CG 3.21Å; Q92-E96 PolarHBondContact O-N 3.44Å; A93-E96 WeakPolarHBondContact CA-OE2 3.32Å; E96-Y98 VanDerWaalsContact C-N 3.26Å; E96-Y98 PolarHBondContact O-N 2.99Å; E96-L99 PolarHBondContact O-N 3.21Å; E96-T100 WeakPolarHBondContact O-CB 3.47Å; E96-T100 VanDerWaalsContact O-CG2 3.31Å; E96-T100 WeakPolarHBondContact O-CG2 3.38Å; E96-T100 PolarHBondContact O-N 3.29Å; E96-T100 PolarHBondContact O-OG1 3.46Å; E96-I572 HydrophobicContact CB-CD1 3.62Å; E96-I572 HydrophobicContact CG-CD1 3.8Å
97	L	69.6	Low	63.5	Low	23 Å²	23	60.1 Å²	60.1	12%	0.12	29%	0.293	C	S	.	.	H	α-helix	trans	-68.3	-20.5	175.4	-162.2	67.5	0	0	0	113.7	A93 V95 T100 L101 I175 V176 A179 L574	A93-L97 WeakPolarHBondContact O-CB 3.2Å; A93-L97 PolarHBondContact O-N 3.32Å; V95-L97 VanDerWaalsContact C-N 3.3Å; V95-L97 PolarHBondContact O-N 3.12Å; L97-T100 WeakPolarHBondContact CA-OG1 3.38Å; L97-L101 VanDerWaalsContact O-CG 3.31Å; L97-L101 WeakPolarHBondContact O-CG 3.46Å; L97-I175 HydrophobicContact CB-CG2 4.13Å; L97-I175 HydrophobicContact CD2-CG2 3.97Å; L97-I175 HydrophobicContact CG-CG2 3.88Å; L97-V176 HydrophobicContact CD2-CG2 4.09Å; L97-A179 HydrophobicContact CD1-CB 3.65Å; L97-A179 HydrophobicContact CD2-CB 3.89Å; L97-A179 HydrophobicContact CG-CB 3.86Å; L97-L574 HydrophobicContact CD1-CD1 4.34Å
98	Y	67.4	Low	61.6	Low	6 Å²	6	54.3 Å²	54.3	2%	0.024	28%	0.282	C	S	.	.	H	α-helix	trans	-81.8	-38.5	173	-171.5	-102.3	0	0	0	111.9	L94 V95 E96 F160 T167 P168 L170 I175	L94-Y98 PolarHBondContact O-N 3.3Å; V95-Y98 WeakPolarHBondContact O-CA 3.42Å; V95-Y98 WeakPolarHBondContact O-CB 3.36Å; V95-Y98 PolarHBondContact O-N 3.33Å; E96-Y98 VanDerWaalsContact C-N 3.26Å; E96-Y98 PolarHBondContact O-N 2.99Å; Y98-F160 HydrophobicContact CD1-CD2 4.11Å; Y98-F160 AromaticContact CD1-CE2 3.37Å; Y98-F160 HydrophobicContact CD1-CE2 3.37Å; Y98-F160 AromaticContact CD1-CZ 3.7Å; Y98-F160 HydrophobicContact CD1-CZ 3.7Å; Y98-F160 HydrophobicContact CE1-CD1 4.35Å; Y98-F160 AromaticContact CE1-CD2 3.6Å; Y98-F160 HydrophobicContact CE1-CD2 3.6Å; Y98-F160 HydrophobicContact CE1-CE1 4.03Å; Y98-F160 AromaticContact CE1-CE2 3.22Å; Y98-F160 HydrophobicContact CE1-CE2 3.22Å; Y98-F160 HydrophobicContact CE1-CG 4.18Å; Y98-F160 AromaticContact CE1-CZ 3.48Å; Y98-F160 HydrophobicContact CE1-CZ 3.48Å; Y98-F160 VanDerWaalsContact CE1-CZ 3.48Å; Y98-T167 WeakPolarHBondContact OH-CB 3.45Å; Y98-T167 PolarHBondContact OH-OG1 3.43Å; Y98-P168 PolarHBondContact OH-O 3.19Å; Y98-L170 HydrophobicContact CE2-CB 4.24Å; Y98-L170 HydrophobicContact CE2-CD1 4.12Å; Y98-L170 HydrophobicContact CE2-CG 4.05Å; Y98-I175 HydrophobicContact CD2-CD1 3.51Å; Y98-I175 HydrophobicContact CD2-CG1 3.84Å; Y98-I175 HydrophobicContact CE2-CD1 4.36Å; Y98-I175 HydrophobicContact CG-CD1 4.18Å
99	L	62.9	Low	59.7	Low	47 Å²	47	52.3 Å²	52.3	25%	0.246	28%	0.28	C	S	.	.	H	α-helix	trans	-69.6	-34.5	178.4	-66	171.7	0	0	0	112.2	V95 E96 L147 F160	V95-L99 HydrophobicContact CG1-CD1 4.08Å; V95-L99 WeakPolarHBondContact O-CG 3.33Å; V95-L99 PolarHBondContact O-N 3.3Å; E96-L99 PolarHBondContact O-N 3.21Å; L99-L147 HydrophobicContact CD2-CD1 4.33Å; L99-F160 HydrophobicContact CD2-CZ 3.98Å
100	T	63.1	Low	58	Low	51 Å²	51	51.9 Å²	51.9	31%	0.313	29%	0.286	S	S	.	.	S	Bend	trans	-81.5	-9.9	-177.4	49.6	0	0	0	0	114.8	E96 L97 I470	E96-T100 WeakPolarHBondContact O-CB 3.47Å; E96-T100 VanDerWaalsContact O-CG2 3.31Å; E96-T100 WeakPolarHBondContact O-CG2 3.38Å; E96-T100 PolarHBondContact O-N 3.29Å; E96-T100 PolarHBondContact O-OG1 3.46Å; L97-T100 WeakPolarHBondContact CA-OG1 3.38Å; T100-I470 HydrophobicContact CG2-CD1 4.34Å; T100-I470 HydrophobicContact CG2-CG2 3.74Å
101	L	60.8	Low	56.6	Low	12 Å²	12	52.5 Å²	52.5	6%	0.063	29%	0.294	C	S	.	.	S	Bend	trans	-79.3	138.5	178.3	-79.9	174.5	0	0	0	112.2	L97 I103 I175 I178 A179	L97-L101 VanDerWaalsContact O-CG 3.31Å; L97-L101 WeakPolarHBondContact O-CG 3.46Å; L101-I103 HydrophobicContact CB-CD1 3.9Å; L101-I103 HydrophobicContact CB-CG1 4.13Å; L101-I103 HydrophobicContact CD1-CD1 3.86Å; L101-I103 HydrophobicContact CG-CD1 4.5Å; L101-I103 PolarHBondContact O-N 3.44Å; L101-I175 HydrophobicContact CD1-CG2 3.84Å; L101-I178 HydrophobicContact CD1-CB 4.12Å; L101-I178 HydrophobicContact CD1-CG2 3.97Å; L101-I178 HydrophobicContact CD2-CG2 3.83Å; L101-A179 HydrophobicContact CD2-CB 4.21Å
102	P	49.6	Very low	54.7	Low	73 Å²	73	56.6 Å²	56.6	47%	0.474	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	16.5	-178.5	30.1	-36.5	0	0	0	114.8	Q104	P102-Q104 PolarHBondContact O-N 3.37Å
103	I	53.9	Low	53.1	Low	48 Å²	48	59.4 Å²	59.4	25%	0.246	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.8	173.6	-61.4	165	0	0	0	111	L101 P168 L170 I178	L101-I103 HydrophobicContact CB-CD1 3.9Å; L101-I103 HydrophobicContact CB-CG1 4.13Å; L101-I103 HydrophobicContact CD1-CD1 3.86Å; L101-I103 HydrophobicContact CG-CD1 4.5Å; L101-I103 PolarHBondContact O-N 3.44Å; I103-P168 HydrophobicContact CG2-CG 4.11Å; I103-L170 HydrophobicContact CD1-CD1 3.72Å; I103-I178 HydrophobicContact CD1-CD1 4.14Å
104	Q	49.9	Very low	51.6	Low	63 Å²	63	63.4 Å²	63.4	29%	0.294	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-24.7	-175.8	-54.8	-169.5	8.6	0	0	114.1	P102 N106 L107 A108 T167	P102-Q104 PolarHBondContact O-N 3.37Å; Q104-N106 PolarHBondContact O-N 3.42Å; Q104-L107 PolarHBondContact O-N 3.12Å; Q104-A108 PolarHBondContact O-N 3.32Å; Q104-T167 HydrophobicContact CG-CG2 4.41Å
105	Q	40.9	Very low	50.1	Low	133 Å²	133	68 Å²	68	62%	0.621	36%	0.364	S	S	*	.	H	α-helix	trans	-67.1	-39	-162.5	-69.4	-179.2	-10	0	0	113.9	L107 A108 A109	Q105-L107 VanDerWaalsContact C-N 3.28Å; Q105-L107 PolarHBondContact O-N 3.32Å; Q105-A108 PolarHBondContact O-N 2.82Å; Q105-A109 WeakPolarHBondContact O-CB 3.5Å; Q105-A109 PolarHBondContact O-N 3.15Å
106	N	38.8	Very low	48.6	Very low	86 Å²	86	71.5 Å²	71.5	46%	0.46	39%	0.388	S	S	.	.	H	α-helix	trans	-68.3	-26.1	-178.1	-67.9	-3.5	0	0	0	112.9	Q104 D110 F1198	Q104-N106 PolarHBondContact O-N 3.42Å; N106-D110 PolarHBondContact O-N 3.02Å; N106-F1198 VanDerWaalsContact ND2-CE1 3.26Å; N106-F1198 WeakPolarHBondContact ND2-CE1 3.46Å; N106-F1198 WeakPolarHBondContact ND2-CZ 3.34Å
107	L	40.4	Very low	47.1	Very low	74 Å²	74	75 Å²	75	39%	0.387	40%	0.403	S	S	.	.	H	α-helix	trans	-77.1	-37.9	175.9	-79.1	160.8	0	0	0	112.2	Q104 Q105 V111 S166	Q104-L107 PolarHBondContact O-N 3.12Å; Q105-L107 VanDerWaalsContact C-N 3.28Å; Q105-L107 PolarHBondContact O-N 3.32Å; L107-V111 WeakPolarHBondContact O-CB 3.47Å; L107-V111 VanDerWaalsContact O-CG2 3.22Å; L107-V111 WeakPolarHBondContact O-CG2 3.44Å; L107-V111 PolarHBondContact O-N 3.35Å; L107-S166 WeakPolarHBondContact CD1-OG 3.36Å; L107-S166 VanDerWaalsContact CD2-OG 3.28Å; L107-S166 WeakPolarHBondContact CD2-OG 3.47Å
108	A	36.1	Very low	45.8	Very low	52 Å²	52	81.7 Å²	81.7	43%	0.43	43%	0.432	S	S	.	.	H	α-helix	trans	-67.3	-45.4	174.4	0	0	0	0	0	111.7	Q104 Q105 L112	Q104-A108 PolarHBondContact O-N 3.32Å; Q105-A108 PolarHBondContact O-N 2.82Å; A108-L112 WeakPolarHBondContact O-CB 3.31Å; A108-L112 VanDerWaalsContact O-CG 3.27Å; A108-L112 WeakPolarHBondContact O-CG 3.3Å; A108-L112 PolarHBondContact O-N 3Å
109	A	36.2	Very low	44.5	Very low	44 Å²	44	87 Å²	87	36%	0.364	47%	0.465	S	S	.	.	H	α-helix	trans	-62.2	-46.6	-174.7	0	0	0	0	0	113.2	Q105 K113	Q105-A109 WeakPolarHBondContact O-CB 3.5Å; Q105-A109 PolarHBondContact O-N 3.15Å; A109-K113 WeakPolarHBondContact O-CB 3.43Å; A109-K113 WeakPolarHBondContact O-CG 3.47Å; A109-K113 PolarHBondContact O-N 3.17Å
110	D	38.2	Very low	43.3	Very low	92 Å²	92	88.1 Å²	88.1	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-78.3	-31.5	-176.9	-73.5	-19.9	0	0	0	112.7	N106 N114	N106-D110 PolarHBondContact O-N 3.02Å; D110-N114 VanDerWaalsContact O-CB 3.28Å; D110-N114 WeakPolarHBondContact O-CB 3.4Å; D110-N114 PolarHBondContact O-N 2.99Å; D110-N114 PolarHBondContact O-ND2 3.34Å
111	V	45.5	Very low	42.3	Very low	85 Å²	85	93.6 Å²	93.6	52%	0.515	51%	0.51	S	S	.	.	H	α-helix	trans	-66.3	-42.5	172.1	173	0	0	0	0	110.7	L107 K115	L107-V111 WeakPolarHBondContact O-CB 3.47Å; L107-V111 VanDerWaalsContact O-CG2 3.22Å; L107-V111 WeakPolarHBondContact O-CG2 3.44Å; L107-V111 PolarHBondContact O-N 3.35Å; V111-K115 PolarHBondContact O-N 3.16Å
112	L	36.4	Very low	41.2	Very low	113 Å²	113	100.4 Å²	100.4	59%	0.592	55%	0.545	S	S	*	.	H	α-helix	trans	-67.3	-46.2	176.9	-72.3	169.5	0	0	0	112.1	A108 N114 K115 C116	A108-L112 WeakPolarHBondContact O-CB 3.31Å; A108-L112 VanDerWaalsContact O-CG 3.27Å; A108-L112 WeakPolarHBondContact O-CG 3.3Å; A108-L112 PolarHBondContact O-N 3Å; L112-N114 PolarHBondContact O-N 3.14Å; L112-K115 PolarHBondContact O-N 2.79Å; L112-C116 WeakPolarHBondContact O-CB 3.46Å; L112-C116 PolarHBondContact O-N 3.39Å; L112-C116 PolarHBondContact O-SG 3.17Å
113	K	40.5	Very low	40.4	Very low	136 Å²	136	100.8 Å²	100.8	59%	0.591	56%	0.562	S	S	*	*	H	α-helix	trans	-58.1	-46.9	175.8	-81.2	178.9	175.7	176.2	0	112.2	A109 C116 H117	A109-K113 WeakPolarHBondContact O-CB 3.43Å; A109-K113 WeakPolarHBondContact O-CG 3.47Å; A109-K113 PolarHBondContact O-N 3.17Å; K113-C116 PolarHBondContact O-N 3.35Å; K113-H117 PolarHBondContact O-N 2.9Å
114	N	41.2	Very low	39.3	Very low	109 Å²	109	101.6 Å²	101.6	58%	0.583	58%	0.582	S	S	*	*	H	α-helix	trans	-72.7	-26.8	-177	-74	-61.2	0	0	0	113.8	D110 L112	D110-N114 VanDerWaalsContact O-CB 3.28Å; D110-N114 WeakPolarHBondContact O-CB 3.4Å; D110-N114 PolarHBondContact O-N 2.99Å; D110-N114 PolarHBondContact O-ND2 3.34Å; L112-N114 PolarHBondContact O-N 3.14Å
115	K	40.8	Very low	38.5	Very low	108 Å²	108	105.9 Å²	105.9	47%	0.47	61%	0.607	S	S	.	*	H	α-helix	trans	-74.6	-48	167.1	-82.8	-169.4	170.3	-173.1	0	111.5	V111 L112 H117 K118 V119 E136	V111-K115 PolarHBondContact O-N 3.16Å; L112-K115 PolarHBondContact O-N 2.79Å; K115-H117 PolarHBondContact O-N 3.05Å; K115-K118 PolarHBondContact O-N 2.97Å; K115-V119 PolarHBondContact O-N 3.34Å; K115-V119 VanDerWaalsContact O-N 3.1Å; K115-E136 IonicContact NZ-OE2 3.81Å; K115-E136 PolarHBondContact NZ-OE2 2.8Å
116	C	39.1	Very low	38.4	Very low	82 Å²	82	105.2 Å²	105.2	55%	0.554	61%	0.608	S	S	*	*	H	α-helix	trans	-61.8	-38.9	-178.2	-70.3	0	0	0	0	113.6	L112 K113 K118 V119 G120	L112-C116 WeakPolarHBondContact O-CB 3.46Å; L112-C116 PolarHBondContact O-N 3.39Å; L112-C116 PolarHBondContact O-SG 3.17Å; K113-C116 PolarHBondContact O-N 3.35Å; C116-K118 VanDerWaalsContact C-N 3.27Å; C116-K118 PolarHBondContact O-N 3.08Å; C116-V119 PolarHBondContact O-N 2.85Å; C116-G120 PolarHBondContact O-N 2.93Å
117	H	37.4	Very low	37.9	Very low	137 Å²	137	110.3 Å²	110.3	63%	0.634	63%	0.628	S	S	*	*	H	α-helix	trans	-67.9	-23	175.5	-83.2	38.2	0	0	0	113.8	K113 K115	K113-H117 PolarHBondContact O-N 2.9Å; K115-H117 PolarHBondContact O-N 3.05Å
118	K	42.1	Very low	37.8	Very low	164 Å²	164	109.6 Å²	109.6	71%	0.713	64%	0.639	S	S	*	*	H	α-helix	trans	-81.3	-30.4	172	-76.1	-174.5	172.7	-174.8	0	113.3	K115 C116	K115-K118 PolarHBondContact O-N 2.97Å; C116-K118 VanDerWaalsContact C-N 3.27Å; C116-K118 PolarHBondContact O-N 3.08Å
119	V	41.5	Very low	38	Very low	119 Å²	119	114.7 Å²	114.7	72%	0.721	65%	0.654	S	S	*	*	H	α-helix	trans	-74.6	-35	175.3	176.5	0	0	0	0	111.3	K115 C116 Q121	K115-V119 PolarHBondContact O-N 3.34Å; K115-V119 VanDerWaalsContact O-N 3.1Å; C116-V119 PolarHBondContact O-N 2.85Å; V119-Q121 VanDerWaalsContact C-N 3.28Å; V119-Q121 PolarHBondContact O-N 3.02Å
120	G	37.7	Very low	38	Very low	70 Å²	70	117.6 Å²	117.6	72%	0.722	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	1.5	180	0	0	0	0	0	116.9	C116	C116-G120 PolarHBondContact O-N 2.93Å
121	Q	41.5	Very low	37.8	Very low	166 Å²	166	119.5 Å²	119.5	78%	0.776	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	4.3	-176.1	-71.2	-168.2	-14.7	0	0	115	V119	V119-Q121 VanDerWaalsContact C-N 3.28Å; V119-Q121 PolarHBondContact O-N 3.02Å
122	L	37.7	Very low	37.4	Very low	155 Å²	155	121.1 Å²	121.1	81%	0.812	68%	0.678	S	S	*	*			trans	-116.1	80	173.8	-77.8	164.9	0	0	0	109.9
123	G	31.7	Very low	37.2	Very low	81 Å²	81	118.5 Å²	118.5	84%	0.835	68%	0.678	S	S	*	*			trans	-82.6	143.9	166.4	0	0	0	0	0	110.9
124	G	32.3	Very low	36.9	Very low	64 Å²	64	116.9 Å²	116.9	66%	0.66	68%	0.675	S	S	*	*	S	Bend	trans	110.2	110.1	-179.6	0	0	0	0	0	113.1
125	D	33.2	Very low	36.8	Very low	153 Å²	153	116.5 Å²	116.5	82%	0.818	68%	0.677	S	S	*	*	S	Bend	trans	53.7	74.5	140.6	-47.9	-23.4	0	0	0	118.3
126	N	37.4	Very low	36.7	Very low	119 Å²	119	117.3 Å²	117.3	64%	0.636	68%	0.682	S	S	*	*			trans	-166.7	58.9	143.7	-101.2	-50.8	0	0	0	113.3	G128	N126-G128 PolarHBondContact O-N 3.3Å
127	H	30.1	Very low	36.6	Very low	193 Å²	193	116.9 Å²	116.9	89%	0.894	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	77.2	171.4	-78.9	-71.1	0	0	0	111.8
128	G	37.9	Very low	36.4	Very low	60 Å²	60	111.8 Å²	111.8	62%	0.619	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.4	-36.6	174.5	0	0	0	0	0	113.9	N126	N126-G128 PolarHBondContact O-N 3.3Å
129	Q	40	Very low	36.6	Very low	158 Å²	158	107.1 Å²	107.1	74%	0.738	65%	0.653	S	S	*	*	S	Bend	trans	-99.7	0.3	-178.2	-65.1	-179.9	-3.5	0	0	114	L131	Q129-L131 VanDerWaalsContact C-N 3.33Å
130	I	35.8	Very low	36.6	Very low	106 Å²	106	105.9 Å²	105.9	54%	0.544	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.4	-19.8	-176	-64	172	0	0	0	112.1
131	L	34.5	Very low	36.7	Very low	132 Å²	132	108.9 Å²	108.9	69%	0.691	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-38.4	-175.1	-163.9	64.1	0	0	0	113	Q129 G133 L134	Q129-L131 VanDerWaalsContact C-N 3.33Å; L131-G133 VanDerWaalsContact C-N 3.32Å; L131-G133 PolarHBondContact O-N 2.79Å; L131-L134 HydrophobicContact CD1-CD1 4.37Å; L131-L134 WeakPolarHBondContact O-CB 3.4Å; L131-L134 PolarHBondContact O-N 3.29Å
132	D	35.9	Very low	36.9	Very low	119 Å²	119	106.3 Å²	106.3	64%	0.636	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-68.2	-32	-178.9	-63.7	-39.4	0	0	0	112.4	L134 T135	D132-L134 PolarHBondContact O-N 2.82Å; D132-T135 WeakPolarHBondContact O-CB 3.39Å; D132-T135 WeakPolarHBondContact O-CG2 3.42Å; D132-T135 PolarHBondContact O-N 2.92Å; D132-T135 PolarHBondContact O-OG1 3.08Å
133	G	33.9	Very low	37.6	Very low	57 Å²	57	99.1 Å²	99.1	59%	0.588	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-66.9	-14.6	176.2	0	0	0	0	0	114.7	L131 T135	L131-G133 VanDerWaalsContact C-N 3.32Å; L131-G133 PolarHBondContact O-N 2.79Å; G133-T135 VanDerWaalsContact C-N 3.34Å
134	L	33.7	Very low	38.5	Very low	102 Å²	102	98.7 Å²	98.7	53%	0.534	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-82.2	-11.2	176.6	-71.2	165.2	0	0	0	113.1	L131 D132 E136 S137	L131-L134 HydrophobicContact CD1-CD1 4.37Å; L131-L134 WeakPolarHBondContact O-CB 3.4Å; L131-L134 PolarHBondContact O-N 3.29Å; D132-L134 PolarHBondContact O-N 2.82Å; L134-E136 VanDerWaalsContact C-N 3.33Å; L134-E136 PolarHBondContact O-N 3.11Å; L134-S137 VanDerWaalsContact O-CB 3.26Å; L134-S137 WeakPolarHBondContact O-CB 3.47Å; L134-S137 PolarHBondContact O-N 3.09Å; L134-S137 VanDerWaalsContact O-N 3.13Å; L134-S137 PolarHBondContact O-OG 3.02Å
135	T	38.4	Very low	39.3	Very low	102 Å²	102	97.1 Å²	97.1	63%	0.626	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-29.6	-179.1	58.7	0	0	0	0	113.7	D132 G133 S137 G138	D132-T135 WeakPolarHBondContact O-CB 3.39Å; D132-T135 WeakPolarHBondContact O-CG2 3.42Å; D132-T135 PolarHBondContact O-N 2.92Å; D132-T135 PolarHBondContact O-OG1 3.08Å; G133-T135 VanDerWaalsContact C-N 3.34Å; T135-S137 PolarHBondContact O-N 3.06Å; T135-G138 PolarHBondContact O-N 3.42Å
136	E	39.5	Very low	40.3	Very low	124 Å²	124	94.2 Å²	94.2	58%	0.579	54%	0.538	S	S	*	.	H	α-helix	trans	-59.5	-30.3	172.6	-71.9	-166.8	153.5	0	0	112.6	K115 L134 G138 S139	K115-E136 IonicContact NZ-OE2 3.81Å; K115-E136 PolarHBondContact NZ-OE2 2.8Å; L134-E136 VanDerWaalsContact C-N 3.33Å; L134-E136 PolarHBondContact O-N 3.11Å; E136-G138 PolarHBondContact O-N 3.02Å; E136-S139 PolarHBondContact O-N 3.43Å; E136-S139 PolarHBondContact O-OG 2.9Å; E136-S139 VanDerWaalsContact O-OG 3.04Å
137	S	36.2	Very low	41.2	Very low	73 Å²	73	88.8 Å²	88.8	51%	0.51	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-33.1	175.9	-27.6	0	0	0	0	111.6	L134 T135 S139 L140 L141	L134-S137 VanDerWaalsContact O-CB 3.26Å; L134-S137 WeakPolarHBondContact O-CB 3.47Å; L134-S137 PolarHBondContact O-N 3.09Å; L134-S137 VanDerWaalsContact O-N 3.13Å; L134-S137 PolarHBondContact O-OG 3.02Å; T135-S137 PolarHBondContact O-N 3.06Å; S137-S139 VanDerWaalsContact C-N 3.33Å; S137-S139 PolarHBondContact O-N 2.94Å; S137-L140 PolarHBondContact O-N 3.14Å; S137-L141 PolarHBondContact O-N 3.31Å
138	G	34.2	Very low	42.2	Very low	31 Å²	31	84.8 Å²	84.8	32%	0.32	49%	0.494	S	S	.	.	H	α-helix	trans	-68.6	-27.8	177.8	0	0	0	0	0	113.2	T135 E136 L140 L141 N142	T135-G138 PolarHBondContact O-N 3.42Å; E136-G138 PolarHBondContact O-N 3.02Å; G138-L140 VanDerWaalsContact C-N 3.33Å; G138-L140 PolarHBondContact O-N 3.11Å; G138-L141 PolarHBondContact O-N 2.99Å; G138-N142 WeakPolarHBondContact O-CB 3.29Å; G138-N142 PolarHBondContact O-N 3.34Å
139	S	44.9	Very low	43	Very low	65 Å²	65	90.5 Å²	90.5	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-38.6	177.4	81.4	0	0	0	0	111.2	E136 S137 N142 T143	E136-S139 PolarHBondContact O-N 3.43Å; E136-S139 PolarHBondContact O-OG 2.9Å; E136-S139 VanDerWaalsContact O-OG 3.04Å; S137-S139 VanDerWaalsContact C-N 3.33Å; S137-S139 PolarHBondContact O-N 2.94Å; S139-N142 PolarHBondContact O-N 2.96Å; S139-T143 VanDerWaalsContact O-CG2 3.28Å; S139-T143 WeakPolarHBondContact O-CG2 3.4Å; S139-T143 PolarHBondContact O-N 3.35Å
140	L	43.1	Very low	43.9	Very low	94 Å²	94	83.3 Å²	83.3	49%	0.492	47%	0.469	S	S	.	.	H	α-helix	trans	-67.3	-39.2	177.7	-119.8	169.9	0	0	0	111.9	S137 G138 T143 I144	S137-L140 PolarHBondContact O-N 3.14Å; G138-L140 VanDerWaalsContact C-N 3.33Å; G138-L140 PolarHBondContact O-N 3.11Å; L140-T143 PolarHBondContact O-N 2.94Å; L140-T143 PolarHBondContact O-OG1 2.96Å; L140-I144 WeakPolarHBondContact O-CG1 3.44Å; L140-I144 PolarHBondContact O-N 2.98Å
141	L	39.5	Very low	45	Very low	132 Å²	132	81.4 Å²	81.4	69%	0.691	46%	0.464	S	S	*	.	H	α-helix	trans	-65.6	-44.1	173.8	-136	75.6	0	0	0	111.6	S137 G138 T143 I144 G145	S137-L141 PolarHBondContact O-N 3.31Å; G138-L141 PolarHBondContact O-N 2.99Å; L141-T143 VanDerWaalsContact C-N 3.34Å; L141-T143 PolarHBondContact O-N 3.48Å; L141-I144 PolarHBondContact O-N 3.1Å; L141-G145 PolarHBondContact O-N 3.02Å; L141-G145 VanDerWaalsContact O-N 3.15Å
142	N	45.3	Very low	46.4	Very low	112 Å²	112	77.6 Å²	77.6	60%	0.599	45%	0.446	S	S	*	.	H	α-helix	trans	-62.8	-38	176.3	-71.5	-6.8	0	0	0	112	G138 S139 I144 G145 E146	G138-N142 WeakPolarHBondContact O-CB 3.29Å; G138-N142 PolarHBondContact O-N 3.34Å; S139-N142 PolarHBondContact O-N 2.96Å; N142-I144 VanDerWaalsContact C-N 3.31Å; N142-I144 PolarHBondContact O-N 2.78Å; N142-G145 PolarHBondContact O-N 3.34Å; N142-E146 WeakPolarHBondContact O-CG 3.22Å; N142-E146 PolarHBondContact O-N 2.83Å
143	T	51.1	Low	47.9	Very low	5 Å²	5	72.8 Å²	72.8	3%	0.031	42%	0.419	C	S	.	.	H	α-helix	trans	-62	-37.2	175.1	57.7	0	0	0	0	113.2	S139 L140 L141 E146 L147 H163	S139-T143 VanDerWaalsContact O-CG2 3.28Å; S139-T143 WeakPolarHBondContact O-CG2 3.4Å; S139-T143 PolarHBondContact O-N 3.35Å; L140-T143 PolarHBondContact O-N 2.94Å; L140-T143 PolarHBondContact O-OG1 2.96Å; L141-T143 VanDerWaalsContact C-N 3.34Å; L141-T143 PolarHBondContact O-N 3.48Å; T143-E146 PolarHBondContact O-N 3.28Å; T143-L147 WeakPolarHBondContact O-CB 3.45Å; T143-L147 WeakPolarHBondContact O-CD1 3.44Å; T143-L147 WeakPolarHBondContact O-CG 3.49Å; T143-L147 PolarHBondContact O-N 2.61Å; T143-H163 HydrophobicContact CG2-CB 3.77Å; T143-H163 VanDerWaalsContact CG2-CD2 3.4Å; T143-H163 WeakPolarHBondContact CG2-CD2 3.36Å; T143-H163 WeakPolarHBondContact CG2-ND1 3.45Å
144	I	51.2	Low	49.6	Very low	72 Å²	72	79.8 Å²	79.8	37%	0.369	43%	0.428	S	S	.	.	H	α-helix	trans	-67	-43.1	177.6	-66.1	165.6	0	0	0	109.4	L140 L141 N142 L147 D148	L140-I144 WeakPolarHBondContact O-CG1 3.44Å; L140-I144 PolarHBondContact O-N 2.98Å; L141-I144 PolarHBondContact O-N 3.1Å; N142-I144 VanDerWaalsContact C-N 3.31Å; N142-I144 PolarHBondContact O-N 2.78Å; I144-L147 PolarHBondContact O-N 2.77Å; I144-D148 PolarHBondContact O-N 3.01Å
145	G	49	Very low	51.2	Low	30 Å²	30	78.6 Å²	78.6	31%	0.309	42%	0.422	S	S	.	.	H	α-helix	trans	-59.3	-47.2	172.1	0	0	0	0	0	113.7	L141 N142 L147 D148 F149	L141-G145 PolarHBondContact O-N 3.02Å; L141-G145 VanDerWaalsContact O-N 3.15Å; N142-G145 PolarHBondContact O-N 3.34Å; G145-L147 PolarHBondContact O-N 2.67Å; G145-D148 PolarHBondContact O-N 2.83Å; G145-F149 VanDerWaalsContact O-CD2 3.29Å; G145-F149 WeakPolarHBondContact O-CD2 3.49Å; G145-F149 PolarHBondContact O-N 3.15Å
146	E	54.8	Low	52.6	Low	93 Å²	93	73.8 Å²	73.8	44%	0.435	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-32.7	175.2	-73.5	-176.1	165.1	0	0	112.6	N142 T143 I159 H163	N142-E146 WeakPolarHBondContact O-CG 3.22Å; N142-E146 PolarHBondContact O-N 2.83Å; T143-E146 PolarHBondContact O-N 3.28Å; E146-I159 HydrophobicContact CB-CD1 4.3Å; E146-I159 HydrophobicContact CB-CG2 4.25Å; E146-I159 WeakPolarHBondContact O-CD1 3.17Å; E146-H163 IonicContact OE2-CD2 3.65Å; E146-H163 IonicContact OE2-CE1 2.76Å; E146-H163 IonicContact OE2-NE2 2.6Å; E146-H163 PolarHBondContact OE2-NE2 3Å
147	L	56.8	Low	53.9	Low	4 Å²	4	68.7 Å²	68.7	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-76.7	-40.2	179.7	-84.5	160.4	0	0	0	113.4	L99 T143 I144 G145 F149 A150 A156 I159 F160	L99-L147 HydrophobicContact CD2-CD1 4.33Å; T143-L147 WeakPolarHBondContact O-CB 3.45Å; T143-L147 WeakPolarHBondContact O-CD1 3.44Å; T143-L147 WeakPolarHBondContact O-CG 3.49Å; T143-L147 PolarHBondContact O-N 2.61Å; I144-L147 PolarHBondContact O-N 2.77Å; G145-L147 PolarHBondContact O-N 2.67Å; L147-F149 PolarHBondContact O-N 3.46Å; L147-A150 WeakPolarHBondContact O-CB 3.31Å; L147-A150 PolarHBondContact O-N 3.27Å; L147-A150 VanDerWaalsContact O-N 3.08Å; L147-A156 HydrophobicContact CD2-CB 3.7Å; L147-I159 HydrophobicContact CD1-CG2 4.42Å; L147-I159 HydrophobicContact CD2-CB 4.35Å; L147-I159 HydrophobicContact CD2-CG2 4.34Å; L147-I159 HydrophobicContact CG-CB 4.49Å; L147-I159 HydrophobicContact CG-CG2 3.96Å; L147-F160 HydrophobicContact CD1-CD1 4.38Å; L147-F160 HydrophobicContact CD1-CE1 3.7Å; L147-F160 HydrophobicContact CD1-CE2 3.82Å; L147-F160 HydrophobicContact CD1-CZ 3.36Å; L147-F160 HydrophobicContact CD2-CD2 3.89Å; L147-F160 HydrophobicContact CD2-CE2 3.33Å; L147-F160 HydrophobicContact CD2-CZ 3.8Å; L147-F160 HydrophobicContact CG-CE2 4.25Å; L147-F160 HydrophobicContact CG-CZ 4.24Å
148	D	50.6	Low	55.4	Low	109 Å²	109	67.7 Å²	67.7	58%	0.583	36%	0.36	S	S	*	.	H	α-helix	trans	-62.3	-32	176	-79.2	-16.2	0	0	0	111.9	I144 G145	I144-D148 PolarHBondContact O-N 3.01Å; G145-D148 PolarHBondContact O-N 2.83Å
149	F	54.7	Low	57	Low	181 Å²	181	66.6 Å²	66.6	79%	0.794	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	2.4	175.2	-71.6	-68.3	0	0	0	114.7	G145 L147 P151	G145-F149 VanDerWaalsContact O-CD2 3.29Å; G145-F149 WeakPolarHBondContact O-CD2 3.49Å; G145-F149 PolarHBondContact O-N 3.15Å; L147-F149 PolarHBondContact O-N 3.46Å; F149-P151 WeakPolarHBondContact O-CD 3.1Å
150	A	59.1	Low	57.9	Low	6 Å²	6	63.8 Å²	63.8	5%	0.05	33%	0.327	C	S	.	.			trans	-71	106.8	-175.2	0	0	0	0	0	112.8	L147 T152 L155 A156 I159	L147-A150 WeakPolarHBondContact O-CB 3.31Å; L147-A150 PolarHBondContact O-N 3.27Å; L147-A150 VanDerWaalsContact O-N 3.08Å; A150-T152 PolarHBondContact O-N 3.25Å; A150-L155 HydrophobicContact CB-CB 4.39Å; A150-L155 HydrophobicContact CB-CD2 4.38Å; A150-A156 HydrophobicContact CB-CB 4.05Å; A150-I159 HydrophobicContact CB-CD1 4.16Å
151	P	58.2	Low	58.8	Low	67 Å²	67	67.3 Å²	67.3	44%	0.435	33%	0.334	S	S	.	.	S	Bend	trans	-76	-5.9	-169.4	33.5	-36.6	0	0	0	113.7	H88 F149	H88-P151 PolarHBondContact ND1-O 3.47Å; F149-P151 WeakPolarHBondContact O-CD 3.1Å
152	T	63.7	Low	59.9	Low	52 Å²	52	67.6 Å²	67.6	32%	0.319	33%	0.331	S	S	.	.	S	Bend	trans	-145.1	148	174.9	68.4	0	0	0	0	111.1	A150 R154 L155 A156	A150-T152 PolarHBondContact O-N 3.25Å; T152-R154 PolarHBondContact O-N 3.11Å; T152-R154 VanDerWaalsContact O-N 3.09Å; T152-L155 PolarHBondContact O-N 3.04Å; T152-L155 PolarHBondContact OG1-N 3.28Å; T152-A156 PolarHBondContact O-N 2.99Å; T152-A156 VanDerWaalsContact O-N 3.16Å
153	Y	68.3	Low	60.5	Low	17 Å²	17	65.7 Å²	65.7	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-53.8	-28.5	169.8	-176	-100.6	0	0	0	113.4	L94 V95 T157 L170 K172 I175	L94-Y153 HydrophobicContact CB-CD2 4.36Å; V95-Y153 HydrophobicContact CG2-CD2 4.3Å; Y153-T157 HydrophobicContact CD1-CG2 4.24Å; Y153-T157 HydrophobicContact CE1-CG2 3.51Å; Y153-T157 HydrophobicContact CE2-CG2 4Å; Y153-T157 PolarHBondContact O-N 3.27Å; Y153-T157 PolarHBondContact O-OG1 3.22Å; Y153-T157 WeakPolarHBondContact OH-CG2 3.46Å; Y153-L170 PolarHBondContact OH-O 2.94Å; Y153-K172 HydrophobicContact CD1-CG 3.85Å; Y153-K172 HydrophobicContact CE1-CG 4.29Å; Y153-K172 HydrophobicContact CG-CG 4.29Å; Y153-I175 HydrophobicContact CD2-CD1 4.25Å; Y153-I175 HydrophobicContact CE1-CD1 4.49Å; Y153-I175 HydrophobicContact CE2-CD1 3.28Å; Y153-I175 VanDerWaalsContact CZ-CD1 3.45Å; Y153-I175 WeakPolarHBondContact OH-CD1 3.4Å
154	R	69.1	Low	60.5	Low	205 Å²	205	72.6 Å²	72.6	77%	0.774	36%	0.356	S	S	*	.	H	α-helix	trans	-68.7	-35.1	174.5	-171.7	175.3	179.3	176.7	0.3	112.5	T152 T157 T158	T152-R154 PolarHBondContact O-N 3.11Å; T152-R154 VanDerWaalsContact O-N 3.09Å; R154-T157 WeakPolarHBondContact CA-OG1 3.36Å; R154-T157 PolarHBondContact O-OG1 3.38Å; R154-T158 PolarHBondContact O-N 3.39Å; R154-T158 VanDerWaalsContact O-N 3.15Å; R154-T158 PolarHBondContact O-OG1 2.93Å
155	L	68.1	Low	60.7	Low	77 Å²	77	72.1 Å²	72.1	40%	0.403	35%	0.353	S	S	.	.	H	α-helix	trans	-73	-43.7	175.2	-159.9	83.5	0	0	0	110.9	A150 T152 T157 T158 I159	A150-L155 HydrophobicContact CB-CB 4.39Å; A150-L155 HydrophobicContact CB-CD2 4.38Å; T152-L155 PolarHBondContact O-N 3.04Å; T152-L155 PolarHBondContact OG1-N 3.28Å; L155-T157 VanDerWaalsContact C-N 3.3Å; L155-T157 PolarHBondContact O-N 3.35Å; L155-T158 WeakPolarHBondContact CA-OG1 3.35Å; L155-T158 PolarHBondContact O-N 2.69Å; L155-T158 PolarHBondContact O-OG1 3.33Å; L155-I159 HydrophobicContact CD2-CD1 4.07Å; L155-I159 HydrophobicContact CG-CD1 4.1Å; L155-I159 WeakPolarHBondContact O-CG1 3.26Å; L155-I159 PolarHBondContact O-N 3Å
156	A	67	Low	60.6	Low	1 Å²	1	74.7 Å²	74.7	1%	0.008	37%	0.367	C	S	.	.	H	α-helix	trans	-55.1	-46.9	174.6	0	0	0	0	0	111.3	V95 L147 A150 T152 T158 I159 F160	V95-A156 HydrophobicContact CG1-CB 4.19Å; V95-A156 HydrophobicContact CG2-CB 3.75Å; L147-A156 HydrophobicContact CD2-CB 3.7Å; A150-A156 HydrophobicContact CB-CB 4.05Å; T152-A156 PolarHBondContact O-N 2.99Å; T152-A156 VanDerWaalsContact O-N 3.16Å; A156-T158 VanDerWaalsContact C-N 3.3Å; A156-T158 PolarHBondContact O-N 2.88Å; A156-I159 PolarHBondContact O-N 3.28Å; A156-F160 WeakPolarHBondContact O-CD2 3.34Å; A156-F160 PolarHBondContact O-N 2.94Å
157	T	65.9	Low	60.5	Low	17 Å²	17	71.1 Å²	71.1	10%	0.104	35%	0.351	C	S	.	.	H	α-helix	trans	-70	-17.3	176.1	48.2	0	0	0	0	115.2	Y153 R154 L155 R161 V169	Y153-T157 HydrophobicContact CD1-CG2 4.24Å; Y153-T157 HydrophobicContact CE1-CG2 3.51Å; Y153-T157 HydrophobicContact CE2-CG2 4Å; Y153-T157 PolarHBondContact O-N 3.27Å; Y153-T157 PolarHBondContact O-OG1 3.22Å; Y153-T157 WeakPolarHBondContact OH-CG2 3.46Å; R154-T157 WeakPolarHBondContact CA-OG1 3.36Å; R154-T157 PolarHBondContact O-OG1 3.38Å; L155-T157 VanDerWaalsContact C-N 3.3Å; L155-T157 PolarHBondContact O-N 3.35Å; T157-R161 WeakPolarHBondContact O-CD 3.39Å; T157-R161 WeakPolarHBondContact O-CG 3.42Å; T157-V169 HydrophobicContact CG2-CG1 3.97Å
158	T	69.3	Low	60.4	Low	51 Å²	51	74.3 Å²	74.3	31%	0.313	37%	0.373	S	S	.	.	H	α-helix	trans	-80.4	-39.2	165.6	48	0	0	0	0	112	R154 L155 A156 F160 R161 Q162	R154-T158 PolarHBondContact O-N 3.39Å; R154-T158 VanDerWaalsContact O-N 3.15Å; R154-T158 PolarHBondContact O-OG1 2.93Å; L155-T158 WeakPolarHBondContact CA-OG1 3.35Å; L155-T158 PolarHBondContact O-N 2.69Å; L155-T158 PolarHBondContact O-OG1 3.33Å; A156-T158 VanDerWaalsContact C-N 3.3Å; A156-T158 PolarHBondContact O-N 2.88Å; T158-F160 PolarHBondContact O-N 3.08Å; T158-R161 CarbonylContact O-C 3.58Å; T158-R161 WeakPolarHBondContact O-CA 3.35Å; T158-R161 WeakPolarHBondContact O-CB 3.41Å; T158-R161 PolarHBondContact O-N 3.43Å; T158-Q162 VanDerWaalsContact O-CG 3.32Å; T158-Q162 WeakPolarHBondContact O-CG 3.44Å; T158-Q162 PolarHBondContact O-N 3.5Å; T158-Q162 PolarHBondContact O-OE1 2.93Å
159	I	66.7	Low	61	Low	9 Å²	9	72.3 Å²	72.3	5%	0.046	36%	0.364	C	S	.	.	H	α-helix	trans	-60.3	-47.8	176.1	-63.9	160	0	0	0	110	E146 L147 A150 L155 A156 R161 Q162 H163	E146-I159 HydrophobicContact CB-CD1 4.3Å; E146-I159 HydrophobicContact CB-CG2 4.25Å; E146-I159 WeakPolarHBondContact O-CD1 3.17Å; L147-I159 HydrophobicContact CD1-CG2 4.42Å; L147-I159 HydrophobicContact CD2-CB 4.35Å; L147-I159 HydrophobicContact CD2-CG2 4.34Å; L147-I159 HydrophobicContact CG-CB 4.49Å; L147-I159 HydrophobicContact CG-CG2 3.96Å; A150-I159 HydrophobicContact CB-CD1 4.16Å; L155-I159 HydrophobicContact CD2-CD1 4.07Å; L155-I159 HydrophobicContact CG-CD1 4.1Å; L155-I159 WeakPolarHBondContact O-CG1 3.26Å; L155-I159 PolarHBondContact O-N 3Å; A156-I159 PolarHBondContact O-N 3.28Å; I159-R161 PolarHBondContact O-N 3.47Å; I159-Q162 PolarHBondContact O-N 3.4Å; I159-H163 PolarHBondContact O-CD2 3.45Å; I159-H163 VanDerWaalsContact O-CD2 3.3Å; I159-H163 PolarHBondContact O-N 3.05Å; I159-H163 VanDerWaalsContact O-N 3.1Å
160	F	64.2	Low	61.5	Low	6 Å²	6	64.9 Å²	64.9	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-57.4	-33	173.1	-77.8	-66.1	0	0	0	113.9	Y98 L99 L147 A156 T158 L165	Y98-F160 HydrophobicContact CD1-CD2 4.11Å; Y98-F160 AromaticContact CD1-CE2 3.37Å; Y98-F160 HydrophobicContact CD1-CE2 3.37Å; Y98-F160 AromaticContact CD1-CZ 3.7Å; Y98-F160 HydrophobicContact CD1-CZ 3.7Å; Y98-F160 HydrophobicContact CE1-CD1 4.35Å; Y98-F160 AromaticContact CE1-CD2 3.6Å; Y98-F160 HydrophobicContact CE1-CD2 3.6Å; Y98-F160 HydrophobicContact CE1-CE1 4.03Å; Y98-F160 AromaticContact CE1-CE2 3.22Å; Y98-F160 HydrophobicContact CE1-CE2 3.22Å; Y98-F160 HydrophobicContact CE1-CG 4.18Å; Y98-F160 AromaticContact CE1-CZ 3.48Å; Y98-F160 HydrophobicContact CE1-CZ 3.48Å; Y98-F160 VanDerWaalsContact CE1-CZ 3.48Å; L99-F160 HydrophobicContact CD2-CZ 3.98Å; L147-F160 HydrophobicContact CD1-CD1 4.38Å; L147-F160 HydrophobicContact CD1-CE1 3.7Å; L147-F160 HydrophobicContact CD1-CE2 3.82Å; L147-F160 HydrophobicContact CD1-CZ 3.36Å; L147-F160 HydrophobicContact CD2-CD2 3.89Å; L147-F160 HydrophobicContact CD2-CE2 3.33Å; L147-F160 HydrophobicContact CD2-CZ 3.8Å; L147-F160 HydrophobicContact CG-CE2 4.25Å; L147-F160 HydrophobicContact CG-CZ 4.24Å; A156-F160 WeakPolarHBondContact O-CD2 3.34Å; A156-F160 PolarHBondContact O-N 2.94Å; T158-F160 PolarHBondContact O-N 3.08Å; F160-L165 HydrophobicContact CD1-CB 4.32Å; F160-L165 HydrophobicContact CD1-CD1 3.89Å; F160-L165 HydrophobicContact CE1-CD1 4.1Å
161	R	62.1	Low	62.1	Low	167 Å²	167	70.7 Å²	70.7	63%	0.63	36%	0.359	S	S	*	.	H	α-helix	trans	-77.3	-31.5	175.6	-73	170.9	-178.8	-151.3	-2	113.1	T157 T158 I159 V169	T157-R161 WeakPolarHBondContact O-CD 3.39Å; T157-R161 WeakPolarHBondContact O-CG 3.42Å; T158-R161 CarbonylContact O-C 3.58Å; T158-R161 WeakPolarHBondContact O-CA 3.35Å; T158-R161 WeakPolarHBondContact O-CB 3.41Å; T158-R161 PolarHBondContact O-N 3.43Å; I159-R161 PolarHBondContact O-N 3.47Å; R161-V169 HydrophobicContact CG-CG2 4.07Å
162	Q	61.8	Low	62.8	Low	138 Å²	138	70.8 Å²	70.8	65%	0.645	35%	0.352	S	S	*	.	H	α-helix	trans	-73.3	-38.6	-179.1	-74.5	167.3	-86.7	0	0	111.5	T158 I159 N164	T158-Q162 VanDerWaalsContact O-CG 3.32Å; T158-Q162 WeakPolarHBondContact O-CG 3.44Å; T158-Q162 PolarHBondContact O-N 3.5Å; T158-Q162 PolarHBondContact O-OE1 2.93Å; I159-Q162 PolarHBondContact O-N 3.4Å; Q162-N164 VanDerWaalsContact C-N 3.33Å; Q162-N164 PolarHBondContact O-N 3.21Å
163	H	58.1	Low	63	Low	72 Å²	72	70.2 Å²	70.2	33%	0.333	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	16.3	-175.6	-66.9	-75.6	0	0	0	114.9	T143 E146 I159 L165	T143-H163 HydrophobicContact CG2-CB 3.77Å; T143-H163 VanDerWaalsContact CG2-CD2 3.4Å; T143-H163 WeakPolarHBondContact CG2-CD2 3.36Å; T143-H163 WeakPolarHBondContact CG2-ND1 3.45Å; E146-H163 IonicContact OE2-CD2 3.65Å; E146-H163 IonicContact OE2-CE1 2.76Å; E146-H163 IonicContact OE2-NE2 2.6Å; E146-H163 PolarHBondContact OE2-NE2 3Å; I159-H163 PolarHBondContact O-CD2 3.45Å; I159-H163 VanDerWaalsContact O-CD2 3.3Å; I159-H163 PolarHBondContact O-N 3.05Å; I159-H163 VanDerWaalsContact O-N 3.1Å; H163-L165 HydrophobicContact CB-CG 4.4Å; H163-L165 PolarHBondContact O-N 2.9Å
164	N	51.3	Low	62.9	Low	151 Å²	151	71 Å²	71	81%	0.807	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	13.7	178.4	-77	-37.7	0	0	0	116.4	Q162 S166	Q162-N164 VanDerWaalsContact C-N 3.33Å; Q162-N164 PolarHBondContact O-N 3.21Å; N164-S166 PolarHBondContact O-N 2.98Å; N164-S166 VanDerWaalsContact O-N 3.09Å
165	L	56.8	Low	62.7	Low	61 Å²	61	61.2 Å²	61.2	32%	0.319	32%	0.322	S	S	.	.			trans	-63.2	113.1	175.6	-67.4	172.5	0	0	0	108.7	F160 H163 T167	F160-L165 HydrophobicContact CD1-CB 4.32Å; F160-L165 HydrophobicContact CD1-CD1 3.89Å; F160-L165 HydrophobicContact CE1-CD1 4.1Å; H163-L165 HydrophobicContact CB-CG 4.4Å; H163-L165 PolarHBondContact O-N 2.9Å; L165-T167 PolarHBondContact O-N 3.06Å
166	S	46	Very low	62.7	Low	85 Å²	85	58.1 Å²	58.1	59%	0.594	31%	0.306	S	S	*	.			trans	-73.9	40.2	-173.6	61.5	0	0	0	0	114	L107 N164	L107-S166 WeakPolarHBondContact CD1-OG 3.36Å; L107-S166 VanDerWaalsContact CD2-OG 3.28Å; L107-S166 WeakPolarHBondContact CD2-OG 3.47Å; N164-S166 PolarHBondContact O-N 2.98Å; N164-S166 VanDerWaalsContact O-N 3.09Å
167	T	52.1	Low	62.5	Low	17 Å²	17	60.7 Å²	60.7	10%	0.104	32%	0.316	C	S	.	.			trans	-78.2	139	169.7	65.7	0	0	0	0	109.7	Y98 Q104 L165 V169	Y98-T167 WeakPolarHBondContact OH-CB 3.45Å; Y98-T167 PolarHBondContact OH-OG1 3.43Å; Q104-T167 HydrophobicContact CG-CG2 4.41Å; L165-T167 PolarHBondContact O-N 3.06Å; T167-V169 PolarHBondContact O-N 2.75Å
168	P	56	Low	62.5	Low	72 Å²	72	62.5 Å²	62.5	47%	0.468	32%	0.324	S	S	.	.			trans	-67.5	125.3	176.3	28.2	-33.9	0	0	0	109.6	Y98 I103 L170	Y98-P168 PolarHBondContact OH-O 3.19Å; I103-P168 HydrophobicContact CG2-CG 4.11Å; P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 HydrophobicContact CB-CD2 3.94Å; P168-L170 HydrophobicContact CG-CD2 3.9Å; P168-L170 HydrophobicContact CG-CG 4.43Å; P168-L170 WeakPolarHBondContact O-CG 3.02Å; P168-L170 PolarHBondContact O-N 2.95Å
169	V	63.1	Low	62.2	Low	67 Å²	67	60.7 Å²	60.7	41%	0.406	32%	0.315	S	S	.	.			trans	-70.1	90.9	175.9	-177.9	0	0	0	0	109.2	T157 R161 T167	T157-V169 HydrophobicContact CG2-CG1 3.97Å; R161-V169 HydrophobicContact CG-CG2 4.07Å; T167-V169 PolarHBondContact O-N 2.75Å
170	L	65	Low	62	Low	25 Å²	25	60.8 Å²	60.8	13%	0.131	32%	0.316	C	S	.	.			trans	-71.1	155.9	-177.9	-61.8	-168.5	0	0	0	111.7	Y98 I103 Y153 P168 V174 I175 I178	Y98-L170 HydrophobicContact CE2-CB 4.24Å; Y98-L170 HydrophobicContact CE2-CD1 4.12Å; Y98-L170 HydrophobicContact CE2-CG 4.05Å; I103-L170 HydrophobicContact CD1-CD1 3.72Å; Y153-L170 PolarHBondContact OH-O 2.94Å; P168-L170 VanDerWaalsContact C-N 3.31Å; P168-L170 HydrophobicContact CB-CD2 3.94Å; P168-L170 HydrophobicContact CG-CD2 3.9Å; P168-L170 HydrophobicContact CG-CG 4.43Å; P168-L170 WeakPolarHBondContact O-CG 3.02Å; P168-L170 PolarHBondContact O-N 2.95Å; L170-V174 HydrophobicContact CB-CB 4.1Å; L170-V174 HydrophobicContact CB-CG1 4.29Å; L170-V174 HydrophobicContact CD1-CG1 4.07Å; L170-V174 HydrophobicContact CD2-CB 4.45Å; L170-V174 HydrophobicContact CD2-CG1 3.78Å; L170-V174 HydrophobicContact CG-CG1 4.26Å; L170-I175 HydrophobicContact CB-CD1 4.37Å; L170-I175 HydrophobicContact CB-CG1 3.76Å; L170-I175 HydrophobicContact CD1-CG1 3.87Å; L170-I175 HydrophobicContact CG-CG1 4.45Å; L170-I178 HydrophobicContact CD1-CD1 3.72Å
171	E	71.8	Confident	61.8	Low	128 Å²	128	63 Å²	63	60%	0.598	33%	0.328	S	S	*	.			trans	-78.6	154.5	161.6	-51.3	-177.5	133.3	0	0	109.7	A173 V174 I175	E171-A173 PolarHBondContact O-N 2.98Å; E171-A173 VanDerWaalsContact O-N 3.1Å; E171-V174 HydrophobicContact CB-CB 4.45Å; E171-V174 HydrophobicContact CB-CG2 3.88Å; E171-V174 HydrophobicContact CG-CG2 4.13Å; E171-V174 WeakPolarHBondContact O-CA 3.16Å; E171-V174 WeakPolarHBondContact O-CB 3.45Å; E171-V174 PolarHBondContact O-N 3.09Å; E171-I175 PolarHBondContact O-N 3.31Å; E171-I175 VanDerWaalsContact O-N 3.15Å
172	K	72	Confident	61.4	Low	68 Å²	68	57.4 Å²	57.4	30%	0.296	32%	0.315	S	S	.	.	H	α-helix	trans	-43.8	-46.8	170.6	-70.5	-171.4	153.6	-163.4	0	112.7	E90 N91 L94 Y153 I175 V176	E90-K172 IonicContact OE1-NZ 3.75Å; E90-K172 PolarHBondContact OE1-NZ 3.23Å; N91-K172 WeakPolarHBondContact OD1-CE 3.49Å; N91-K172 PolarHBondContact OD1-NZ 3.36Å; L94-K172 HydrophobicContact CD1-CB 4.14Å; L94-K172 HydrophobicContact CD1-CD 3.53Å; L94-K172 VanDerWaalsContact CD1-CE 3.42Å; L94-K172 HydrophobicContact CD1-CG 3.84Å; Y153-K172 HydrophobicContact CD1-CG 3.85Å; Y153-K172 HydrophobicContact CE1-CG 4.29Å; Y153-K172 HydrophobicContact CG-CG 4.29Å; K172-I175 PolarHBondContact O-N 3.1Å; K172-V176 WeakPolarHBondContact O-CG2 3.45Å; K172-V176 PolarHBondContact O-N 3.45Å
173	A	68.4	Low	61.1	Low	40 Å²	40	51.6 Å²	51.6	33%	0.331	29%	0.288	S	S	.	.	H	α-helix	trans	-68.5	-34.1	179.9	0	0	0	0	0	112.4	E171 V176 R177	E171-A173 PolarHBondContact O-N 2.98Å; E171-A173 VanDerWaalsContact O-N 3.1Å; A173-V176 PolarHBondContact O-N 2.98Å; A173-R177 VanDerWaalsContact C-NE 3.34Å; A173-R177 WeakPolarHBondContact O-CD 3.18Å; A173-R177 WeakPolarHBondContact O-CG 3.21Å; A173-R177 PolarHBondContact O-N 3.04Å; A173-R177 VanDerWaalsContact O-N 3.09Å; A173-R177 PolarHBondContact O-NE 3.43Å
174	V	65.6	Low	60.9	Low	34 Å²	34	51.6 Å²	51.6	21%	0.206	30%	0.295	C	S	.	.	H	α-helix	trans	-60.7	-47.6	175.6	-175.7	0	0	0	0	110.7	L170 E171 V176 R177 I178	L170-V174 HydrophobicContact CB-CB 4.1Å; L170-V174 HydrophobicContact CB-CG1 4.29Å; L170-V174 HydrophobicContact CD1-CG1 4.07Å; L170-V174 HydrophobicContact CD2-CB 4.45Å; L170-V174 HydrophobicContact CD2-CG1 3.78Å; L170-V174 HydrophobicContact CG-CG1 4.26Å; E171-V174 HydrophobicContact CB-CB 4.45Å; E171-V174 HydrophobicContact CB-CG2 3.88Å; E171-V174 HydrophobicContact CG-CG2 4.13Å; E171-V174 WeakPolarHBondContact O-CA 3.16Å; E171-V174 WeakPolarHBondContact O-CB 3.45Å; E171-V174 PolarHBondContact O-N 3.09Å; V174-V176 PolarHBondContact O-N 3.01Å; V174-R177 PolarHBondContact O-N 3.45Å; V174-I178 HydrophobicContact CG1-CD1 3.87Å; V174-I178 HydrophobicContact CG1-CG1 4.4Å; V174-I178 WeakPolarHBondContact O-CG1 3.34Å; V174-I178 PolarHBondContact O-N 2.94Å
175	I	65.7	Low	60.7	Low	0 Å²	0	49 Å²	49	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56	-52.5	177	-58.7	170.7	0	0	0	110.8	L97 Y98 L101 Y153 L170 E171 K172 R177 I178 A179	L97-I175 HydrophobicContact CB-CG2 4.13Å; L97-I175 HydrophobicContact CD2-CG2 3.97Å; L97-I175 HydrophobicContact CG-CG2 3.88Å; Y98-I175 HydrophobicContact CD2-CD1 3.51Å; Y98-I175 HydrophobicContact CD2-CG1 3.84Å; Y98-I175 HydrophobicContact CE2-CD1 4.36Å; Y98-I175 HydrophobicContact CG-CD1 4.18Å; L101-I175 HydrophobicContact CD1-CG2 3.84Å; Y153-I175 HydrophobicContact CD2-CD1 4.25Å; Y153-I175 HydrophobicContact CE1-CD1 4.49Å; Y153-I175 HydrophobicContact CE2-CD1 3.28Å; Y153-I175 VanDerWaalsContact CZ-CD1 3.45Å; Y153-I175 WeakPolarHBondContact OH-CD1 3.4Å; L170-I175 HydrophobicContact CB-CD1 4.37Å; L170-I175 HydrophobicContact CB-CG1 3.76Å; L170-I175 HydrophobicContact CD1-CG1 3.87Å; L170-I175 HydrophobicContact CG-CG1 4.45Å; E171-I175 PolarHBondContact O-N 3.31Å; E171-I175 VanDerWaalsContact O-N 3.15Å; K172-I175 PolarHBondContact O-N 3.1Å; I175-R177 VanDerWaalsContact C-N 3.29Å; I175-R177 PolarHBondContact O-N 2.92Å; I175-I178 PolarHBondContact O-N 3.33Å; I175-I178 VanDerWaalsContact O-N 3.08Å; I175-A179 PolarHBondContact O-N 2.96Å
176	V	68.2	Low	60.1	Low	11 Å²	11	51.8 Å²	51.8	7%	0.067	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-36.4	-177.7	174.7	0	0	0	0	111.9	L94 L97 K172 A173 V174 S180 I275 Y285	L94-V176 HydrophobicContact CD2-CG2 3.6Å; L97-V176 HydrophobicContact CD2-CG2 4.09Å; K172-V176 WeakPolarHBondContact O-CG2 3.45Å; K172-V176 PolarHBondContact O-N 3.45Å; A173-V176 PolarHBondContact O-N 2.98Å; V174-V176 PolarHBondContact O-N 3.01Å; V176-S180 WeakPolarHBondContact O-CB 3.26Å; V176-S180 PolarHBondContact O-N 3.39Å; V176-I275 HydrophobicContact CG1-CD1 4.02Å; V176-Y285 HydrophobicContact CG1-CD1 3.64Å; V176-Y285 HydrophobicContact CG1-CD2 3.77Å; V176-Y285 HydrophobicContact CG1-CE1 3.92Å; V176-Y285 HydrophobicContact CG1-CE2 4.04Å; V176-Y285 HydrophobicContact CG1-CG 3.55Å
177	R	61.9	Low	60.1	Low	55 Å²	55	49.4 Å²	49.4	21%	0.208	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-43.5	173.3	-55.3	139.1	-163.1	-179.8	1	111.7	A173 V174 I175 S180 N181 V266	A173-R177 VanDerWaalsContact C-NE 3.34Å; A173-R177 WeakPolarHBondContact O-CD 3.18Å; A173-R177 WeakPolarHBondContact O-CG 3.21Å; A173-R177 PolarHBondContact O-N 3.04Å; A173-R177 VanDerWaalsContact O-N 3.09Å; A173-R177 PolarHBondContact O-NE 3.43Å; V174-R177 PolarHBondContact O-N 3.45Å; I175-R177 VanDerWaalsContact C-N 3.29Å; I175-R177 PolarHBondContact O-N 2.92Å; R177-S180 PolarHBondContact O-N 3.38Å; R177-N181 VanDerWaalsContact O-CB 3.26Å; R177-N181 WeakPolarHBondContact O-CB 3.26Å; R177-N181 PolarHBondContact O-N 2.9Å; R177-N181 PolarHBondContact O-OD1 3.26Å; R177-V266 VanDerWaalsContact CD-CG2 3.48Å; R177-V266 HydrophobicContact CG-CB 4.28Å; R177-V266 HydrophobicContact CG-CG1 3.78Å; R177-V266 HydrophobicContact CG-CG2 4.18Å
178	I	65.8	Low	59.8	Low	55 Å²	55	52.9 Å²	52.9	28%	0.282	28%	0.28	S	S	.	.	H	α-helix	trans	-64.5	-44.7	-179.2	-65.1	171.7	0	0	0	109.6	L101 I103 L170 V174 I175 N181 S182	L101-I178 HydrophobicContact CD1-CB 4.12Å; L101-I178 HydrophobicContact CD1-CG2 3.97Å; L101-I178 HydrophobicContact CD2-CG2 3.83Å; I103-I178 HydrophobicContact CD1-CD1 4.14Å; L170-I178 HydrophobicContact CD1-CD1 3.72Å; V174-I178 HydrophobicContact CG1-CD1 3.87Å; V174-I178 HydrophobicContact CG1-CG1 4.4Å; V174-I178 WeakPolarHBondContact O-CG1 3.34Å; V174-I178 PolarHBondContact O-N 2.94Å; I175-I178 PolarHBondContact O-N 3.33Å; I175-I178 VanDerWaalsContact O-N 3.08Å; I178-N181 PolarHBondContact O-N 2.82Å; I178-S182 WeakPolarHBondContact O-CB 3.37Å; I178-S182 PolarHBondContact O-N 2.81Å; I178-S182 PolarHBondContact O-OG 2.9Å
179	A	64.3	Low	59	Low	14 Å²	14	53.6 Å²	53.6	12%	0.116	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-48.1	173.9	0	0	0	0	0	112.2	L97 L101 I175 N181 S182 L183	L97-A179 HydrophobicContact CD1-CB 3.65Å; L97-A179 HydrophobicContact CD2-CB 3.89Å; L97-A179 HydrophobicContact CG-CB 3.86Å; L101-A179 HydrophobicContact CD2-CB 4.21Å; I175-A179 PolarHBondContact O-N 2.96Å; A179-N181 VanDerWaalsContact C-N 3.33Å; A179-N181 PolarHBondContact O-N 3.45Å; A179-S182 PolarHBondContact O-N 2.82Å; A179-L183 VanDerWaalsContact O-CB 3.26Å; A179-L183 WeakPolarHBondContact O-CB 3.44Å; A179-L183 PolarHBondContact O-N 3.5Å
180	S	62.6	Low	57.8	Low	10 Å²	10	57.1 Å²	57.1	7%	0.07	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-39.6	177.5	-172.4	0	0	0	0	112.6	V176 R177 C184	V176-S180 WeakPolarHBondContact O-CB 3.26Å; V176-S180 PolarHBondContact O-N 3.39Å; R177-S180 PolarHBondContact O-N 3.38Å; S180-C184 WeakPolarHBondContact O-CB 3.21Å; S180-C184 PolarHBondContact O-N 2.85Å
181	N	58.6	Low	56.5	Low	53 Å²	53	59.2 Å²	59.2	28%	0.283	30%	0.301	S	S	.	.	H	α-helix	trans	-74.7	-39.8	178.7	-71.6	1	0	0	0	111.4	R177 I178 A179 C184 L185	R177-N181 VanDerWaalsContact O-CB 3.26Å; R177-N181 WeakPolarHBondContact O-CB 3.26Å; R177-N181 PolarHBondContact O-N 2.9Å; R177-N181 PolarHBondContact O-OD1 3.26Å; I178-N181 PolarHBondContact O-N 2.82Å; A179-N181 VanDerWaalsContact C-N 3.33Å; A179-N181 PolarHBondContact O-N 3.45Å; N181-C184 PolarHBondContact O-N 3.37Å; N181-L185 WeakPolarHBondContact O-CB 3.32Å; N181-L185 PolarHBondContact O-N 3.21Å
182	S	54.3	Low	54.7	Low	49 Å²	49	55.6 Å²	55.6	34%	0.343	29%	0.29	S	S	.	.	H	α-helix	trans	-67.4	-38.1	177.6	-56.3	0	0	0	0	111.7	I178 A179 Y186	I178-S182 WeakPolarHBondContact O-CB 3.37Å; I178-S182 PolarHBondContact O-N 2.81Å; I178-S182 PolarHBondContact O-OG 2.9Å; A179-S182 PolarHBondContact O-N 2.82Å; S182-Y186 WeakPolarHBondContact O-CB 3.2Å; S182-Y186 PolarHBondContact O-N 3.33Å
183	L	55	Low	52.7	Low	17 Å²	17	57 Å²	57	9%	0.089	31%	0.305	C	S	.	.	H	α-helix	trans	-77.5	-34	176.6	-174.5	48.9	0	0	0	112.3	A179 L185 Y186 N187 L468 I576	A179-L183 VanDerWaalsContact O-CB 3.26Å; A179-L183 WeakPolarHBondContact O-CB 3.44Å; A179-L183 PolarHBondContact O-N 3.5Å; L183-L185 VanDerWaalsContact C-N 3.35Å; L183-Y186 HydrophobicContact CD1-CD1 4.28Å; L183-Y186 PolarHBondContact O-N 2.9Å; L183-N187 WeakPolarHBondContact CD1-OD1 3.42Å; L183-N187 WeakPolarHBondContact O-CB 3.44Å; L183-N187 VanDerWaalsContact O-CG 3.26Å; L183-N187 PolarHBondContact O-N 3.17Å; L183-L468 HydrophobicContact CD1-CB 4.26Å; L183-L468 HydrophobicContact CD1-CD1 4.1Å; L183-L468 HydrophobicContact CD1-CD2 3.91Å; L183-L468 HydrophobicContact CD1-CG 4.31Å; L183-L468 HydrophobicContact CD2-CB 4.1Å; L183-L468 HydrophobicContact CD2-CD2 3.79Å; L183-L468 HydrophobicContact CG-CD2 4.46Å; L183-I576 HydrophobicContact CD2-CD1 3.58Å; L183-I576 HydrophobicContact CD2-CG1 4.02Å; L183-I576 HydrophobicContact CG-CD1 4.18Å
184	C	53.9	Low	51.1	Low	71 Å²	71	61.5 Å²	61.5	48%	0.48	32%	0.319	S	S	.	.	H	α-helix	trans	-61.7	-43.4	168.6	-177.1	0	0	0	0	111.3	S180 N181 W188	S180-C184 WeakPolarHBondContact O-CB 3.21Å; S180-C184 PolarHBondContact O-N 2.85Å; N181-C184 PolarHBondContact O-N 3.37Å; C184-W188 WeakPolarHBondContact O-CB 3.38Å; C184-W188 PolarHBondContact O-N 3.47Å; C184-W188 VanDerWaalsContact O-N 3.11Å
185	L	47.3	Very low	49.3	Very low	97 Å²	97	64.9 Å²	64.9	51%	0.508	34%	0.344	S	S	.	.	H	α-helix	trans	-60.7	-48.7	170.3	-88.9	161.2	0	0	0	111.9	N181 L183 N187 W188 L189	N181-L185 WeakPolarHBondContact O-CB 3.32Å; N181-L185 PolarHBondContact O-N 3.21Å; L183-L185 VanDerWaalsContact C-N 3.35Å; L185-N187 PolarHBondContact O-N 2.71Å; L185-W188 PolarHBondContact O-N 3.15Å; L185-L189 WeakPolarHBondContact O-CB 3.29Å; L185-L189 WeakPolarHBondContact O-CG 3.34Å; L185-L189 PolarHBondContact O-N 2.8Å
186	Y	45.3	Very low	47.6	Very low	120 Å²	120	73.1 Å²	73.1	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-58.5	-49.9	-178.9	-174.5	-92.1	0	0	0	111.7	S182 L183 W188 L189 Y190	S182-Y186 WeakPolarHBondContact O-CB 3.2Å; S182-Y186 PolarHBondContact O-N 3.33Å; L183-Y186 HydrophobicContact CD1-CD1 4.28Å; L183-Y186 PolarHBondContact O-N 2.9Å; Y186-W188 VanDerWaalsContact C-N 3.28Å; Y186-W188 PolarHBondContact O-N 3.01Å; Y186-L189 PolarHBondContact O-N 3.44Å; Y186-Y190 AromaticContact CD2-CD2 3.93Å; Y186-Y190 HydrophobicContact CD2-CD2 3.93Å; Y186-Y190 HydrophobicContact CD2-CE2 4.48Å; Y186-Y190 AromaticContact CE2-CD2 3.84Å; Y186-Y190 HydrophobicContact CE2-CD2 3.84Å; Y186-Y190 HydrophobicContact CE2-CE2 4.4Å; Y186-Y190 HydrophobicContact CG-CD2 4.46Å; Y186-Y190 PolarHBondContact O-N 3.24Å
187	N	46.2	Very low	45.6	Very low	35 Å²	35	77.5 Å²	77.5	19%	0.187	42%	0.419	C	S	.	.	H	α-helix	trans	-67.3	-27.1	179.2	-64.7	-5.9	0	0	0	112.9	L183 L185 S466	L183-N187 WeakPolarHBondContact CD1-OD1 3.42Å; L183-N187 WeakPolarHBondContact O-CB 3.44Å; L183-N187 VanDerWaalsContact O-CG 3.26Å; L183-N187 PolarHBondContact O-N 3.17Å; L185-N187 PolarHBondContact O-N 2.71Å; N187-S466 VanDerWaalsContact ND2-CB 3.3Å; N187-S466 WeakPolarHBondContact ND2-CB 3.45Å; N187-S466 PolarHBondContact ND2-OG 2.68Å
188	W	45.9	Very low	44	Very low	89 Å²	89	82.3 Å²	82.3	34%	0.337	45%	0.449	S	S	.	.	H	α-helix	trans	-82	-21.3	176.3	-177.7	82.5	0	0	0	113.6	C184 L185 Y186 F726 R740	C184-W188 WeakPolarHBondContact O-CB 3.38Å; C184-W188 PolarHBondContact O-N 3.47Å; C184-W188 VanDerWaalsContact O-N 3.11Å; L185-W188 PolarHBondContact O-N 3.15Å; Y186-W188 VanDerWaalsContact C-N 3.28Å; Y186-W188 PolarHBondContact O-N 3.01Å; W188-F726 AromaticContact CE2-CE2 3.64Å; W188-F726 HydrophobicContact CH2-CD2 4.15Å; W188-F726 HydrophobicContact CH2-CE2 4.2Å; W188-F726 AromaticContact CZ2-CD2 3.59Å; W188-F726 HydrophobicContact CZ2-CD2 3.59Å; W188-F726 AromaticContact CZ2-CE2 3.24Å; W188-F726 HydrophobicContact CZ2-CE2 3.24Å; W188-F726 HydrophobicContact CZ2-CG 4.44Å; W188-F726 AromaticContact CZ2-CZ 3.85Å; W188-F726 HydrophobicContact CZ2-CZ 3.85Å; W188-F726 AromaticContact NE1-CE2 3.72Å; W188-F726 AromaticContact NE1-CZ 3.84Å; W188-R740 VanDerWaalsContact CE2-NH1 3.33Å; W188-R740 VanDerWaalsContact CZ2-CZ 3.41Å; W188-R740 PolarHBondContact O-NH1 3.03Å
189	L	37.7	Very low	42.3	Very low	87 Å²	87	86.9 Å²	86.9	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-89.4	-35.1	172.3	-69	168.6	0	0	0	112.2	L185 Y186	L185-L189 WeakPolarHBondContact O-CB 3.29Å; L185-L189 WeakPolarHBondContact O-CG 3.34Å; L185-L189 PolarHBondContact O-N 2.8Å; Y186-L189 PolarHBondContact O-N 3.44Å
190	Y	38.1	Very low	40.7	Very low	142 Å²	142	95.9 Å²	95.9	56%	0.557	52%	0.516	S	S	*	.			trans	-136.4	87	-173.4	-55.5	-73.9	0	0	0	111.3	Y186 S192	Y186-Y190 AromaticContact CD2-CD2 3.93Å; Y186-Y190 HydrophobicContact CD2-CD2 3.93Å; Y186-Y190 HydrophobicContact CD2-CE2 4.48Å; Y186-Y190 AromaticContact CE2-CD2 3.84Å; Y186-Y190 HydrophobicContact CE2-CD2 3.84Å; Y186-Y190 HydrophobicContact CE2-CE2 4.4Å; Y186-Y190 HydrophobicContact CG-CD2 4.46Å; Y186-Y190 PolarHBondContact O-N 3.24Å; Y190-S192 PolarHBondContact O-N 2.77Å
191	P	38.5	Very low	39	Very low	68 Å²	68	100.9 Å²	100.9	44%	0.442	55%	0.548	S	S	.	.			trans	-63.3	114.8	168.1	-18.9	32.6	0	0	0	109.8	T193	P191-T193 PolarHBondContact O-N 3.34Å
192	S	34.7	Very low	37.6	Very low	53 Å²	53	107.7 Å²	107.7	37%	0.371	58%	0.578	S	S	.	*			trans	-79.2	115.2	-175.3	52.7	0	0	0	0	112.1	Y190 E194	Y190-S192 PolarHBondContact O-N 2.77Å; S192-E194 PolarHBondContact O-N 3.2Å
193	T	28.9	Very low	36.4	Very low	97 Å²	97	112.1 Å²	112.1	60%	0.595	60%	0.598	S	S	*	*			trans	-83.4	89.3	173.9	53.6	0	0	0	0	111	P191 S195 N781	P191-T193 PolarHBondContact O-N 3.34Å; T193-S195 PolarHBondContact O-N 3.31Å; T193-N781 HydrophobicContact CG2-CB 4.35Å
194	E	34	Very low	35.2	Very low	135 Å²	135	121.3 Å²	121.3	63%	0.631	64%	0.638	S	S	*	*			trans	-81.8	97.3	168.6	-65.9	-163.8	124.4	0	0	109.6	S192 D196 N467	S192-E194 PolarHBondContact O-N 3.2Å; E194-D196 PolarHBondContact O-N 3.48Å; E194-N467 PolarHBondContact OE2-ND2 3.15Å
195	S	27.7	Very low	34	Very low	105 Å²	105	125.2 Å²	125.2	73%	0.734	65%	0.653	S	S	*	*			trans	-83.2	107.2	179.5	59.6	0	0	0	0	111.9	T193 S197	T193-S195 PolarHBondContact O-N 3.31Å; S195-S197 PolarHBondContact O-N 3.2Å
196	D	31.8	Very low	33.2	Very low	173 Å²	173	126.5 Å²	126.5	93%	0.925	67%	0.667	S	S	*	*			trans	-71.3	83.1	179.1	-105.9	-24.9	0	0	0	112.5	E194 N198	E194-D196 PolarHBondContact O-N 3.48Å; D196-N198 PolarHBondContact O-N 2.91Å; D196-N198 VanDerWaalsContact O-N 3.15Å
197	S	26.1	Very low	32.5	Very low	102 Å²	102	127.8 Å²	127.8	71%	0.713	68%	0.681	S	S	*	*			trans	-79.8	89.8	178.5	63.1	0	0	0	0	112.1	S195	S195-S197 PolarHBondContact O-N 3.2Å
198	N	26.8	Very low	31.7	Very low	156 Å²	156	132.9 Å²	132.9	83%	0.834	71%	0.713	S	S	*	*			trans	-171	89.7	156	-99.9	-44.2	0	0	0	115.1	D196	D196-N198 PolarHBondContact O-N 2.91Å; D196-N198 VanDerWaalsContact O-N 3.15Å
199	T	31.2	Very low	30.9	Very low	151 Å²	151	131.9 Å²	131.9	93%	0.926	73%	0.73	S	S	*	*			trans	-165.1	156.7	144.9	5.2	0	0	0	0	110.6
200	K	29.6	Very low	30.3	Very low	204 Å²	204	133.1 Å²	133.1	89%	0.887	75%	0.745	S	S	*	*			trans	-96.2	147.5	-168	-67.1	-179.4	179.8	177.5	0	113.5
201	P	27.1	Very low	29.9	Very low	115 Å²	115	137.6 Å²	137.6	75%	0.747	76%	0.763	S	S	*	*			trans	-91.2	154.4	176.5	36.3	-35.3	0	0	0	113.7
202	Q	30.5	Very low	29.7	Very low	195 Å²	195	139.7 Å²	139.7	91%	0.911	78%	0.776	S	S	*	*			trans	-146.2	161.5	151.2	-79.4	-148.2	0.5	0	0	110.9
203	N	27.8	Very low	29.5	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	80%	0.796	S	S	*	*			trans	-113.1	159	-159.1	-47.8	-49	0	0	0	113.7
204	K	29.5	Very low	29.7	Very low	210 Å²	210	146.7 Å²	146.7	91%	0.913	81%	0.805	S	S	*	*				-178.6	145.1	121	-96.8	155.2	-174.9	177.1	0	115.3
205	L	29	Very low	29.5	Very low	152 Å²	152	146 Å²	146	80%	0.796	82%	0.815	S	S	*	*			trans	-118.6	163.9	165.4	-101.2	147.8	0	0	0	107.1
206	P	31.2	Very low	29.7	Very low	124 Å²	124	148 Å²	148	81%	0.805	82%	0.818	S	S	*	*				-148.8	-132.9	62	41.4	-18.1	0	0	0	114.1
207	L	29.5	Very low	29.7	Very low	148 Å²	148	144.8 Å²	144.8	78%	0.775	81%	0.809	S	S	*	*				-165.7	173.5	-98.2	-166	62.4	0	0	0	111.2
208	V	29.6	Very low	29.9	Very low	142 Å²	142	145 Å²	145	86%	0.861	81%	0.811	S	S	*	*			trans	82.8	142.7	166.5	-171.1	0	0	0	0	115.9
209	G	29.2	Very low	30.1	Very low	67 Å²	67	142.5 Å²	142.5	69%	0.691	81%	0.805	S	S	*	*			cis	-166.9	-160.3	6.9	0	0	0	0	0	116.3
210	C	26.2	Very low	30	Very low	114 Å²	114	140.7 Å²	140.7	77%	0.77	80%	0.799	S	S	*	*			trans	-112.3	175.7	-156.8	-43.3	0	0	0	0	116.9
211	Y	28.8	Very low	29.9	Very low	235 Å²	235	135.7 Å²	135.7	92%	0.922	79%	0.789	S	S	*	*				172	150.3	122.4	-86	-59.4	0	0	0	114.9
212	P	35.4	Very low	30	Very low	113 Å²	113	138 Å²	138	73%	0.734	79%	0.794	S	S	*	*			trans	-135.6	171.5	-175.4	44.2	-29.7	0	0	0	119.1
213	T	30.1	Very low	29.9	Very low	127 Å²	127	134.6 Å²	134.6	78%	0.779	79%	0.786	S	S	*	*			trans	-166.5	-176.3	163.4	46.5	0	0	0	0	111.6
214	E	31.8	Very low	29.9	Very low	169 Å²	169	133 Å²	133	79%	0.79	79%	0.785	S	S	*	*				-162.3	152.1	-60.3	-95.5	174.4	117.5	0	0	113.2
215	S	30.8	Very low	29.9	Very low	121 Å²	121	130.4 Å²	130.4	85%	0.846	78%	0.778	S	S	*	*			trans	67.1	169.3	159.6	71.6	0	0	0	0	122.8
216	D	31.9	Very low	29.8	Very low	147 Å²	147	129.8 Å²	129.8	79%	0.786	77%	0.771	S	S	*	*				-165.8	164.8	-55.5	-152.5	-84.9	0	0	0	113.9
217	S	31.2	Very low	29.7	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	76%	0.763	S	S	*	*			trans	69.7	173.5	160.2	84.7	0	0	0	0	120.8
218	S	30.5	Very low	29.9	Very low	107 Å²	107	125.8 Å²	125.8	75%	0.748	75%	0.746	S	S	*	*			cis	-177.4	170.1	-43.6	67.7	0	0	0	0	110.4
219	S	30.5	Very low	29.9	Very low	102 Å²	102	122.7 Å²	122.7	71%	0.713	72%	0.724	S	S	*	*			cis	-171.8	167.5	-37.7	63.3	0	0	0	0	113
220	S	29.7	Very low	30	Very low	114 Å²	114	123.4 Å²	123.4	80%	0.797	72%	0.718	S	S	*	*			trans	76.2	158.4	164.1	79	0	0	0	0	121.7
221	S	28.5	Very low	30.3	Very low	98 Å²	98	123.1 Å²	123.1	69%	0.685	72%	0.716	S	S	*	*			cis	177.5	152.4	-46	57.1	0	0	0	0	113.6
222	I	29	Very low	30.5	Very low	165 Å²	165	118.4 Å²	118.4	85%	0.846	71%	0.706	S	S	*	*			trans	149.7	168.6	151.6	-76.9	160.9	0	0	0	115
223	T	27.7	Very low	30.4	Very low	122 Å²	122	119.1 Å²	119.1	75%	0.748	70%	0.704	S	S	*	*			trans	-139.5	164.8	-144.9	53.9	0	0	0	0	119.6
224	C	27.4	Very low	30.5	Very low	109 Å²	109	118.8 Å²	118.8	74%	0.736	70%	0.702	S	S	*	*				148	133	129.6	-77.8	0	0	0	0	121.2
225	M	29.3	Very low	30.4	Very low	156 Å²	156	117.2 Å²	117.2	77%	0.768	70%	0.704	S	S	*	*			trans	71.7	165.3	144.2	-63.7	168.8	134.3	0	0	122.7
226	E	28.6	Very low	30.3	Very low	140 Å²	140	115 Å²	115	65%	0.654	69%	0.693	S	S	*	*			cis	-180	169.6	-25.5	-94.4	167.6	-164.6	0	0	109.8
227	M	29.1	Very low	30.2	Very low	130 Å²	130	113.6 Å²	113.6	64%	0.64	69%	0.69	S	S	*	*			cis	-170.4	165.7	-9.2	-123.1	-167.6	-57.7	0	0	116
228	S	32.2	Very low	30	Very low	58 Å²	58	111.9 Å²	111.9	41%	0.406	68%	0.676	S	S	.	*			trans	83.3	108.9	139.3	66.3	0	0	0	0	128.1	S615 D616	S228-S615 CarbonylContact C-O 3.57Å; S228-S615 WeakPolarHBondContact CA-O 3.4Å; S228-S615 PolarHBondContact N-O 2.97Å; S228-D616 WeakPolarHBondContact O-CB 3.44Å
229	D	31.1	Very low	29.9	Very low	77 Å²	77	110.9 Å²	110.9	41%	0.412	67%	0.665	S	S	.	*				134.2	124	126.6	-75.3	7.9	0	0	0	128.2	H614 S615 D616	D229-H614 IonicContact OD1-CE1 3.66Å; D229-H614 IonicContact OD1-CG 3.71Å; D229-H614 IonicContact OD1-ND1 2.69Å; D229-H614 PolarHBondContact OD1-ND1 2.99Å; D229-S615 WeakPolarHBondContact CA-OG 3.3Å; D229-S615 PolarHBondContact N-OG 2.8Å; D229-D616 VanDerWaalsContact N-CB 3.35Å; D229-D616 VanDerWaalsContact N-CG 3.31Å; D229-D616 PolarHBondContact N-OD1 2.91Å
230	C	31.3	Very low	29.9	Very low	82 Å²	82	108.9 Å²	108.9	55%	0.554	65%	0.651	S	S	*	*			trans	73.4	156.9	145.4	-64.4	0	0	0	0	122.3	S615	C230-S615 PolarHBondContact N-OG 3.34Å
231	C	32.5	Very low	29.8	Very low	107 Å²	107	107 Å²	107	72%	0.723	64%	0.637	S	S	*	*			cis	-165.6	-167.5	-15.4	-93	0	0	0	0	108.8
232	D	33	Very low	30	Very low	136 Å²	136	105.7 Å²	105.7	73%	0.727	63%	0.628	S	S	*	*			cis	-156.8	-137.6	12.9	-157.7	68.8	0	0	0	115.3
233	N	32.1	Very low	30	Very low	128 Å²	128	100.8 Å²	100.8	68%	0.684	62%	0.619	S	S	*	*			trans	-124.5	177.8	-157.9	-61.5	-78.5	0	0	0	116.8
234	T	32	Very low	30.1	Very low	121 Å²	121	98 Å²	98	74%	0.742	60%	0.602	S	S	*	*			cis	-172.2	139.8	49.1	40.7	0	0	0	0	118
235	T	30.4	Very low	30.1	Very low	135 Å²	135	100.1 Å²	100.1	83%	0.828	60%	0.599	S	S	*	*			trans	30	158.4	138	58.7	0	0	0	0	126.7
236	A	29.5	Very low	30	Very low	75 Å²	75	95.3 Å²	95.3	62%	0.62	59%	0.589	S	S	*	*			cis	176.6	152	-19.5	0	0	0	0	0	116.3
237	T	28.8	Very low	30	Very low	118 Å²	118	97 Å²	97	72%	0.724	60%	0.601	S	S	*	*			trans	62.9	158.6	138.4	55.3	0	0	0	0	124.2
238	T	27.7	Very low	29.9	Very low	70 Å²	70	98.1 Å²	98.1	43%	0.429	61%	0.605	S	S	.	*			cis	-173.5	152	-10.3	32.1	0	0	0	0	116.9	I1151	T238-I1151 WeakPolarHBondContact OG1-CB 3.33Å; T238-I1151 WeakPolarHBondContact OG1-CG2 3.34Å; T238-I1151 PolarHBondContact OG1-O 3.04Å
239	T	28.7	Very low	29.7	Very low	86 Å²	86	102 Å²	102	53%	0.528	62%	0.619	S	S	.	*			trans	54.4	158.8	141.4	57.3	0	0	0	0	124.6	I1151	T239-I1151 PolarHBondContact OG1-N 3.19Å; T239-I1151 PolarHBondContact OG1-O 2.9Å
240	S	28.6	Very low	29.6	Very low	60 Å²	60	102.9 Å²	102.9	42%	0.42	63%	0.629	S	S	.	*			cis	-175.2	177	-18.8	57.8	0	0	0	0	113.5
241	S	29.5	Very low	29.3	Very low	73 Å²	73	106.6 Å²	106.6	51%	0.51	64%	0.643	S	S	.	*			trans	71	148.8	145.5	48.6	0	0	0	0	121.4	N1147	S241-N1147 WeakPolarHBondContact CB-OD1 3.44Å
242	S	30.8	Very low	29.1	Very low	71 Å²	71	106.8 Å²	106.8	50%	0.497	64%	0.641	S	S	.	*			cis	176.3	153.7	-13	54.5	0	0	0	0	114.7	N1147	S242-N1147 WeakPolarHBondContact CB-OD1 3.42Å; S242-N1147 PolarHBondContact OG-ND2 3.46Å; S242-N1147 PolarHBondContact OG-OD1 2.59Å
243	G	29.5	Very low	28.8	Very low	63 Å²	63	103.1 Å²	103.1	65%	0.649	63%	0.626	S	S	*	*			trans	97.5	164.7	138.5	0	0	0	0	0	121
244	T	30.8	Very low	28.4	Very low	64 Å²	64	100.5 Å²	100.5	39%	0.393	62%	0.618	S	S	.	*			cis	-165.9	162.6	-17.6	-43.3	0	0	0	0	111.8	Y1145 T1146	T244-Y1145 HydrophobicContact CG2-CD1 4.22Å; T244-Y1145 HydrophobicContact CG2-CD2 4.34Å; T244-Y1145 HydrophobicContact CG2-CG 3.78Å; T244-T1146 PolarHBondContact OG1-OG1 2.85Å
245	F	27	Very low	28.2	Very low	153 Å²	153	101.5 Å²	101.5	67%	0.671	62%	0.624	S	S	*	*			trans	75.3	150.6	167.6	-58.7	-78.7	0	0	0	118.9	P1144	F245-P1144 HydrophobicContact CE1-CB 4.49Å; F245-P1144 HydrophobicContact CE1-CG 3.75Å; F245-P1144 HydrophobicContact CZ-CG 4.07Å
246	G	27.1	Very low	28	Very low	54 Å²	54	100.3 Å²	100.3	56%	0.557	62%	0.616	S	S	*	*			cis	163.6	177.7	-10.6	0	0	0	0	0	115.5
247	I	28.6	Very low	27.8	Very low	176 Å²	176	103 Å²	103	90%	0.903	63%	0.627	S	S	*	*			trans	88.7	159.5	167.4	-52.4	165	0	0	0	116.7
248	Q	26.3	Very low	27.7	Very low	154 Å²	154	102.9 Å²	102.9	72%	0.72	63%	0.626	S	S	*	*				-161.5	171.9	-114	-128.6	-177.2	-16.5	0	0	114.8
249	I	27.9	Very low	27.5	Very low	138 Å²	138	104.6 Å²	104.6	71%	0.708	63%	0.628	S	S	*	*			trans	75.3	145.7	145.5	-81.3	165.2	0	0	0	118.9
250	P	29.5	Very low	27.3	Very low	97 Å²	97	105.3 Å²	105.3	63%	0.63	63%	0.634	S	S	*	*			cis	-144.8	-179.7	-25.6	42.8	-23.7	0	0	0	117.5
251	L	25.8	Very low	27.1	Very low	159 Å²	159	111.1 Å²	111.1	83%	0.832	65%	0.652	S	S	*	*			trans	36.3	145.4	145.4	-86.1	70	0	0	0	122.1
252	T	26.6	Very low	27	Very low	112 Å²	112	113.1 Å²	113.1	69%	0.687	67%	0.666	S	S	*	*			cis	-154	167.1	45.4	53.3	0	0	0	0	116
253	S	27.2	Very low	26.8	Very low	58 Å²	58	115.8 Å²	115.8	41%	0.406	68%	0.679	S	S	.	*			trans	68.5	99.3	146.1	68.1	0	0	0	0	123.1	Y1210	S253-Y1210 WeakPolarHBondContact CB-OH 3.11Å; S253-Y1210 PolarHBondContact OG-OH 3.39Å
254	S	24.3	Very low	26.8	Very low	74 Å²	74	116.8 Å²	116.8	52%	0.517	67%	0.669	S	S	.	*				47.1	106	123.6	68.5	0	0	0	0	122.4
255	T	26.7	Very low	27	Very low	142 Å²	142	116.3 Å²	116.3	87%	0.871	67%	0.668	S	S	*	*			trans	-147.5	136.9	131.2	45.3	0	0	0	0	110.1
256	T	27.5	Very low	27.2	Very low	110 Å²	110	110.8 Å²	110.8	68%	0.675	65%	0.647	S	S	*	*			trans	-55	143.8	176.8	48.7	0	0	0	0	113.4	V258	T256-V258 PolarHBondContact O-N 3.11Å; T256-V258 WeakPolarHBondContact OG1-CG2 3.48Å
257	P	24.2	Very low	27.5	Very low	130 Å²	130	115.5 Å²	115.5	84%	0.844	65%	0.654	S	S	*	*			trans	-69.6	83.4	157.4	31.8	-32.2	0	0	0	108.3	F259	P257-F259 PolarHBondContact O-N 3.38Å; P257-F259 VanDerWaalsContact O-N 3.15Å
258	V	27	Very low	27.9	Very low	117 Å²	117	108.8 Å²	108.8	71%	0.709	62%	0.622	S	S	*	*			trans	-57.7	122.4	171.7	179.1	0	0	0	0	107.1	T256	T256-V258 PolarHBondContact O-N 3.11Å; T256-V258 WeakPolarHBondContact OG1-CG2 3.48Å
259	F	24.1	Very low	28.6	Very low	106 Å²	106	107.2 Å²	107.2	47%	0.465	61%	0.613	S	S	.	*			trans	-41.6	127.1	174	-87.2	-89.3	0	0	0	110.4	P257 K261 D704 R728	P257-F259 PolarHBondContact O-N 3.38Å; P257-F259 VanDerWaalsContact O-N 3.15Å; F259-K261 PolarHBondContact O-N 2.9Å; F259-D704 HydrophobicContact CE2-CB 3.88Å; F259-D704 HydrophobicContact CZ-CB 3.59Å; F259-D704 VanDerWaalsContact CZ-OD2 3.32Å; F259-D704 WeakPolarHBondContact CZ-OD2 3.21Å; F259-R728 VanDerWaalsContact CZ-NH2 3.3Å
260	P	24.4	Very low	29.2	Very low	100 Å²	100	105.8 Å²	105.8	65%	0.649	61%	0.614	S	S	*	*			trans	-67.8	87.2	166.6	29.5	-32.4	0	0	0	107.3	S262	P260-S262 PolarHBondContact O-N 3.49Å
261	K	25.4	Very low	29.8	Very low	183 Å²	183	102.2 Å²	102.2	80%	0.796	59%	0.59	S	S	*	*			trans	-45	119.3	162.6	-78.1	-172	175	-175.8	0	105.5	F259 V263	F259-K261 PolarHBondContact O-N 2.9Å; K261-V263 HydrophobicContact CB-CG2 4.34Å; K261-V263 PolarHBondContact O-N 3.34Å
262	S	25.6	Very low	31.4	Very low	115 Å²	115	96 Å²	96	80%	0.804	56%	0.559	S	S	*	*			trans	-74	62.8	-172.2	42.3	0	0	0	0	110.7	P260 L264	P260-S262 PolarHBondContact O-N 3.49Å; S262-L264 VanDerWaalsContact C-N 3.29Å; S262-L264 PolarHBondContact O-N 3.26Å
263	V	27.6	Very low	32.9	Very low	126 Å²	126	91 Å²	91	76%	0.764	53%	0.528	S	S	*	.			trans	-64.5	93.5	174.4	179	0	0	0	0	106.9	K261 S265	K261-V263 HydrophobicContact CB-CG2 4.34Å; K261-V263 PolarHBondContact O-N 3.34Å; V263-S265 VanDerWaalsContact C-N 3.28Å; V263-S265 PolarHBondContact O-N 3.45Å
264	L	29.4	Very low	34.7	Very low	85 Å²	85	88.3 Å²	88.3	45%	0.445	51%	0.509	S	S	.	.			trans	-70.4	90.1	-177	-150.9	130.4	0	0	0	108.4	S262 L271	S262-L264 VanDerWaalsContact C-N 3.29Å; S262-L264 PolarHBondContact O-N 3.26Å; L264-L271 HydrophobicContact CD2-CB 4.15Å; L264-L271 HydrophobicContact CD2-CD1 3.81Å; L264-L271 HydrophobicContact CD2-CG 4.28Å
265	S	34	Very low	36.9	Very low	53 Å²	53	85.2 Å²	85.2	37%	0.371	49%	0.487	S	S	.	.			trans	-60.6	143.3	-178.3	179	0	0	0	0	110.6	V263 H267 S268	V263-S265 VanDerWaalsContact C-N 3.28Å; V263-S265 PolarHBondContact O-N 3.45Å; S265-H267 PolarHBondContact O-N 3.34Å; S265-H267 PolarHBondContact OG-N 3.16Å; S265-S268 WeakPolarHBondContact O-CB 3.48Å; S265-S268 PolarHBondContact O-N 3.47Å
266	V	31.8	Very low	38.9	Very low	38 Å²	38	78.5 Å²	78.5	23%	0.23	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-38.8	-41.7	164.1	-148.1	0	0	0	0	113.3	R177 S268	R177-V266 VanDerWaalsContact CD-CG2 3.48Å; R177-V266 HydrophobicContact CG-CB 4.28Å; R177-V266 HydrophobicContact CG-CG1 3.78Å; R177-V266 HydrophobicContact CG-CG2 4.18Å; V266-S268 VanDerWaalsContact C-N 3.26Å
267	H	34.4	Very low	40.9	Very low	152 Å²	152	74.6 Å²	74.6	70%	0.704	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	3.2	-169.6	-51.5	98.1	0	0	0	111	S265 K269	S265-H267 PolarHBondContact O-N 3.34Å; S265-H267 PolarHBondContact OG-N 3.16Å; H267-K269 PolarHBondContact O-N 3.32Å
268	S	35.9	Very low	42.8	Very low	35 Å²	35	69.8 Å²	69.8	25%	0.245	39%	0.392	C	S	.	.			trans	-65.2	115.5	168.7	-175.7	0	0	0	0	109.3	S265 V266 C270 L271	S265-S268 WeakPolarHBondContact O-CB 3.48Å; S265-S268 PolarHBondContact O-N 3.47Å; V266-S268 VanDerWaalsContact C-N 3.26Å; S268-C270 PolarHBondContact O-N 3.13Å; S268-C270 WeakPolarHBondContact OG-CB 3.42Å; S268-C270 PolarHBondContact OG-N 3.36Å; S268-L271 PolarHBondContact O-N 2.82Å
269	K	42.5	Very low	44.8	Very low	122 Å²	122	68.2 Å²	68.2	53%	0.53	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-7.4	173.6	-60.9	-169.2	175.8	-163.4	0	113.2	H267	H267-K269 PolarHBondContact O-N 3.32Å
270	C	39.1	Very low	46.9	Very low	108 Å²	108	67.5 Å²	67.5	73%	0.73	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.8	176.5	-49.8	0	0	0	0	113.7	S268 V272	S268-C270 PolarHBondContact O-N 3.13Å; S268-C270 WeakPolarHBondContact OG-CB 3.42Å; S268-C270 PolarHBondContact OG-N 3.36Å; C270-V272 PolarHBondContact O-N 2.97Å
271	L	42.3	Very low	49.1	Very low	22 Å²	22	64.9 Å²	64.9	12%	0.115	36%	0.361	C	S	.	.			trans	-84.3	98.7	178.3	-163.6	163.9	0	0	0	110	L264 S268 A273 P287	L264-L271 HydrophobicContact CD2-CB 4.15Å; L264-L271 HydrophobicContact CD2-CD1 3.81Å; L264-L271 HydrophobicContact CD2-CG 4.28Å; S268-L271 PolarHBondContact O-N 2.82Å; L271-A273 HydrophobicContact CD2-CB 4.1Å; L271-P287 HydrophobicContact CD2-CB 4.21Å; L271-P287 HydrophobicContact CD2-CG 3.5Å; L271-P287 WeakPolarHBondContact O-CB 3.47Å; L271-P287 WeakPolarHBondContact O-CG 3.33Å
272	V	60	Low	51.3	Low	29 Å²	29	57.5 Å²	57.5	18%	0.176	33%	0.33	C	S	.	.			trans	-120.4	65.9	-177.1	-161.7	0	0	0	0	109.9	C270 Y290 L293 L579	C270-V272 PolarHBondContact O-N 2.97Å; V272-Y290 HydrophobicContact CG1-CD2 3.88Å; V272-Y290 HydrophobicContact CG1-CG 4.34Å; V272-L293 HydrophobicContact CG1-CD2 4.31Å; V272-L579 HydrophobicContact CB-CB 4.09Å; V272-L579 HydrophobicContact CG1-CB 3.68Å; V272-L579 HydrophobicContact CG1-CD1 3.8Å; V272-L579 HydrophobicContact CG1-CD2 4.3Å; V272-L579 HydrophobicContact CG1-CG 4.14Å; V272-L579 VanDerWaalsContact O-CB 3.32Å; V272-L579 WeakPolarHBondContact O-CB 3.19Å; V272-L579 PolarHBondContact O-N 3.03Å
273	A	56.9	Low	53.5	Low	5 Å²	5	52 Å²	52	4%	0.041	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.1	-175.2	0	0	0	0	0	111.8	L271 P287 I576 Y577 L578	L271-A273 HydrophobicContact CD2-CB 4.1Å; A273-P287 WeakPolarHBondContact O-CD 3.46Å; A273-P287 WeakPolarHBondContact O-CG 3.49Å; A273-I576 HydrophobicContact CB-CG2 4.39Å; A273-Y577 CarbonylContact C-O 3.59Å; A273-Y577 VanDerWaalsContact CA-O 3.22Å; A273-Y577 WeakPolarHBondContact CA-O 3.43Å; A273-L578 HydrophobicContact CB-CD2 3.83Å
274	I	66.8	Low	55.5	Low	2 Å²	2	47.9 Å²	47.9	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.9	174.6	-48.8	176	0	0	0	109.3	V276 I283 Y285 Y290 W463 I576 Y577	I274-V276 HydrophobicContact CG2-CG2 3.79Å; I274-I283 HydrophobicContact CG2-CB 4.39Å; I274-I283 HydrophobicContact CG2-CD1 4.39Å; I274-I283 HydrophobicContact CG2-CG1 4.07Å; I274-I283 HydrophobicContact CG2-CG2 3.67Å; I274-Y285 WeakPolarHBondContact CG2-O 3.36Å; I274-Y290 HydrophobicContact CD1-CD1 4.14Å; I274-Y290 HydrophobicContact CD1-CE1 3.38Å; I274-Y290 HydrophobicContact CD1-CE2 4.5Å; I274-Y290 HydrophobicContact CG1-CD1 3.85Å; I274-Y290 HydrophobicContact CG1-CE1 3.63Å; I274-W463 HydrophobicContact CD1-CH2 3.42Å; I274-W463 VanDerWaalsContact CD1-CH2 3.42Å; I274-W463 HydrophobicContact CD1-CZ2 3.88Å; I274-W463 HydrophobicContact CD1-CZ3 4.05Å; I274-W463 HydrophobicContact CG1-CH2 3.56Å; I274-W463 HydrophobicContact CG1-CZ2 4.5Å; I274-W463 HydrophobicContact CG1-CZ3 3.89Å; I274-I576 WeakPolarHBondContact O-CA 3.37Å; I274-Y577 PolarHBondContact N-O 2.74Å; I274-Y577 PolarHBondContact O-N 2.93Å
275	I	68.9	Low	57.3	Low	10 Å²	10	45.2 Å²	45.2	5%	0.051	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.2	165.6	-47	-179.8	0	0	0	108.9	V176 I284 Y285 I576	V176-I275 HydrophobicContact CG1-CD1 4.02Å; I275-I284 HydrophobicContact CG2-CD1 4.33Å; I275-I284 PolarHBondContact O-N 2.69Å; I275-Y285 HydrophobicContact CD1-CD1 4.15Å; I275-Y285 HydrophobicContact CG1-CD1 4.21Å; I275-Y285 PolarHBondContact N-O 2.65Å; I275-Y285 PolarHBondContact O-N 3.37Å; I275-Y285 VanDerWaalsContact O-N 3.14Å; I275-I576 HydrophobicContact CB-CG1 4.45Å; I275-I576 HydrophobicContact CD1-CD1 4.28Å; I275-I576 HydrophobicContact CG1-CD1 3.89Å; I275-I576 HydrophobicContact CG1-CG1 4.1Å; I275-I576 HydrophobicContact CG2-CG1 4.24Å
276	V	69.7	Low	58.9	Low	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.7	-179.4	-177.5	0	0	0	0	109.5	I274 A278 I282 I283 L306 Q575 Y577	I274-V276 HydrophobicContact CG2-CG2 3.79Å; V276-A278 PolarHBondContact O-N 3.41Å; V276-I282 CarbonylContact C-O 3.57Å; V276-I282 WeakPolarHBondContact CA-O 3.42Å; V276-I283 HydrophobicContact CG2-CG1 4.27Å; V276-L306 HydrophobicContact CG2-CD1 4.44Å; V276-Q575 HydrophobicContact CB-CB 4.47Å; V276-Q575 WeakPolarHBondContact CB-O 3.18Å; V276-Q575 PolarHBondContact N-O 3.38Å; V276-Q575 PolarHBondContact O-N 3.47Å; V276-Y577 HydrophobicContact CB-CD2 4.43Å; V276-Y577 HydrophobicContact CB-CE2 4.19Å; V276-Y577 HydrophobicContact CG2-CD2 3.74Å; V276-Y577 HydrophobicContact CG2-CE2 3.8Å
277	D	69.4	Low	60.6	Low	28 Å²	28	41.1 Å²	41.1	15%	0.15	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	109.1	163.5	172.9	-1.1	0	0	0	108.3	T279 H280 N281 I282 I284	D277-T279 PolarHBondContact O-N 2.86Å; D277-T279 WeakPolarHBondContact OD1-CA 3.47Å; D277-T279 WeakPolarHBondContact OD1-CB 3.43Å; D277-T279 PolarHBondContact OD1-N 3.15Å; D277-T279 PolarHBondContact OD1-OG1 3.27Å; D277-T279 PolarHBondContact OD2-OG1 3.44Å; D277-H280 PolarHBondContact O-N 3.02Å; D277-H280 PolarHBondContact OD1-N 3.39Å; D277-H280 IonicContact OD1-ND1 2.75Å; D277-H280 IonicContact OD2-CE1 2.71Å; D277-H280 IonicContact OD2-CG 3.45Å; D277-H280 IonicContact OD2-ND1 3.58Å; D277-H280 PolarHBondContact OD2-ND1 3Å; D277-N281 CarbonylContact O-C 3.59Å; D277-N281 WeakPolarHBondContact O-CA 3.41Å; D277-N281 PolarHBondContact O-N 2.87Å; D277-I282 HydrophobicContact CB-CB 4.44Å; D277-I282 PolarHBondContact N-O 3.02Å; D277-I282 PolarHBondContact O-N 3.1Å; D277-I284 HydrophobicContact CB-CD1 3.84Å; D277-I284 HydrophobicContact CB-CG1 3.91Å
278	A	63.6	Low	61.9	Low	30 Å²	30	37 Å²	37	25%	0.248	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.7	-178.6	0	0	0	0	0	112.7	V276 N281 N573 Q575	V276-A278 PolarHBondContact O-N 3.41Å; A278-N281 PolarHBondContact O-OD1 3.37Å; A278-N573 HydrophobicContact CB-CB 3.96Å; A278-N573 VanDerWaalsContact CB-O 3.29Å; A278-N573 WeakPolarHBondContact CB-O 3.48Å; A278-N573 PolarHBondContact N-O 3.31Å; A278-Q575 HydrophobicContact CB-CB 4.12Å
279	T	68.5	Low	63	Low	84 Å²	84	36.4 Å²	36.4	52%	0.515	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-29.4	179.2	74.2	0	0	0	0	112.1	D277 N573	D277-T279 PolarHBondContact O-N 2.86Å; D277-T279 WeakPolarHBondContact OD1-CA 3.47Å; D277-T279 WeakPolarHBondContact OD1-CB 3.43Å; D277-T279 PolarHBondContact OD1-N 3.15Å; D277-T279 PolarHBondContact OD1-OG1 3.27Å; D277-T279 PolarHBondContact OD2-OG1 3.44Å; T279-N573 HydrophobicContact CG2-CB 4.3Å
280	H	68.6	Low	64.1	Low	90 Å²	90	30.6 Å²	30.6	42%	0.417	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-5.9	177.8	-61.5	97.6	0	0	0	114.6	D277 I282	D277-H280 PolarHBondContact O-N 3.02Å; D277-H280 PolarHBondContact OD1-N 3.39Å; D277-H280 IonicContact OD1-ND1 2.75Å; D277-H280 IonicContact OD2-CE1 2.71Å; D277-H280 IonicContact OD2-CG 3.45Å; D277-H280 IonicContact OD2-ND1 3.58Å; D277-H280 PolarHBondContact OD2-ND1 3Å; H280-I282 VanDerWaalsContact C-N 3.27Å; H280-I282 HydrophobicContact CB-CB 4.24Å; H280-I282 HydrophobicContact CB-CD1 3.58Å; H280-I282 HydrophobicContact CB-CG1 3.69Å; H280-I282 PolarHBondContact O-N 2.97Å
281	N	70.4	Confident	65.3	Low	45 Å²	45	25.7 Å²	25.7	24%	0.241	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	41.8	-164.3	-70.5	-15.2	0	0	0	113.1	D277 A278 K305 L306	D277-N281 CarbonylContact O-C 3.59Å; D277-N281 WeakPolarHBondContact O-CA 3.41Å; D277-N281 PolarHBondContact O-N 2.87Å; A278-N281 PolarHBondContact O-OD1 3.37Å; N281-K305 CarbonylContact O-C 3.59Å; N281-K305 WeakPolarHBondContact O-CA 3.44Å; N281-L306 PolarHBondContact O-N 2.79Å
282	I	71.5	Confident	66.4	Low	28 Å²	28	31.1 Å²	31.1	14%	0.144	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	133.3	-177.1	-69	175.1	0	0	0	111.1	V276 D277 H280 I284 L304 K305	V276-I282 CarbonylContact C-O 3.57Å; V276-I282 WeakPolarHBondContact CA-O 3.42Å; D277-I282 HydrophobicContact CB-CB 4.44Å; D277-I282 PolarHBondContact N-O 3.02Å; D277-I282 PolarHBondContact O-N 3.1Å; H280-I282 VanDerWaalsContact C-N 3.27Å; H280-I282 HydrophobicContact CB-CB 4.24Å; H280-I282 HydrophobicContact CB-CD1 3.58Å; H280-I282 HydrophobicContact CB-CG1 3.69Å; H280-I282 PolarHBondContact O-N 2.97Å; I282-I284 PolarHBondContact O-N 3.09Å; I282-I284 VanDerWaalsContact O-N 3.16Å; I282-L304 WeakPolarHBondContact CA-O 3.36Å; I282-K305 HydrophobicContact CG1-CG 4.39Å
283	I	72.7	Confident	66.5	Low	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	112	174.5	-61.6	175.1	0	0	0	109.7	I274 V276 A286 T301 G303 L304 L309	I274-I283 HydrophobicContact CG2-CB 4.39Å; I274-I283 HydrophobicContact CG2-CD1 4.39Å; I274-I283 HydrophobicContact CG2-CG1 4.07Å; I274-I283 HydrophobicContact CG2-CG2 3.67Å; V276-I283 HydrophobicContact CG2-CG1 4.27Å; I283-A286 HydrophobicContact CG2-CB 4.25Å; I283-T301 HydrophobicContact CD1-CG2 4.22Å; I283-G303 PolarHBondContact O-N 3.07Å; I283-L304 HydrophobicContact CD1-CB 4.41Å; I283-L304 PolarHBondContact N-O 3.2Å; I283-L309 HydrophobicContact CD1-CB 3.93Å; I283-L309 HydrophobicContact CD1-CD1 3.45Å; I283-L309 VanDerWaalsContact CD1-CD1 3.45Å; I283-L309 HydrophobicContact CD1-CG 4.25Å
284	I	69.2	Low	66.9	Low	40 Å²	40	32.4 Å²	32.4	21%	0.205	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-45.3	173.6	-58.3	166.8	0	0	0	109.6	I275 D277 I282 I302 L574	I275-I284 HydrophobicContact CG2-CD1 4.33Å; I275-I284 PolarHBondContact O-N 2.69Å; D277-I284 HydrophobicContact CB-CD1 3.84Å; D277-I284 HydrophobicContact CB-CG1 3.91Å; I282-I284 PolarHBondContact O-N 3.09Å; I282-I284 VanDerWaalsContact O-N 3.16Å; I284-I302 WeakPolarHBondContact O-CG2 3.11Å; I284-L574 HydrophobicContact CD1-CD2 3.47Å; I284-L574 VanDerWaalsContact CD1-CD2 3.47Å
285	Y	67.2	Low	67	Low	29 Å²	29	35.3 Å²	35.3	11%	0.114	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	135.8	-176.9	177.9	-108	0	0	0	112.1	V176 I274 I275 P287	V176-Y285 HydrophobicContact CG1-CD1 3.64Å; V176-Y285 HydrophobicContact CG1-CD2 3.77Å; V176-Y285 HydrophobicContact CG1-CE1 3.92Å; V176-Y285 HydrophobicContact CG1-CE2 4.04Å; V176-Y285 HydrophobicContact CG1-CG 3.55Å; I274-Y285 WeakPolarHBondContact CG2-O 3.36Å; I275-Y285 HydrophobicContact CD1-CD1 4.15Å; I275-Y285 HydrophobicContact CG1-CD1 4.21Å; I275-Y285 PolarHBondContact N-O 2.65Å; I275-Y285 PolarHBondContact O-N 3.37Å; I275-Y285 VanDerWaalsContact O-N 3.14Å; Y285-P287 HydrophobicContact CE1-CB 4.49Å; Y285-P287 HydrophobicContact CE1-CG 3.89Å
286	A	68	Low	67.1	Low	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.212	C	C	.	.			trans	-129.6	130.8	170.3	0	0	0	0	0	108	I283 Y290 T291 W298 T301	I283-A286 HydrophobicContact CG2-CB 4.25Å; A286-Y290 HydrophobicContact CB-CD1 4.15Å; A286-T291 HydrophobicContact CB-CG2 3.67Å; A286-W298 PolarHBondContact O-NE1 3.16Å; A286-T301 HydrophobicContact CB-CG2 3.74Å
287	P	66.1	Low	67.2	Low	5 Å²	5	39.5 Å²	39.5	3%	0.032	24%	0.235	C	C	.	.			trans	-67.8	146.4	176.2	-21.9	31.8	0	0	0	111.5	L271 A273 Y285 A289 Y290 T291	L271-P287 HydrophobicContact CD2-CB 4.21Å; L271-P287 HydrophobicContact CD2-CG 3.5Å; L271-P287 WeakPolarHBondContact O-CB 3.47Å; L271-P287 WeakPolarHBondContact O-CG 3.33Å; A273-P287 WeakPolarHBondContact O-CD 3.46Å; A273-P287 WeakPolarHBondContact O-CG 3.49Å; Y285-P287 HydrophobicContact CE1-CB 4.49Å; Y285-P287 HydrophobicContact CE1-CG 3.89Å; P287-A289 VanDerWaalsContact C-N 3.26Å; P287-A289 PolarHBondContact O-N 3.34Å; P287-Y290 PolarHBondContact O-N 2.94Å; P287-T291 PolarHBondContact O-N 2.95Å; P287-T291 PolarHBondContact O-OG1 2.75Å
288	P	63.5	Low	66.9	Low	64 Å²	64	43.6 Å²	43.6	42%	0.416	25%	0.249	S	C	.	.	H	α-helix	trans	-50.6	-45	174.6	-29.9	36.7	0	0	0	113.1	Y290 T291 E292	P288-Y290 VanDerWaalsContact C-N 3.33Å; P288-Y290 PolarHBondContact O-N 3.3Å; P288-T291 WeakPolarHBondContact CA-OG1 3.06Å; P288-T291 PolarHBondContact O-N 3.43Å; P288-T291 PolarHBondContact O-OG1 2.89Å; P288-E292 WeakPolarHBondContact O-CG 3.32Å; P288-E292 PolarHBondContact O-N 3.21Å
289	A	57.4	Low	67.1	Low	23 Å²	23	47.5 Å²	47.5	19%	0.19	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-37.9	177.9	0	0	0	0	0	113.6	P287 L293	P287-A289 VanDerWaalsContact C-N 3.26Å; P287-A289 PolarHBondContact O-N 3.34Å; A289-L293 WeakPolarHBondContact O-CB 3.44Å; A289-L293 PolarHBondContact O-N 2.74Å
290	Y	65.4	Low	67.3	Low	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.7	-38	173.7	172	-112	0	0	0	111.7	V272 I274 A286 P287 P288 L293 I294 T301 L309 Q313 W463 L579	V272-Y290 HydrophobicContact CG1-CD2 3.88Å; V272-Y290 HydrophobicContact CG1-CG 4.34Å; I274-Y290 HydrophobicContact CD1-CD1 4.14Å; I274-Y290 HydrophobicContact CD1-CE1 3.38Å; I274-Y290 HydrophobicContact CD1-CE2 4.5Å; I274-Y290 HydrophobicContact CG1-CD1 3.85Å; I274-Y290 HydrophobicContact CG1-CE1 3.63Å; A286-Y290 HydrophobicContact CB-CD1 4.15Å; P287-Y290 PolarHBondContact O-N 2.94Å; P288-Y290 VanDerWaalsContact C-N 3.33Å; P288-Y290 PolarHBondContact O-N 3.3Å; Y290-L293 HydrophobicContact CD2-CD2 4.47Å; Y290-L293 WeakPolarHBondContact O-CB 3.4Å; Y290-L293 PolarHBondContact O-N 3.01Å; Y290-I294 HydrophobicContact CD1-CD1 4.37Å; Y290-I294 HydrophobicContact CD2-CG2 4.19Å; Y290-I294 HydrophobicContact CE1-CD1 3.67Å; Y290-I294 HydrophobicContact CE2-CD1 4.44Å; Y290-I294 HydrophobicContact CE2-CG2 3.44Å; Y290-I294 VanDerWaalsContact CE2-CG2 3.44Å; Y290-I294 PolarHBondContact O-N 2.7Å; Y290-T301 HydrophobicContact CE1-CG2 4.49Å; Y290-L309 HydrophobicContact CE1-CD1 4.09Å; Y290-L309 WeakPolarHBondContact OH-CD1 3.35Å; Y290-L309 WeakPolarHBondContact OH-CD2 3.3Å; Y290-Q313 PolarHBondContact OH-NE2 2.83Å; Y290-W463 AromaticContact CD2-CH2 3.84Å; Y290-W463 HydrophobicContact CD2-CH2 3.84Å; Y290-W463 HydrophobicContact CD2-CZ2 4.29Å; Y290-W463 HydrophobicContact CE1-CH2 4.33Å; Y290-W463 AromaticContact CE2-CH2 3.37Å; Y290-W463 HydrophobicContact CE2-CH2 3.37Å; Y290-W463 AromaticContact CE2-CZ2 3.41Å; Y290-W463 HydrophobicContact CE2-CZ2 3.41Å; Y290-W463 VanDerWaalsContact CE2-CZ2 3.41Å; Y290-W463 AromaticContact CZ-CH2 3.66Å; Y290-W463 AromaticContact CZ-CZ2 3.64Å; Y290-L579 HydrophobicContact CD2-CD1 4.15Å; Y290-L579 HydrophobicContact CE2-CD1 4.1Å
291	T	66	Low	67.3	Low	6 Å²	6	42 Å²	42	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-72	-34	179.1	59.8	0	0	0	0	112.5	A286 P287 P288 G295 L296 T301	A286-T291 HydrophobicContact CB-CG2 3.67Å; P287-T291 PolarHBondContact O-N 2.95Å; P287-T291 PolarHBondContact O-OG1 2.75Å; P288-T291 WeakPolarHBondContact CA-OG1 3.06Å; P288-T291 PolarHBondContact O-N 3.43Å; P288-T291 PolarHBondContact O-OG1 2.89Å; T291-G295 PolarHBondContact O-N 2.81Å; T291-L296 CarbonylContact C-O 3.56Å; T291-L296 WeakPolarHBondContact CB-O 3.33Å; T291-L296 PolarHBondContact O-N 3.26Å; T291-L296 VanDerWaalsContact O-N 3.12Å; T291-T301 HydrophobicContact CG2-CG2 3.97Å; T291-T301 WeakPolarHBondContact CG2-OG1 3.36Å
292	E	65.4	Low	67.4	Low	135 Å²	135	41.9 Å²	41.9	63%	0.631	24%	0.241	S	C	*	.	H	α-helix	trans	-60	-46.5	166.3	-73.2	173.1	-167.7	0	0	111.4	P288 I294 G295	P288-E292 WeakPolarHBondContact O-CG 3.32Å; P288-E292 PolarHBondContact O-N 3.21Å; E292-I294 VanDerWaalsContact C-N 3.34Å; E292-I294 PolarHBondContact O-N 2.71Å; E292-G295 PolarHBondContact O-N 2.71Å
293	L	60.9	Low	67.4	Low	58 Å²	58	41.2 Å²	41.2	30%	0.304	24%	0.241	S	C	.	.	H	α-helix	trans	-58.9	-39.2	-179.5	-176.6	69.4	0	0	0	113.3	V272 A289 Y290 L461 L579	V272-L293 HydrophobicContact CG1-CD2 4.31Å; A289-L293 WeakPolarHBondContact O-CB 3.44Å; A289-L293 PolarHBondContact O-N 2.74Å; Y290-L293 HydrophobicContact CD2-CD2 4.47Å; Y290-L293 WeakPolarHBondContact O-CB 3.4Å; Y290-L293 PolarHBondContact O-N 3.01Å; L293-L461 HydrophobicContact CD2-CD2 4.45Å; L293-L579 HydrophobicContact CD2-CD1 3.9Å
294	I	66	Low	67.6	Low	4 Å²	4	41.7 Å²	41.7	2%	0.021	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-1	-179.6	69.6	-174.6	0	0	0	114.1	Y290 E292 L296 T301 L309 Q313	Y290-I294 HydrophobicContact CD1-CD1 4.37Å; Y290-I294 HydrophobicContact CD2-CG2 4.19Å; Y290-I294 HydrophobicContact CE1-CD1 3.67Å; Y290-I294 HydrophobicContact CE2-CD1 4.44Å; Y290-I294 HydrophobicContact CE2-CG2 3.44Å; Y290-I294 VanDerWaalsContact CE2-CG2 3.44Å; Y290-I294 PolarHBondContact O-N 2.7Å; E292-I294 VanDerWaalsContact C-N 3.34Å; E292-I294 PolarHBondContact O-N 2.71Å; I294-L296 VanDerWaalsContact C-N 3.29Å; I294-L296 HydrophobicContact CD1-CB 4.01Å; I294-L296 HydrophobicContact CD1-CD1 3.82Å; I294-L296 HydrophobicContact CD1-CG 4.09Å; I294-L296 HydrophobicContact CG1-CB 3.9Å; I294-L296 HydrophobicContact CG1-CD1 4.3Å; I294-L296 HydrophobicContact CG1-CG 4.03Å; I294-L296 PolarHBondContact O-N 2.98Å; I294-T301 HydrophobicContact CD1-CG2 4.28Å; I294-L309 HydrophobicContact CD1-CD1 4.03Å; I294-Q313 HydrophobicContact CG2-CG 4.46Å
295	G	67.9	Low	68.1	Low	62 Å²	62	45.6 Å²	45.6	64%	0.639	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	20	-178.3	0	0	0	0	0	115.4	T291 E292	T291-G295 PolarHBondContact O-N 2.81Å; E292-G295 PolarHBondContact O-N 2.71Å
296	L	72.1	Confident	68.3	Low	28 Å²	28	44.5 Å²	44.5	15%	0.147	26%	0.255	C	S	.	.			trans	-102.1	147.8	174.8	-68.5	-178.3	0	0	0	110.8	T291 I294 R312 I316	T291-L296 CarbonylContact C-O 3.56Å; T291-L296 WeakPolarHBondContact CB-O 3.33Å; T291-L296 PolarHBondContact O-N 3.26Å; T291-L296 VanDerWaalsContact O-N 3.12Å; I294-L296 VanDerWaalsContact C-N 3.29Å; I294-L296 HydrophobicContact CD1-CB 4.01Å; I294-L296 HydrophobicContact CD1-CD1 3.82Å; I294-L296 HydrophobicContact CD1-CG 4.09Å; I294-L296 HydrophobicContact CG1-CB 3.9Å; I294-L296 HydrophobicContact CG1-CD1 4.3Å; I294-L296 HydrophobicContact CG1-CG 4.03Å; I294-L296 PolarHBondContact O-N 2.98Å; L296-R312 HydrophobicContact CD1-CB 4.44Å; L296-I316 HydrophobicContact CD2-CD1 3.66Å; L296-I316 HydrophobicContact CG-CD1 4.19Å
297	S	71.5	Confident	68.5	Low	70 Å²	70	48 Å²	48	49%	0.49	27%	0.274	S	S	.	.			trans	-69	137.5	170.1	172.4	0	0	0	0	110	V299 T300 T301	S297-V299 PolarHBondContact O-N 2.86Å; S297-V299 VanDerWaalsContact O-N 3.14Å; S297-T300 WeakPolarHBondContact CB-OG1 3.44Å; S297-T300 PolarHBondContact N-OG1 3.09Å; S297-T300 VanDerWaalsContact N-OG1 3.15Å; S297-T300 CarbonylContact O-C 3.56Å; S297-T300 WeakPolarHBondContact O-CA 3.33Å; S297-T300 WeakPolarHBondContact O-CB 3.47Å; S297-T300 PolarHBondContact O-N 3.21Å; S297-T300 PolarHBondContact O-OG1 2.94Å; S297-T301 PolarHBondContact O-N 3.14Å; S297-T301 VanDerWaalsContact O-N 3.15Å; S297-T301 PolarHBondContact O-OG1 2.87Å; S297-T301 VanDerWaalsContact O-OG1 3.08Å
298	W	62.6	Low	68.9	Low	114 Å²	114	51.5 Å²	51.5	43%	0.432	29%	0.29	S	S	.	.	H	α-helix	trans	-45.3	-45.8	174.7	-175	69.8	0	0	0	113.3	A286 T300 T301 I302	A286-W298 PolarHBondContact O-NE1 3.16Å; W298-T300 PolarHBondContact O-N 3.29Å; W298-T301 PolarHBondContact O-N 3.33Å; W298-T301 VanDerWaalsContact O-N 3.15Å; W298-I302 HydrophobicContact CD2-CD1 4.23Å; W298-I302 HydrophobicContact CH2-CD1 4.25Å; W298-I302 HydrophobicContact CZ2-CD1 3.59Å; W298-I302 PolarHBondContact O-N 3.25Å
299	V	68.5	Low	69.3	Low	112 Å²	112	48.5 Å²	48.5	68%	0.679	27%	0.271	S	S	*	.	H	α-helix	trans	-67.1	-23.5	178.5	-175.4	0	0	0	0	112.8	S297	S297-V299 PolarHBondContact O-N 2.86Å; S297-V299 VanDerWaalsContact O-N 3.14Å
300	T	72	Confident	69.7	Low	60 Å²	60	49.1 Å²	49.1	37%	0.368	27%	0.272	S	S	.	.	H	α-helix	trans	-92.2	-6.3	175.9	62.7	0	0	0	0	114	S297 W298 L304 R312	S297-T300 WeakPolarHBondContact CB-OG1 3.44Å; S297-T300 PolarHBondContact N-OG1 3.09Å; S297-T300 VanDerWaalsContact N-OG1 3.15Å; S297-T300 CarbonylContact O-C 3.56Å; S297-T300 WeakPolarHBondContact O-CA 3.33Å; S297-T300 WeakPolarHBondContact O-CB 3.47Å; S297-T300 PolarHBondContact O-N 3.21Å; S297-T300 PolarHBondContact O-OG1 2.94Å; W298-T300 PolarHBondContact O-N 3.29Å; T300-L304 VanDerWaalsContact O-CD1 3.26Å; T300-L304 WeakPolarHBondContact O-CD1 3.38Å; T300-L304 WeakPolarHBondContact O-CD2 3.21Å; T300-L304 WeakPolarHBondContact O-CG 3.49Å; T300-R312 PolarHBondContact O-NH1 3.25Å
301	T	69.1	Low	69.8	Low	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-98.1	-41.3	-179.5	-48.7	0	0	0	0	111.6	I283 A286 Y290 T291 I294 S297 W298 L304 L309	I283-T301 HydrophobicContact CD1-CG2 4.22Å; A286-T301 HydrophobicContact CB-CG2 3.74Å; Y290-T301 HydrophobicContact CE1-CG2 4.49Å; T291-T301 HydrophobicContact CG2-CG2 3.97Å; T291-T301 WeakPolarHBondContact CG2-OG1 3.36Å; I294-T301 HydrophobicContact CD1-CG2 4.28Å; S297-T301 PolarHBondContact O-N 3.14Å; S297-T301 VanDerWaalsContact O-N 3.15Å; S297-T301 PolarHBondContact O-OG1 2.87Å; S297-T301 VanDerWaalsContact O-OG1 3.08Å; W298-T301 PolarHBondContact O-N 3.33Å; W298-T301 VanDerWaalsContact O-N 3.15Å; T301-L304 WeakPolarHBondContact O-CG 3.46Å; T301-L304 PolarHBondContact O-N 3.07Å; T301-L309 HydrophobicContact CG2-CD1 3.71Å
302	I	71.9	Confident	69.9	Low	41 Å²	41	55.8 Å²	55.8	21%	0.21	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	134.9	173.1	-65.3	173.1	0	0	0	109.7	I284 W298 L304	I284-I302 WeakPolarHBondContact O-CG2 3.11Å; W298-I302 HydrophobicContact CD2-CD1 4.23Å; W298-I302 HydrophobicContact CH2-CD1 4.25Å; W298-I302 HydrophobicContact CZ2-CD1 3.59Å; W298-I302 PolarHBondContact O-N 3.25Å; I302-L304 VanDerWaalsContact C-N 3.34Å
303	G	71.7	Confident	69.7	Low	15 Å²	15	50.2 Å²	50.2	16%	0.155	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	11.4	-179.5	0	0	0	0	0	115.5	R86 I283	R86-G303 PolarHBondContact NE-O 2.88Å; I283-G303 PolarHBondContact O-N 3.07Å
304	L	76.5	Confident	69.3	Low	9 Å²	9	52.7 Å²	52.7	5%	0.047	30%	0.298	C	S	.	.			trans	-79.6	157.4	160.9	-61.8	-173.6	0	0	0	110.8	I282 I283 T300 T301 I302 L309	I282-L304 WeakPolarHBondContact CA-O 3.36Å; I283-L304 HydrophobicContact CD1-CB 4.41Å; I283-L304 PolarHBondContact N-O 3.2Å; T300-L304 VanDerWaalsContact O-CD1 3.26Å; T300-L304 WeakPolarHBondContact O-CD1 3.38Å; T300-L304 WeakPolarHBondContact O-CD2 3.21Å; T300-L304 WeakPolarHBondContact O-CG 3.49Å; T301-L304 WeakPolarHBondContact O-CG 3.46Å; T301-L304 PolarHBondContact O-N 3.07Å; I302-L304 VanDerWaalsContact C-N 3.34Å; L304-L309 HydrophobicContact CD1-CB 4.28Å
305	K	80.8	Confident	68.6	Low	122 Å²	122	57.4 Å²	57.4	53%	0.53	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-76.3	147	159.5	-72.7	-168	172.3	-166.8	0	110.4	N281 I282 N307 E308 L309	N281-K305 CarbonylContact O-C 3.59Å; N281-K305 WeakPolarHBondContact O-CA 3.44Å; I282-K305 HydrophobicContact CG1-CG 4.39Å; K305-N307 VanDerWaalsContact C-N 3.31Å; K305-N307 PolarHBondContact O-N 3.11Å; K305-E308 HydrophobicContact CB-CB 4.32Å; K305-E308 WeakPolarHBondContact O-CA 3.38Å; K305-E308 VanDerWaalsContact O-CB 3.31Å; K305-E308 WeakPolarHBondContact O-CB 3.3Å; K305-E308 PolarHBondContact O-N 2.96Å; K305-L309 PolarHBondContact O-N 2.85Å; K305-L309 VanDerWaalsContact O-N 3.09Å
306	L	71.3	Confident	67.8	Low	7 Å²	7	58.5 Å²	58.5	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-53.5	-47.8	177.6	-176.8	66.4	0	0	0	111.8	V276 N281 E308 L309 V310 Y577	V276-L306 HydrophobicContact CG2-CD1 4.44Å; N281-L306 PolarHBondContact O-N 2.79Å; L306-E308 PolarHBondContact O-N 2.82Å; L306-L309 WeakPolarHBondContact O-CB 3.37Å; L306-L309 PolarHBondContact O-N 2.83Å; L306-V310 WeakPolarHBondContact O-CG2 3.11Å; L306-V310 PolarHBondContact O-N 2.76Å; L306-Y577 HydrophobicContact CD1-CE2 4.4Å; L306-Y577 HydrophobicContact CD2-CE1 4.32Å; L306-Y577 HydrophobicContact CD2-CE2 3.75Å; L306-Y577 VanDerWaalsContact CD2-CZ 3.5Å; L306-Y577 WeakPolarHBondContact CD2-OH 3.35Å
307	N	71.4	Confident	66	Low	74 Å²	74	59.4 Å²	59.4	40%	0.396	34%	0.338	S	S	.	.	H	α-helix	trans	-57.3	-35.8	176.6	-55.3	38.1	0	0	0	112.3	K305 V310 S311	K305-N307 VanDerWaalsContact C-N 3.31Å; K305-N307 PolarHBondContact O-N 3.11Å; N307-V310 PolarHBondContact O-N 2.82Å; N307-S311 PolarHBondContact O-N 3.36Å; N307-S311 PolarHBondContact O-OG 3.19Å; N307-S311 VanDerWaalsContact O-OG 3.1Å
308	E	75.1	Confident	64.4	Low	77 Å²	77	57.6 Å²	57.6	36%	0.36	32%	0.324	S	S	.	.	H	α-helix	trans	-70.9	-35.7	178.3	-165.1	-169.2	158.6	0	0	111.4	K305 L306 R312	K305-E308 HydrophobicContact CB-CB 4.32Å; K305-E308 WeakPolarHBondContact O-CA 3.38Å; K305-E308 VanDerWaalsContact O-CB 3.31Å; K305-E308 WeakPolarHBondContact O-CB 3.3Å; K305-E308 PolarHBondContact O-N 2.96Å; L306-E308 PolarHBondContact O-N 2.82Å; E308-R312 WeakPolarHBondContact O-CB 3.44Å; E308-R312 VanDerWaalsContact O-CG 3.23Å; E308-R312 WeakPolarHBondContact O-CG 3.29Å; E308-R312 PolarHBondContact O-N 3.46Å; E308-R312 IonicContact OE1-CZ 2.74Å; E308-R312 IonicContact OE1-NE 3.78Å; E308-R312 PolarHBondContact OE1-NE 3.25Å; E308-R312 IonicContact OE1-NH2 2.65Å; E308-R312 PolarHBondContact OE1-NH2 2.96Å
309	L	72.7	Confident	62.8	Low	2 Å²	2	55.9 Å²	55.9	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-44.7	170.1	174.8	141.9	0	0	0	111.3	I283 Y290 I294 T301 L304 K305 L306 S311 R312 Q313	I283-L309 HydrophobicContact CD1-CB 3.93Å; I283-L309 HydrophobicContact CD1-CD1 3.45Å; I283-L309 VanDerWaalsContact CD1-CD1 3.45Å; I283-L309 HydrophobicContact CD1-CG 4.25Å; Y290-L309 HydrophobicContact CE1-CD1 4.09Å; Y290-L309 WeakPolarHBondContact OH-CD1 3.35Å; Y290-L309 WeakPolarHBondContact OH-CD2 3.3Å; I294-L309 HydrophobicContact CD1-CD1 4.03Å; T301-L309 HydrophobicContact CG2-CD1 3.71Å; L304-L309 HydrophobicContact CD1-CB 4.28Å; K305-L309 PolarHBondContact O-N 2.85Å; K305-L309 VanDerWaalsContact O-N 3.09Å; L306-L309 WeakPolarHBondContact O-CB 3.37Å; L306-L309 PolarHBondContact O-N 2.83Å; L309-S311 PolarHBondContact O-N 3.44Å; L309-R312 CarbonylContact O-C 3.53Å; L309-R312 WeakPolarHBondContact O-CB 3.37Å; L309-R312 PolarHBondContact O-N 2.96Å; L309-R312 VanDerWaalsContact O-N 3.12Å; L309-Q313 HydrophobicContact CD2-CG 4.22Å; L309-Q313 WeakPolarHBondContact O-CG 3.43Å; L309-Q313 PolarHBondContact O-N 3.44Å
310	V	65.5	Low	61.1	Low	36 Å²	36	54.2 Å²	54.2	22%	0.218	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-45.9	178	176.8	0	0	0	0	110.6	L306 N307 R312 Q313 V314 L408	L306-V310 WeakPolarHBondContact O-CG2 3.11Å; L306-V310 PolarHBondContact O-N 2.76Å; N307-V310 PolarHBondContact O-N 2.82Å; V310-R312 VanDerWaalsContact C-N 3.29Å; V310-R312 PolarHBondContact O-N 3.2Å; V310-Q313 PolarHBondContact O-N 3.41Å; V310-V314 WeakPolarHBondContact O-CG2 3.3Å; V310-V314 PolarHBondContact O-N 2.8Å; V310-V314 VanDerWaalsContact O-N 3.08Å; V310-L408 HydrophobicContact CG2-CD1 4.02Å; V310-L408 HydrophobicContact CG2-CD2 4.47Å
311	S	66.9	Low	59	Low	72 Å²	72	59.1 Å²	59.1	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-56.8	-42.1	172.7	-62.9	0	0	0	0	112.1	N307 L309 V314 S315	N307-S311 PolarHBondContact O-N 3.36Å; N307-S311 PolarHBondContact O-OG 3.19Å; N307-S311 VanDerWaalsContact O-OG 3.1Å; L309-S311 PolarHBondContact O-N 3.44Å; S311-V314 PolarHBondContact O-N 2.92Å; S311-S315 WeakPolarHBondContact O-CB 3.5Å; S311-S315 PolarHBondContact O-N 2.97Å; S311-S315 PolarHBondContact O-OG 3.19Å
312	R	67.1	Low	57.1	Low	74 Å²	74	62.5 Å²	62.5	28%	0.279	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-40.5	176.6	-73.5	170.5	-174.2	-153.9	1.9	112.9	L296 T300 E308 L309 V310 V314 S315 I316	L296-R312 HydrophobicContact CD1-CB 4.44Å; T300-R312 PolarHBondContact O-NH1 3.25Å; E308-R312 WeakPolarHBondContact O-CB 3.44Å; E308-R312 VanDerWaalsContact O-CG 3.23Å; E308-R312 WeakPolarHBondContact O-CG 3.29Å; E308-R312 PolarHBondContact O-N 3.46Å; E308-R312 IonicContact OE1-CZ 2.74Å; E308-R312 IonicContact OE1-NE 3.78Å; E308-R312 PolarHBondContact OE1-NE 3.25Å; E308-R312 IonicContact OE1-NH2 2.65Å; E308-R312 PolarHBondContact OE1-NH2 2.96Å; L309-R312 CarbonylContact O-C 3.53Å; L309-R312 WeakPolarHBondContact O-CB 3.37Å; L309-R312 PolarHBondContact O-N 2.96Å; L309-R312 VanDerWaalsContact O-N 3.12Å; V310-R312 VanDerWaalsContact C-N 3.29Å; V310-R312 PolarHBondContact O-N 3.2Å; R312-V314 VanDerWaalsContact C-N 3.31Å; R312-V314 PolarHBondContact O-N 2.85Å; R312-S315 PolarHBondContact O-N 2.9Å; R312-I316 HydrophobicContact CB-CD1 4.32Å; R312-I316 VanDerWaalsContact O-CB 3.3Å; R312-I316 WeakPolarHBondContact O-CB 3.17Å; R312-I316 WeakPolarHBondContact O-CD1 3.48Å; R312-I316 WeakPolarHBondContact O-CG1 3.45Å; R312-I316 PolarHBondContact O-N 2.99Å
313	Q	61.2	Low	55	Low	18 Å²	18	71 Å²	71	8%	0.084	39%	0.389	C	S	.	.	H	α-helix	trans	-59.9	-42.9	175.3	-72.5	-179.7	-55.3	0	0	111.2	Y290 I294 L309 V310 G317 V318	Y290-Q313 PolarHBondContact OH-NE2 2.83Å; I294-Q313 HydrophobicContact CG2-CG 4.46Å; L309-Q313 HydrophobicContact CD2-CG 4.22Å; L309-Q313 WeakPolarHBondContact O-CG 3.43Å; L309-Q313 PolarHBondContact O-N 3.44Å; V310-Q313 PolarHBondContact O-N 3.41Å; Q313-G317 PolarHBondContact O-N 2.94Å; Q313-V318 HydrophobicContact CB-CB 4.39Å; Q313-V318 WeakPolarHBondContact O-CB 3.38Å; Q313-V318 PolarHBondContact O-N 3.14Å
314	V	53.2	Low	52.9	Low	109 Å²	109	74.8 Å²	74.8	66%	0.661	41%	0.413	S	S	*	.	H	α-helix	trans	-64	-46.1	173	176.5	0	0	0	0	111.1	V310 S311 R312 I316 G317	V310-V314 WeakPolarHBondContact O-CG2 3.3Å; V310-V314 PolarHBondContact O-N 2.8Å; V310-V314 VanDerWaalsContact O-N 3.08Å; S311-V314 PolarHBondContact O-N 2.92Å; R312-V314 VanDerWaalsContact C-N 3.31Å; R312-V314 PolarHBondContact O-N 2.85Å; V314-I316 VanDerWaalsContact C-N 3.32Å; V314-I316 PolarHBondContact O-N 2.99Å; V314-G317 PolarHBondContact O-N 3.45Å
315	S	52.5	Low	50.6	Low	103 Å²	103	81 Å²	81	72%	0.72	44%	0.441	S	S	*	.	H	α-helix	trans	-66.4	-26.7	179.7	-59.4	0	0	0	0	114.9	S311 R312 G317	S311-S315 WeakPolarHBondContact O-CB 3.5Å; S311-S315 PolarHBondContact O-N 2.97Å; S311-S315 PolarHBondContact O-OG 3.19Å; R312-S315 PolarHBondContact O-N 2.9Å; S315-G317 VanDerWaalsContact C-N 3.32Å
316	I	50.6	Low	48.1	Very low	85 Å²	85	81 Å²	81	44%	0.436	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-6.5	-179.4	-68.9	165.5	0	0	0	111.4	L296 R312 V314 V318	L296-I316 HydrophobicContact CD2-CD1 3.66Å; L296-I316 HydrophobicContact CG-CD1 4.19Å; R312-I316 HydrophobicContact CB-CD1 4.32Å; R312-I316 VanDerWaalsContact O-CB 3.3Å; R312-I316 WeakPolarHBondContact O-CB 3.17Å; R312-I316 WeakPolarHBondContact O-CD1 3.48Å; R312-I316 WeakPolarHBondContact O-CG1 3.45Å; R312-I316 PolarHBondContact O-N 2.99Å; V314-I316 VanDerWaalsContact C-N 3.32Å; V314-I316 PolarHBondContact O-N 2.99Å; I316-V318 HydrophobicContact CB-CG2 3.94Å; I316-V318 HydrophobicContact CG2-CG2 3.67Å
317	G	33.2	Very low	46.1	Very low	47 Å²	47	84 Å²	84	49%	0.485	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	26.1	-176.7	0	0	0	0	0	113.3	Q313 V314 S315 S319	Q313-G317 PolarHBondContact O-N 2.94Å; V314-G317 PolarHBondContact O-N 3.45Å; S315-G317 VanDerWaalsContact C-N 3.32Å; G317-S319 PolarHBondContact O-N 2.88Å
318	V	37.9	Very low	44.2	Very low	33 Å²	33	84 Å²	84	20%	0.2	47%	0.473	C	S	.	.			trans	-80.9	43.1	177.6	-159.1	0	0	0	0	110.7	Q313 I316 L461	Q313-V318 HydrophobicContact CB-CB 4.39Å; Q313-V318 WeakPolarHBondContact O-CB 3.38Å; Q313-V318 PolarHBondContact O-N 3.14Å; I316-V318 HydrophobicContact CB-CG2 3.94Å; I316-V318 HydrophobicContact CG2-CG2 3.67Å; V318-L461 HydrophobicContact CG1-CD1 4.27Å
319	S	30.5	Very low	41.9	Very low	77 Å²	77	85.7 Å²	85.7	54%	0.538	48%	0.481	S	S	.	.	S	Bend	trans	-124.5	116.5	-178	-179.4	0	0	0	0	109.5	G317 E321	G317-S319 PolarHBondContact O-N 2.88Å; S319-E321 PolarHBondContact O-N 3.06Å
320	S	32.1	Very low	39.9	Very low	77 Å²	77	93.2 Å²	93.2	54%	0.538	51%	0.51	S	S	.	.	S	Bend	trans	57.1	-22.8	173.9	40.8	0	0	0	0	118.7
321	E	27.4	Very low	38.1	Very low	164 Å²	164	96.8 Å²	96.8	77%	0.766	53%	0.527	S	S	*	.			trans	-115.5	69	-175.2	-62.8	-172.2	160.2	0	0	111.2	S319 R323	S319-E321 PolarHBondContact O-N 3.06Å; E321-R323 PolarHBondContact O-N 3.42Å
322	L	30	Very low	36.3	Very low	71 Å²	71	102.4 Å²	102.4	37%	0.372	54%	0.537	S	S	.	.			trans	-73.4	68.9	-179.7	-109	173.1	0	0	0	112.5	S324 L461	L322-S324 PolarHBondContact O-N 3.28Å; L322-L461 HydrophobicContact CD1-CD2 4.36Å
323	R	27.9	Very low	34.5	Very low	220 Å²	220	103 Å²	103	83%	0.83	55%	0.546	S	S	*	.			trans	25.7	77.3	170.8	-76.2	-176	171.5	170.8	-1.7	114.4	E321 H325	E321-R323 PolarHBondContact O-N 3.42Å; R323-H325 VanDerWaalsContact C-N 3.32Å; R323-H325 PolarHBondContact O-N 2.82Å
324	S	26.9	Very low	33.2	Very low	94 Å²	94	107.2 Å²	107.2	66%	0.657	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	91.2	165.6	37.9	0	0	0	0	110.7	L322	L322-S324 PolarHBondContact O-N 3.28Å
325	H	27.5	Very low	32.2	Very low	140 Å²	140	109.5 Å²	109.5	65%	0.648	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.2	-23.4	146.6	-99.4	-62	0	0	0	113.6	R323	R323-H325 VanDerWaalsContact C-N 3.32Å; R323-H325 PolarHBondContact O-N 2.82Å
326	N	30	Very low	31	Very low	121 Å²	121	111.3 Å²	111.3	65%	0.647	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-32	-171.3	-85.8	-48.8	0	0	0	116.6	Y330	N326-Y330 PolarHBondContact O-N 3.32Å
327	C	29.3	Very low	29.9	Very low	69 Å²	69	110.4 Å²	110.4	47%	0.466	58%	0.575	S	S	.	*	H	α-helix	trans	-74.2	-51.1	-170.2	-147.7	0	0	0	0	113.2	H329 Y330 L331	C327-H329 VanDerWaalsContact C-N 3.28Å; C327-H329 PolarHBondContact O-N 2.88Å; C327-Y330 PolarHBondContact O-N 3.46Å; C327-Y330 VanDerWaalsContact O-N 3.09Å; C327-L331 PolarHBondContact O-N 2.9Å
328	C	29.8	Very low	29.6	Very low	75 Å²	75	116.8 Å²	116.8	51%	0.507	59%	0.59	S	S	.	*	H	α-helix	trans	-64.9	-30.4	-179.4	-56.4	0	0	0	0	113	R332	C328-R332 PolarHBondContact O-N 2.87Å
329	H	28.6	Very low	29.2	Very low	113 Å²	113	125.8 Å²	125.8	52%	0.523	62%	0.621	S	S	.	*	H	α-helix	trans	-70.5	-37.5	171.7	-96.4	-59.5	0	0	0	112.7	C327 L331 R332 N333	C327-H329 VanDerWaalsContact C-N 3.28Å; C327-H329 PolarHBondContact O-N 2.88Å; H329-L331 VanDerWaalsContact C-N 3.3Å; H329-L331 PolarHBondContact O-N 3.48Å; H329-R332 PolarHBondContact O-N 2.75Å; H329-N333 PolarHBondContact ND1-OD1 2.9Å; H329-N333 WeakPolarHBondContact O-CB 3.49Å; H329-N333 PolarHBondContact O-N 2.88Å; H329-N333 PolarHBondContact O-OD1 3.2Å; H329-N333 VanDerWaalsContact O-OD1 3.14Å
330	Y	29.3	Very low	29	Very low	160 Å²	160	128.2 Å²	128.2	63%	0.627	64%	0.638	S	S	*	*	H	α-helix	trans	-68.2	-28.1	-179.4	-118.1	-87.2	0	0	0	113.6	N326 C327 L334	N326-Y330 PolarHBondContact O-N 3.32Å; C327-Y330 PolarHBondContact O-N 3.46Å; C327-Y330 VanDerWaalsContact O-N 3.09Å; Y330-L334 HydrophobicContact CD1-CD1 4.05Å; Y330-L334 HydrophobicContact CD1-CG 4.38Å; Y330-L334 WeakPolarHBondContact O-CB 3.15Å; Y330-L334 WeakPolarHBondContact O-CD1 3.46Å; Y330-L334 WeakPolarHBondContact O-CG 3.5Å; Y330-L334 PolarHBondContact O-N 3.49Å
331	L	29.1	Very low	28.9	Very low	110 Å²	110	129.7 Å²	129.7	58%	0.576	65%	0.649	S	S	*	*	H	α-helix	trans	-82.5	-39	175.6	-71	170.1	0	0	0	112.8	C327 H329	C327-L331 PolarHBondContact O-N 2.9Å; H329-L331 VanDerWaalsContact C-N 3.3Å; H329-L331 PolarHBondContact O-N 3.48Å
332	R	28.5	Very low	28.9	Very low	191 Å²	191	128.4 Å²	128.4	72%	0.721	65%	0.652	S	S	*	*	H	α-helix	trans	-68.3	-46.7	172.3	-94.6	178.4	168.7	138.4	-1.6	112.6	C328 H329 L334 Q335 Y336	C328-R332 PolarHBondContact O-N 2.87Å; H329-R332 PolarHBondContact O-N 2.75Å; R332-L334 PolarHBondContact O-N 3.2Å; R332-Q335 PolarHBondContact O-N 3.17Å; R332-Q335 VanDerWaalsContact O-N 3.08Å; R332-Y336 PolarHBondContact O-N 3.47Å; R332-Y336 VanDerWaalsContact O-N 3.09Å
333	N	29.3	Very low	28.7	Very low	85 Å²	85	133.3 Å²	133.3	46%	0.455	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-4.2	-175.7	-57.2	17.4	0	0	0	113.4	H329 Y336 G337	H329-N333 PolarHBondContact ND1-OD1 2.9Å; H329-N333 WeakPolarHBondContact O-CB 3.49Å; H329-N333 PolarHBondContact O-N 2.88Å; H329-N333 PolarHBondContact O-OD1 3.2Å; H329-N333 VanDerWaalsContact O-OD1 3.14Å; N333-Y336 CarbonylContact C-O 3.48Å; N333-Y336 WeakPolarHBondContact CA-O 3.41Å; N333-Y336 CarbonylContact O-C 3.44Å; N333-Y336 VanDerWaalsContact O-O 3.09Å; N333-G337 WeakPolarHBondContact O-CA 3.35Å
334	L	32.7	Very low	28.6	Very low	107 Å²	107	130.3 Å²	130.3	56%	0.56	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-9.4	167.6	-80.3	176.6	0	0	0	113.6	Y330 R332	Y330-L334 HydrophobicContact CD1-CD1 4.05Å; Y330-L334 HydrophobicContact CD1-CG 4.38Å; Y330-L334 WeakPolarHBondContact O-CB 3.15Å; Y330-L334 WeakPolarHBondContact O-CD1 3.46Å; Y330-L334 WeakPolarHBondContact O-CG 3.5Å; Y330-L334 PolarHBondContact O-N 3.49Å; R332-L334 PolarHBondContact O-N 3.2Å
335	Q	32.8	Very low	28.6	Very low	157 Å²	157	134.6 Å²	134.6	73%	0.734	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-30.6	164.6	-66.8	-174.3	-81.9	0	0	111.9	R332	R332-Q335 PolarHBondContact O-N 3.17Å; R332-Q335 VanDerWaalsContact O-N 3.08Å
336	Y	27.2	Very low	28.5	Very low	142 Å²	142	135.7 Å²	135.7	56%	0.557	69%	0.694	S	S	*	*	S	Bend	trans	-116.9	90.7	171.1	-74.3	-97.8	0	0	0	110.1	R332 N333 E840	R332-Y336 PolarHBondContact O-N 3.47Å; R332-Y336 VanDerWaalsContact O-N 3.09Å; N333-Y336 CarbonylContact C-O 3.48Å; N333-Y336 WeakPolarHBondContact CA-O 3.41Å; N333-Y336 CarbonylContact O-C 3.44Å; N333-Y336 VanDerWaalsContact O-O 3.09Å; Y336-E840 WeakPolarHBondContact CE1-OE1 3.49Å
337	G	26.8	Very low	28.4	Very low	65 Å²	65	135.8 Å²	135.8	67%	0.67	70%	0.699	S	S	*	*			trans	-135.2	27.5	-162.2	0	0	0	0	0	116.5	N333	N333-G337 WeakPolarHBondContact O-CA 3.35Å
338	K	28.5	Very low	28.3	Very low	181 Å²	181	141.2 Å²	141.2	79%	0.787	72%	0.724	S	S	*	*	S	Bend	trans	-134.8	148.2	165.1	-76.3	-174.1	175.8	179.8	0	109.4
339	Y	28.2	Very low	28	Very low	222 Å²	222	142 Å²	142	87%	0.871	73%	0.73	S	S	*	*	S	Bend	trans	65.7	78.5	175.6	-57	-76.7	0	0	0	118
340	S	27.4	Very low	28.1	Very low	128 Å²	128	145.5 Å²	145.5	90%	0.895	74%	0.744	S	S	*	*			trans	-173.6	66.5	132.9	52.6	0	0	0	0	111.8
341	S	29.8	Very low	28.1	Very low	108 Å²	108	146 Å²	146	76%	0.755	75%	0.752	S	S	*	*			trans	-101.8	125.3	174.5	57.7	0	0	0	0	111.5
342	V	27.2	Very low	28.1	Very low	137 Å²	137	150.9 Å²	150.9	83%	0.83	77%	0.768	S	S	*	*			trans	67.1	102.8	169.6	-164.9	0	0	0	0	115.6
343	E	25.5	Very low	28	Very low	174 Å²	174	146.5 Å²	146.5	81%	0.813	77%	0.767	S	S	*	*				-175.6	158.2	121.6	-101.1	174.6	-164.8	0	0	109.9
344	N	26.5	Very low	28	Very low	158 Å²	158	149.8 Å²	149.8	85%	0.845	78%	0.783	S	S	*	*	S	Bend	trans	83.3	57.5	-176.8	-54.3	-56	0	0	0	118.9
345	M	25.5	Very low	27.8	Very low	184 Å²	184	152.2 Å²	152.2	91%	0.906	79%	0.792	S	S	*	*	S	Bend		-156.7	149.5	122.7	-104.3	-175.2	-172.6	0	0	109.3
346	I	26.2	Very low	27.6	Very low	162 Å²	162	150.1 Å²	150.1	83%	0.831	79%	0.79	S	S	*	*	S	Bend	trans	65.2	87.9	-175	-44.2	170.5	0	0	0	114.4
347	T	28	Very low	27.7	Very low	123 Å²	123	151.4 Å²	151.4	76%	0.755	80%	0.801	S	S	*	*			trans	177.2	70	131.5	38.3	0	0	0	0	109.9	S349	T347-S349 VanDerWaalsContact C-N 3.26Å; T347-S349 PolarHBondContact O-N 3.15Å
348	N	26.7	Very low	27.9	Very low	183 Å²	183	155.5 Å²	155.5	98%	0.979	81%	0.807	S	S	*	*			trans	-89.2	68.2	170.5	-148.3	14.7	0	0	0	109.4
349	S	25.1	Very low	28	Very low	93 Å²	93	150.1 Å²	150.1	65%	0.65	80%	0.802	S	S	*	*			trans	-139.1	57.6	-169.2	49.6	0	0	0	0	112.6	T347	T347-S349 VanDerWaalsContact C-N 3.26Å; T347-S349 PolarHBondContact O-N 3.15Å
350	K	30.7	Very low	28.2	Very low	185 Å²	185	145.8 Å²	145.8	80%	0.804	79%	0.794	S	S	*	*			trans	-126.7	113.9	166	-81	-171.7	177.3	176.9	0	113.1
351	Q	28	Very low	28.3	Very low	171 Å²	171	146.8 Å²	146.8	80%	0.799	79%	0.787	S	S	*	*			trans	59.3	91.5	136	-59.4	169.7	-53.7	0	0	117.7
352	K	29.7	Very low	28.3	Very low	212 Å²	212	149.5 Å²	149.5	92%	0.922	79%	0.787	S	S	*	*				-149.2	150.5	113.5	-112.2	164.9	-173	177	0	112.7
353	S	25.7	Very low	28.3	Very low	99 Å²	99	153.6 Å²	153.6	69%	0.692	79%	0.789	S	S	*	*			trans	-67.5	166.8	-173.8	48	0	0	0	0	114.8
354	I	28.8	Very low	28.6	Very low	155 Å²	155	152.4 Å²	152.4	80%	0.795	79%	0.794	S	S	*	*			trans	109	116.1	173.1	-61.7	157.3	0	0	0	110.2
355	Q	29	Very low	28.4	Very low	157 Å²	157	152.3 Å²	152.3	73%	0.734	79%	0.788	S	S	*	*			cis	150.2	132.5	-10.4	165.6	177.4	13.4	0	0	104.8
356	T	29.2	Very low	28.6	Very low	113 Å²	113	152.8 Å²	152.8	69%	0.693	78%	0.781	S	S	*	*			trans	62.2	146.5	172.7	45.8	0	0	0	0	116.8
357	E	29.9	Very low	28.8	Very low	169 Å²	169	151.7 Å²	151.7	79%	0.79	78%	0.777	S	S	*	*			cis	-152	-169.1	7.1	-126.4	159.6	-153.9	0	0	112.9
358	L	29.5	Very low	29	Very low	152 Å²	152	151.2 Å²	151.2	80%	0.796	78%	0.776	S	S	*	*			trans	-48.5	166.6	-174.6	-73.4	68.2	0	0	0	115.6
359	G	31.5	Very low	29.1	Very low	67 Å²	67	148.8 Å²	148.8	69%	0.691	77%	0.768	S	S	*	*			cis	164.7	179.8	10.7	0	0	0	0	0	107.3
360	D	33	Very low	29.1	Very low	131 Å²	131	148.7 Å²	148.7	70%	0.701	77%	0.772	S	S	*	*			cis	-166.2	146.5	-1.5	-95.7	-26.1	0	0	0	109.3
361	M	28.4	Very low	29	Very low	150 Å²	150	147 Å²	147	74%	0.739	77%	0.77	S	S	*	*			trans	58.9	155	149.1	-53.1	-66.2	-106.2	0	0	120
362	E	30.9	Very low	28.9	Very low	164 Å²	164	143 Å²	143	77%	0.766	76%	0.762	S	S	*	*			cis	-156.2	175.6	-9.3	-128.6	171.8	164.3	0	0	112.4
363	Y	25.7	Very low	28.9	Very low	224 Å²	224	139.4 Å²	139.4	88%	0.878	75%	0.752	S	S	*	*			trans	-89.9	146.6	176.4	-89	-115.6	0	0	0	113.5
364	V	31.8	Very low	29.2	Very low	149 Å²	149	142.1 Å²	142.1	90%	0.903	75%	0.754	S	S	*	*			trans	-145.2	151.7	148.3	-173.3	0	0	0	0	110.2
365	E	24.2	Very low	29.3	Very low	156 Å²	156	140 Å²	140	73%	0.729	75%	0.748	S	S	*	*			trans	-122.7	-177.5	-174.8	-169.5	171.2	-143.9	0	0	111.1
366	Y	29.4	Very low	29.4	Very low	193 Å²	193	138.9 Å²	138.9	76%	0.757	75%	0.746	S	S	*	*			trans	72.8	153.9	179.6	-60.7	-98.5	0	0	0	115.7
367	D	29.2	Very low	29.3	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	75%	0.752	S	S	*	*			cis	-153.5	160.9	-7.9	-133.5	-3.5	0	0	0	110.3
368	P	32.1	Very low	29	Very low	113 Å²	113	139.6 Å²	139.6	73%	0.734	75%	0.751	S	S	*	*			trans	-112.8	97.6	-173.7	37.7	-28.2	0	0	0	116.3
369	V	28.5	Very low	28.8	Very low	133 Å²	133	136.6 Å²	136.6	81%	0.806	75%	0.748	S	S	*	*			trans	-142.9	111.6	172.5	176.6	0	0	0	0	115.4
370	A	25.6	Very low	28.6	Very low	90 Å²	90	142.1 Å²	142.1	74%	0.744	76%	0.756	S	S	*	*			trans	54	-172.7	141.8	0	0	0	0	0	122.4
371	I	29.7	Very low	28.3	Very low	150 Å²	150	144 Å²	144	77%	0.769	76%	0.764	S	S	*	*			trans	69.6	79.8	176.2	-47.4	176.4	0	0	0	114.4
372	S	26.1	Very low	28.1	Very low	88 Å²	88	145 Å²	145	62%	0.615	77%	0.767	S	S	*	*				66.1	118.5	71.4	81.8	0	0	0	0	116.3
373	N	29.3	Very low	27.8	Very low	135 Å²	135	145.5 Å²	145.5	72%	0.722	77%	0.769	S	S	*	*				178.6	168.5	113.2	-90.4	-35	0	0	0	113.6
374	H	32.5	Very low	27.7	Very low	156 Å²	156	142.8 Å²	142.8	72%	0.722	77%	0.765	S	S	*	*			trans	70.4	97.7	168.2	-67.5	-62.6	0	0	0	117.9
375	T	29.8	Very low	27.4	Very low	110 Å²	110	143.6 Å²	143.6	68%	0.675	76%	0.756	S	S	*	*				92.1	139.8	67.7	49.9	0	0	0	0	113.2
376	L	30.5	Very low	27.3	Very low	134 Å²	134	143.9 Å²	143.9	70%	0.702	76%	0.758	S	S	*	*			cis	-146.1	152.2	16.2	-104.3	128.9	0	0	0	113.5
377	K	28.7	Very low	27.1	Very low	188 Å²	188	143.8 Å²	143.8	82%	0.817	76%	0.764	S	S	*	*			trans	46	122	147.9	-78.7	171.7	-171.5	176.7	0	122.9
378	S	23.3	Very low	26.9	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	76%	0.762	S	S	*	*			trans	-69.8	162.4	156.2	55.1	0	0	0	0	116.3
379	A	25.6	Very low	26.6	Very low	88 Å²	88	145.7 Å²	145.7	73%	0.727	77%	0.773	S	S	*	*			trans	99.3	150.5	136.4	0	0	0	0	0	121.1
380	Q	26.1	Very low	26.3	Very low	184 Å²	184	144.1 Å²	144.1	86%	0.86	77%	0.768	S	S	*	*			trans	93.7	149.8	164.5	-58	-169.1	-30.8	0	0	119.7
381	I	28.1	Very low	26.2	Very low	170 Å²	170	146 Å²	146	87%	0.872	77%	0.774	S	S	*	*			trans	91	143.3	167.7	-60.8	156.1	0	0	0	117
382	H	23.2	Very low	25.8	Very low	171 Å²	171	147.9 Å²	147.9	79%	0.792	78%	0.779	S	S	*	*			trans	-97.7	169.7	-170.4	-100.1	-66.1	0	0	0	112.1
383	Q	24.4	Very low	25.7	Very low	175 Å²	175	151.4 Å²	151.4	82%	0.818	79%	0.788	S	S	*	*			trans	72.9	162.2	153.8	-78.4	169.1	-23.4	0	0	118.4
384	Q	24.7	Very low	25.3	Very low	167 Å²	167	152.5 Å²	152.5	78%	0.78	79%	0.792	S	S	*	*			trans	80.5	123.6	158.8	-79.8	178.5	-1.8	0	0	121.1
385	F	24	Very low	24.8	Very low	166 Å²	166	155.5 Å²	155.5	73%	0.728	80%	0.797	S	S	*	*			trans	62.2	123.7	150.5	-71.5	-75.5	0	0	0	123.5
386	E	22.9	Very low	24.5	Very low	162 Å²	162	156 Å²	156	76%	0.757	80%	0.803	S	S	*	*			trans	-7.8	139.2	131.7	-52	168.5	138.1	0	0	117.3
387	Q	25.4	Very low	24.1	Very low	190 Å²	190	154.1 Å²	154.1	89%	0.888	80%	0.801	S	S	*	*				-166	159.9	113.9	-103.7	179.4	17.1	0	0	111.2
388	P	25	Very low	23.8	Very low	107 Å²	107	149.7 Å²	149.7	70%	0.695	79%	0.793	S	S	*	*			trans	-92.1	158.3	-169.4	36.4	-35.3	0	0	0	113.6	S390	P388-S390 PolarHBondContact O-N 3.4Å
389	L	26.4	Very low	23.7	Very low	186 Å²	186	155.1 Å²	155.1	97%	0.974	80%	0.799	S	S	*	*			trans	-85.8	99.1	157.6	-87.7	167.7	0	0	0	109
390	S	21.9	Very low	23.6	Very low	99 Å²	99	154 Å²	154	69%	0.692	80%	0.796	S	S	*	*			trans	-75.9	123.1	177.8	43.2	0	0	0	0	112.2	P388	P388-S390 PolarHBondContact O-N 3.4Å
391	C	23.4	Very low	23.6	Very low	131 Å²	131	153.6 Å²	153.6	89%	0.885	80%	0.798	S	S	*	*			trans	-106.8	144.6	137.3	-68.8	0	0	0	0	107.1
392	E	21.5	Very low	23.4	Very low	188 Å²	188	149.8 Å²	149.8	88%	0.879	78%	0.782	S	S	*	*			trans	-71.4	146.5	-156.7	-66.6	167.4	122.6	0	0	114.2	I394	E392-I394 PolarHBondContact O-N 2.77Å
393	M	22.4	Very low	23.5	Very low	163 Å²	163	148.4 Å²	148.4	80%	0.803	78%	0.781	S	S	*	*			trans	-71.5	117.4	167.4	-78.5	165.7	46.3	0	0	110.1
394	I	22	Very low	23.5	Very low	157 Å²	157	151.1 Å²	151.1	81%	0.805	78%	0.784	S	S	*	*			trans	-123.3	101.7	141.6	-57.7	-179	0	0	0	106.8	E392 P396	E392-I394 PolarHBondContact O-N 2.77Å; I394-P396 WeakPolarHBondContact O-CD 3.32Å
395	W	21.5	Very low	23.7	Very low	219 Å²	219	147.2 Å²	147.2	83%	0.83	77%	0.773	S	S	*	*			trans	-82.6	120.4	161.8	-88.9	47	0	0	0	108	S397	W395-S397 PolarHBondContact O-N 2.97Å; W395-S397 VanDerWaalsContact O-N 3.15Å
396	P	23.5	Very low	23.7	Very low	121 Å²	121	143.5 Å²	143.5	79%	0.786	76%	0.76	S	S	*	*			trans	-70.1	104.2	156	-7.8	25.5	0	0	0	107	I394	I394-P396 WeakPolarHBondContact O-CD 3.32Å
397	S	21.5	Very low	23.9	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	75%	0.752	S	S	*	*			trans	-62.1	148.3	169	45.6	0	0	0	0	110.6	W395	W395-S397 PolarHBondContact O-N 2.97Å; W395-S397 VanDerWaalsContact O-N 3.15Å
398	S	22.3	Very low	24.1	Very low	94 Å²	94	133 Å²	133	66%	0.657	72%	0.721	S	S	*	*	S	Bend	trans	39.2	97.9	156	56.7	0	0	0	0	117.7
399	Y	22.7	Very low	24.2	Very low	224 Å²	224	132.6 Å²	132.6	88%	0.878	72%	0.72	S	S	*	*				-175.3	152.9	105.4	-101.9	-78.1	0	0	0	108.8
400	G	23.1	Very low	24.4	Very low	65 Å²	65	126.5 Å²	126.5	67%	0.67	69%	0.694	S	S	*	*			trans	-96	165.4	-164.9	0	0	0	0	0	115.5
401	I	25.5	Very low	24.8	Very low	176 Å²	176	125 Å²	125	90%	0.903	68%	0.68	S	S	*	*			trans	-159.7	142	138	-97.9	148.7	0	0	0	107.4
402	T	24.6	Very low	25.1	Very low	89 Å²	89	121.6 Å²	121.6	55%	0.546	65%	0.653	S	S	.	*			trans	-82.5	128.2	-172.5	41	0	0	0	0	112.3
403	N	24.8	Very low	25.3	Very low	143 Å²	143	117.8 Å²	117.8	77%	0.765	64%	0.644	S	S	*	*			trans	175.3	102.8	147.2	-94.7	-37.5	0	0	0	111.3
404	R	25.5	Very low	25.7	Very low	232 Å²	232	119.1 Å²	119.1	88%	0.875	65%	0.646	S	S	*	*			trans	-146.5	134.4	165.8	-92.2	-170.5	172.3	-179.9	-2.2	110.9
405	P	27.1	Very low	25.9	Very low	85 Å²	85	117.4 Å²	117.4	55%	0.552	65%	0.645	S	S	*	*			trans	-70	160.5	-176.4	28.1	-34.8	0	0	0	113.8	C407	P405-C407 PolarHBondContact O-N 3.43Å
406	L	25.1	Very low	26	Very low	87 Å²	87	114.9 Å²	114.9	46%	0.455	65%	0.646	S	S	.	*			trans	-62.7	97.2	-173.3	-91.7	141	0	0	0	114.4	K789	L406-K789 HydrophobicContact CD1-CB 4.18Å; L406-K789 HydrophobicContact CD2-CB 3.92Å; L406-K789 HydrophobicContact CD2-CD 3.57Å; L406-K789 HydrophobicContact CD2-CG 3.9Å; L406-K789 HydrophobicContact CG-CB 3.96Å; L406-K789 HydrophobicContact CG-CD 4.02Å; L406-K789 HydrophobicContact CG-CG 4.41Å
407	C	27.8	Very low	26.1	Very low	87 Å²	87	114.5 Å²	114.5	59%	0.588	65%	0.646	S	S	*	*			trans	-68.7	145.6	160.5	-69.1	0	0	0	0	112	P405 S409	P405-C407 PolarHBondContact O-N 3.43Å; C407-S409 PolarHBondContact O-N 3.29Å
408	L	27.8	Very low	26.3	Very low	45 Å²	45	116.3 Å²	116.3	24%	0.236	65%	0.652	C	S	.	*	G	3₁₀ helix	trans	-57.6	-6.4	-179.7	-115.9	160	0	0	0	115.8	V310 S410	V310-L408 HydrophobicContact CG2-CD1 4.02Å; V310-L408 HydrophobicContact CG2-CD2 4.47Å; L408-S410 PolarHBondContact O-N 3.29Å
409	S	28.3	Very low	26.3	Very low	98 Å²	98	116.9 Å²	116.9	69%	0.685	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-72.6	-5.5	-175.6	49.9	0	0	0	0	115.5	C407	C407-S409 PolarHBondContact O-N 3.29Å
410	S	29.6	Very low	26.5	Very low	59 Å²	59	112.4 Å²	112.4	41%	0.413	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-105.5	-11	-179.4	53.9	0	0	0	0	115.7	L408 L412 K789	L408-S410 PolarHBondContact O-N 3.29Å; S410-L412 VanDerWaalsContact C-N 3.3Å; S410-K789 VanDerWaalsContact CB-NZ 3.31Å; S410-K789 WeakPolarHBondContact OG-CE 3.37Å; S410-K789 PolarHBondContact OG-NZ 3.11Å
411	V	31.6	Very low	26.5	Very low	66 Å²	66	114 Å²	114	40%	0.4	66%	0.656	S	S	.	*	S	Bend	trans	-95.2	9.4	-177.4	-162.8	0	0	0	0	111.2
412	L	28.6	Very low	26.5	Very low	60 Å²	60	113.5 Å²	113.5	31%	0.314	65%	0.65	S	S	.	*	S	Bend	trans	-100.9	126.6	176.2	-65	176	0	0	0	109.6	S410 K414	S410-L412 VanDerWaalsContact C-N 3.3Å; L412-K414 PolarHBondContact O-N 3.25Å
413	P	27	Very low	26.5	Very low	108 Å²	108	116.6 Å²	116.6	70%	0.701	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-62.1	129.3	172.5	25.9	-33	0	0	0	109.6
414	K	29	Very low	26.4	Very low	192 Å²	192	117.1 Å²	117.1	84%	0.835	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-61.4	133.3	177	-67.2	177.9	-178.9	174.5	0	109.2	L412 I416	L412-K414 PolarHBondContact O-N 3.25Å; K414-I416 PolarHBondContact O-N 2.88Å
415	P	26	Very low	26.3	Very low	121 Å²	121	111.9 Å²	111.9	79%	0.786	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-62.8	134.4	170.9	27.7	-33.4	0	0	0	109.3	S417	P415-S417 PolarHBondContact O-N 3.23Å
416	I	25.2	Very low	26.2	Very low	166 Å²	166	113.2 Å²	113.2	85%	0.851	67%	0.668	S	S	*	*			trans	-69.9	100.7	-177.5	-59.3	171.7	0	0	0	109	K414	K414-I416 PolarHBondContact O-N 2.88Å
417	S	25.7	Very low	26.2	Very low	112 Å²	112	117 Å²	117	78%	0.783	68%	0.683	S	S	*	*			trans	-86.4	109.3	173.9	55.6	0	0	0	0	110.3	P415	P415-S417 PolarHBondContact O-N 3.23Å
418	V	23.9	Very low	26.4	Very low	133 Å²	133	120.5 Å²	120.5	81%	0.806	69%	0.691	S	S	*	*			trans	-69.6	129.8	172.8	-179.5	0	0	0	0	109.7
419	S	22.4	Very low	26.4	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	71%	0.714	S	S	*	*			trans	-89.8	142.5	177.8	53.6	0	0	0	0	112.9
420	P	27	Very low	26.3	Very low	131 Å²	131	126 Å²	126	85%	0.851	71%	0.712	S	S	*	*			trans	-107.8	165.5	142.9	35.4	-27.7	0	0	0	111.1
421	S	23.6	Very low	26.3	Very low	99 Å²	99	129.7 Å²	129.7	69%	0.692	73%	0.727	S	S	*	*			trans	-126.9	168.1	-161.5	52.4	0	0	0	0	114.6
422	H	25	Very low	26.1	Very low	165 Å²	165	134.3 Å²	134.3	76%	0.764	74%	0.744	S	S	*	*			trans	88	147	158	-79.5	-75.1	0	0	0	121.3
423	I	26.3	Very low	26.2	Very low	153 Å²	153	136.3 Å²	136.3	79%	0.785	76%	0.759	S	S	*	*			trans	77.3	137.4	163.6	-62.5	144.9	0	0	0	116.9
424	E	22.2	Very low	26.2	Very low	154 Å²	154	137.6 Å²	137.6	72%	0.72	76%	0.76	S	S	*	*			cis	-174.9	140.6	-47.3	-115.5	176.6	179	0	0	109.2
425	C	23.8	Very low	26	Very low	122 Å²	122	136.6 Å²	136.6	82%	0.824	76%	0.763	S	S	*	*			trans	60.6	162.1	156.2	-67.1	0	0	0	0	118.7
426	S	25.2	Very low	26.1	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	76%	0.757	S	S	*	*			cis	-146.3	178.4	-5.1	45.3	0	0	0	0	111.1
427	E	25.2	Very low	26.1	Very low	165 Å²	165	131.7 Å²	131.7	77%	0.771	76%	0.756	S	S	*	*			trans	-88.3	170.6	-167.8	-52.8	151.4	132.2	0	0	115.1
428	H	30	Very low	26.1	Very low	162 Å²	162	132 Å²	132	75%	0.75	75%	0.753	S	S	*	*				175.7	133.7	119	-91.7	-51.2	0	0	0	114.7
429	L	27.9	Very low	26.3	Very low	137 Å²	137	134.5 Å²	134.5	72%	0.717	76%	0.756	S	S	*	*				44.7	148	128.3	-60.2	175.1	0	0	0	121.8
430	N	27	Very low	26.5	Very low	122 Å²	122	133.2 Å²	133.2	65%	0.652	76%	0.759	S	S	*	*			cis	-173.9	176.2	-23.5	-129.2	51.3	0	0	0	109.9
431	D	29.7	Very low	26.5	Very low	136 Å²	136	136.1 Å²	136.1	73%	0.727	76%	0.759	S	S	*	*			trans	64.1	163.5	155.8	-52.2	-20.2	0	0	0	120.6
432	E	27.2	Very low	26.8	Very low	163 Å²	163	139.9 Å²	139.9	76%	0.762	77%	0.766	S	S	*	*				-164	179.4	-52.7	-147.3	-161.6	-140.7	0	0	110.3
433	T	30.4	Very low	26.9	Very low	101 Å²	101	138.8 Å²	138.8	62%	0.62	77%	0.765	S	S	*	*			trans	84.2	107.8	160	68.6	0	0	0	0	124.3
434	N	27	Very low	27.3	Very low	136 Å²	136	137.2 Å²	137.2	73%	0.727	77%	0.765	S	S	*	*				79.6	119.7	112.6	-62.7	-24	0	0	0	127.7
435	L	25.9	Very low	27.5	Very low	170 Å²	170	135 Å²	135	89%	0.89	77%	0.766	S	S	*	*			trans	71.1	139.8	130.1	-86.9	83	0	0	0	125
436	G	26.7	Very low	27.6	Very low	64 Å²	64	137.2 Å²	137.2	66%	0.66	77%	0.768	S	S	*	*			trans	121.4	104.1	159.2	0	0	0	0	0	114.2
437	S	26.9	Very low	27.8	Very low	120 Å²	120	136.1 Å²	136.1	84%	0.839	77%	0.766	S	S	*	*				79.2	146.2	64.3	82	0	0	0	0	113.9
438	V	25.9	Very low	27.7	Very low	118 Å²	118	136.4 Å²	136.4	72%	0.715	77%	0.773	S	S	*	*			cis	-165	151.8	-13	118.2	0	0	0	0	110.8
439	Q	26.5	Very low	27.6	Very low	187 Å²	187	134.7 Å²	134.7	87%	0.874	77%	0.774	S	S	*	*			trans	64.3	147.2	160.9	-80.3	163.7	-7.2	0	0	123
440	G	28.2	Very low	27.3	Very low	78 Å²	78	134.1 Å²	134.1	80%	0.804	78%	0.782	S	S	*	*			trans	167.1	99.1	166.7	0	0	0	0	0	113.9
441	F	25	Very low	27.3	Very low	192 Å²	192	134.3 Å²	134.3	84%	0.842	79%	0.787	S	S	*	*			trans	-94.1	149.7	178.6	-91.8	-108.4	0	0	0	112.5
442	Q	31.1	Very low	26.9	Very low	179 Å²	179	132.3 Å²	132.3	84%	0.836	78%	0.783	S	S	*	*				168.2	111.4	110.6	-90.4	-172.6	-22.5	0	0	114.9
443	D	27.1	Very low	26.8	Very low	142 Å²	142	134 Å²	134	76%	0.759	79%	0.788	S	S	*	*			trans	47.3	154.8	137.3	-62.5	-11.3	0	0	0	126
444	P	35	Very low	26.5	Very low	119 Å²	119	136.4 Å²	136.4	77%	0.773	79%	0.792	S	S	*	*			trans	-119.9	164.9	-166.3	42.1	-28.9	0	0	0	115.7
445	S	26.5	Very low	26.4	Very low	108 Å²	108	136.6 Å²	136.6	76%	0.755	79%	0.792	S	S	*	*			trans	-157.7	137	160.6	51.2	0	0	0	0	116.7
446	I	25.9	Very low	26.4	Very low	169 Å²	169	131 Å²	131	87%	0.867	77%	0.77	S	S	*	*			trans	52.8	106.8	145.6	-53.1	162.7	0	0	0	119.6
447	A	29.4	Very low	26.3	Very low	91 Å²	91	133.4 Å²	133.4	75%	0.752	76%	0.764	S	S	*	*				-167.2	114.9	126	0	0	0	0	0	111.3
448	N	22.8	Very low	26.3	Very low	170 Å²	170	132.8 Å²	132.8	91%	0.909	75%	0.748	S	S	*	*			trans	-86.3	116.2	176.2	-77.3	-28.2	0	0	0	111.3
449	T	27.1	Very low	26.3	Very low	127 Å²	127	130.4 Å²	130.4	78%	0.779	73%	0.728	S	S	*	*			trans	-131.5	138.1	157.7	47.4	0	0	0	0	110.2	V451	T449-V451 PolarHBondContact O-N 2.85Å; T449-V451 VanDerWaalsContact O-N 3.09Å
450	S	23	Very low	26.4	Very low	125 Å²	125	123.6 Å²	123.6	87%	0.874	70%	0.699	S	S	*	*			trans	-82.2	88.4	-166.6	54.1	0	0	0	0	112.6	S452	S450-S452 PolarHBondContact O-N 2.78Å
451	V	25.1	Very low	26.5	Very low	125 Å²	125	121.9 Å²	121.9	76%	0.758	67%	0.671	S	S	*	*			trans	-79.3	109.1	170.4	-178.3	0	0	0	0	109.9	T449 K453	T449-V451 PolarHBondContact O-N 2.85Å; T449-V451 VanDerWaalsContact O-N 3.09Å; V451-K453 PolarHBondContact O-N 3.47Å
452	S	22.8	Very low	26.9	Very low	94 Å²	94	113.7 Å²	113.7	66%	0.657	64%	0.638	S	S	*	*			trans	-67.4	99.2	173.9	52	0	0	0	0	111	S450 H454	S450-S452 PolarHBondContact O-N 2.78Å; S452-H454 VanDerWaalsContact C-N 3.34Å; S452-H454 PolarHBondContact O-N 3.31Å
453	K	23.8	Very low	27.2	Very low	199 Å²	199	107.1 Å²	107.1	87%	0.865	61%	0.605	S	S	*	*			trans	-67.7	88.4	171.8	-75.4	-171.9	174.2	-176.2	0	110.7	V451 I455	V451-K453 PolarHBondContact O-N 3.47Å; K453-I455 PolarHBondContact O-N 3.14Å
454	H	25.1	Very low	27.4	Very low	151 Å²	151	103.4 Å²	103.4	70%	0.699	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-65.3	120.2	165.7	-91.9	-78.8	0	0	0	109.7	S452	S452-H454 VanDerWaalsContact C-N 3.34Å; S452-H454 PolarHBondContact O-N 3.31Å
455	I	24.6	Very low	27.6	Very low	140 Å²	140	99.8 Å²	99.8	72%	0.718	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-75.7	122.5	172.2	-58.7	172.4	0	0	0	107.3	K453 N586	K453-I455 PolarHBondContact O-N 3.14Å; I455-N586 WeakPolarHBondContact CG2-ND2 3.42Å
456	A	25	Very low	27.9	Very low	52 Å²	52	95.6 Å²	95.6	43%	0.43	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-94.4	133.9	175.9	0	0	0	0	0	110.5
457	E	26.2	Very low	28.3	Very low	115 Å²	115	90.9 Å²	90.9	54%	0.537	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-84.5	125.1	172.3	-66	168	170.2	0	0	109	F459	E457-F459 HydrophobicContact CB-CD2 4.42Å; E457-F459 HydrophobicContact CB-CE2 3.71Å; E457-F459 HydrophobicContact CB-CZ 4.26Å
458	Q	25.9	Very low	28.5	Very low	107 Å²	107	88.5 Å²	88.5	50%	0.5	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-92.4	120.8	177.6	-68.7	-172.1	0.6	0	0	110.9
459	F	26.6	Very low	28.8	Very low	68 Å²	68	84 Å²	84	30%	0.298	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.1	175.5	-67.2	-85.7	0	0	0	110.5	E457	E457-F459 HydrophobicContact CB-CD2 4.42Å; E457-F459 HydrophobicContact CB-CE2 3.71Å; E457-F459 HydrophobicContact CB-CZ 4.26Å
460	V	28.1	Very low	29	Very low	44 Å²	44	80 Å²	80	27%	0.267	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	135	172.9	173.5	0	0	0	0	109.8	I582 L584	V460-I582 PolarHBondContact N-O 2.88Å; V460-I582 VanDerWaalsContact N-O 3.11Å; V460-I582 PolarHBondContact O-N 2.9Å; V460-L584 HydrophobicContact CB-CD1 4.08Å; V460-L584 HydrophobicContact CG2-CD1 3.59Å
461	L	30.9	Very low	29.2	Very low	43 Å²	43	83 Å²	83	23%	0.225	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	103.8	177.4	-55.5	172.7	0	0	0	109	L293 V318 L322 L579	L293-L461 HydrophobicContact CD2-CD2 4.45Å; V318-L461 HydrophobicContact CG1-CD1 4.27Å; L322-L461 HydrophobicContact CD1-CD2 4.36Å; L461-L579 HydrophobicContact CD2-CD1 4.29Å; L461-L579 HydrophobicContact CD2-CD2 3.94Å
462	C	32	Very low	29.3	Very low	20 Å²	20	80.5 Å²	80.5	14%	0.135	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	150.8	172.9	-75.4	0	0	0	0	111.3	L579 Q580 I582	C462-L579 WeakPolarHBondContact O-CA 3.28Å; C462-Q580 PolarHBondContact N-O 2.79Å; C462-Q580 VanDerWaalsContact N-O 3.12Å; C462-Q580 PolarHBondContact O-N 3.2Å; C462-I582 HydrophobicContact CB-CD1 4.12Å; C462-I582 VanDerWaalsContact SG-CD1 3.52Å
463	W	39	Very low	29.5	Very low	41 Å²	41	85.1 Å²	85.1	16%	0.155	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	121.2	-178.6	-70.2	105.4	0	0	0	110.9	I274 Y290 Y577 L578 L579	I274-W463 HydrophobicContact CD1-CH2 3.42Å; I274-W463 VanDerWaalsContact CD1-CH2 3.42Å; I274-W463 HydrophobicContact CD1-CZ2 3.88Å; I274-W463 HydrophobicContact CD1-CZ3 4.05Å; I274-W463 HydrophobicContact CG1-CH2 3.56Å; I274-W463 HydrophobicContact CG1-CZ2 4.5Å; I274-W463 HydrophobicContact CG1-CZ3 3.89Å; Y290-W463 AromaticContact CD2-CH2 3.84Å; Y290-W463 HydrophobicContact CD2-CH2 3.84Å; Y290-W463 HydrophobicContact CD2-CZ2 4.29Å; Y290-W463 HydrophobicContact CE1-CH2 4.33Å; Y290-W463 AromaticContact CE2-CH2 3.37Å; Y290-W463 HydrophobicContact CE2-CH2 3.37Å; Y290-W463 AromaticContact CE2-CZ2 3.41Å; Y290-W463 HydrophobicContact CE2-CZ2 3.41Å; Y290-W463 VanDerWaalsContact CE2-CZ2 3.41Å; Y290-W463 AromaticContact CZ-CH2 3.66Å; Y290-W463 AromaticContact CZ-CZ2 3.64Å; W463-Y577 HydrophobicContact CB-CD1 4.25Å; W463-Y577 WeakPolarHBondContact CZ3-O 3.44Å; W463-L578 VanDerWaalsContact CA-O 3.32Å; W463-L578 WeakPolarHBondContact CA-O 3.37Å; W463-L579 HydrophobicContact CD2-CB 4.39Å; W463-L579 HydrophobicContact CE3-CB 3.82Å; W463-L579 HydrophobicContact CE3-CG 4.44Å; W463-L579 HydrophobicContact CH2-CB 4.06Å; W463-L579 HydrophobicContact CH2-CD1 3.82Å; W463-L579 HydrophobicContact CH2-CG 4.42Å; W463-L579 HydrophobicContact CZ2-CD1 3.76Å; W463-L579 HydrophobicContact CZ2-CG 4.49Å; W463-L579 HydrophobicContact CZ3-CB 3.65Å; W463-L579 HydrophobicContact CZ3-CD1 4.28Å; W463-L579 HydrophobicContact CZ3-CG 4.39Å
464	N	31.3	Very low	29.6	Very low	64 Å²	64	84 Å²	84	34%	0.342	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.8	170.3	-66.5	-0.2	0	0	0	108.8	Y577 L578	N464-Y577 WeakPolarHBondContact O-CA 3.22Å; N464-L578 PolarHBondContact N-O 3.02Å; N464-L578 PolarHBondContact O-N 3.48Å
465	S	38.3	Very low	29.7	Very low	43 Å²	43	81.2 Å²	81.2	30%	0.301	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	140.1	178.6	55.3	0	0	0	0	111.7	I576	S465-I576 CarbonylContact C-O 3.59Å; S465-I576 WeakPolarHBondContact CA-O 3.36Å
466	S	32.5	Very low	29.8	Very low	19 Å²	19	84 Å²	84	13%	0.133	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.4	173.5	48.7	0	0	0	0	110.2	N187 Q575 I576	N187-S466 VanDerWaalsContact ND2-CB 3.3Å; N187-S466 WeakPolarHBondContact ND2-CB 3.45Å; N187-S466 PolarHBondContact ND2-OG 2.68Å; S466-Q575 CarbonylContact O-C 3.43Å; S466-Q575 VanDerWaalsContact O-CA 3.3Å; S466-Q575 WeakPolarHBondContact O-CA 3.26Å; S466-I576 PolarHBondContact N-O 3.25Å; S466-I576 PolarHBondContact O-N 2.87Å; S466-I576 PolarHBondContact OG-O 3.08Å
467	N	33.9	Very low	29.9	Very low	70 Å²	70	90.8 Å²	90.8	37%	0.374	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.4	175.5	-63.3	-28	0	0	0	109.4	E194 Q575	E194-N467 PolarHBondContact OE2-ND2 3.15Å; N467-Q575 PolarHBondContact OD1-NE2 3.04Å
468	L	35	Very low	30	Very low	41 Å²	41	93.7 Å²	93.7	22%	0.215	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	112.3	165.8	-176.8	73.8	0	0	0	109.2	L183 I470 N573 L574	L183-L468 HydrophobicContact CD1-CB 4.26Å; L183-L468 HydrophobicContact CD1-CD1 4.1Å; L183-L468 HydrophobicContact CD1-CD2 3.91Å; L183-L468 HydrophobicContact CD1-CG 4.31Å; L183-L468 HydrophobicContact CD2-CB 4.1Å; L183-L468 HydrophobicContact CD2-CD2 3.79Å; L183-L468 HydrophobicContact CG-CD2 4.46Å; L468-I470 HydrophobicContact CD2-CD1 3.76Å; L468-I470 HydrophobicContact CD2-CG1 3.56Å; L468-I470 HydrophobicContact CG-CG1 3.83Å; L468-N573 WeakPolarHBondContact O-CA 3.44Å; L468-L574 PolarHBondContact N-O 3.45Å; L468-L574 PolarHBondContact O-N 3.18Å
469	S	29.5	Very low	30	Very low	77 Å²	77	96 Å²	96	54%	0.538	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	99.7	169.7	47.2	0	0	0	0	109.8	R471 N573	S469-R471 PolarHBondContact O-N 3.05Å; S469-N573 WeakPolarHBondContact CA-OD1 3.49Å; S469-N573 WeakPolarHBondContact CB-OD1 3.38Å
470	I	31.3	Very low	30	Very low	43 Å²	43	102.6 Å²	102.6	22%	0.221	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	90.2	176.9	-52.1	-178.4	0	0	0	108.5	T100 L468 N472 I572 L574	T100-I470 HydrophobicContact CG2-CD1 4.34Å; T100-I470 HydrophobicContact CG2-CG2 3.74Å; L468-I470 HydrophobicContact CD2-CD1 3.76Å; L468-I470 HydrophobicContact CD2-CG1 3.56Å; L468-I470 HydrophobicContact CG-CG1 3.83Å; I470-N472 PolarHBondContact O-N 3.2Å; I470-I572 PolarHBondContact N-O 3.38Å; I470-L574 HydrophobicContact CD1-CD1 4.41Å
471	R	25.8	Very low	29.9	Very low	186 Å²	186	107.2 Å²	107.2	70%	0.702	53%	0.532	S	S	*	.			trans	-76	115.4	179.1	-160.4	176.1	-159.9	-176	0.6	111.2	S469 K473 D571	S469-R471 PolarHBondContact O-N 3.05Å; R471-K473 PolarHBondContact O-N 3.05Å; R471-D571 WeakPolarHBondContact CA-OD1 2.98Å; R471-D571 VanDerWaalsContact CG-OD1 3.3Å; R471-D571 WeakPolarHBondContact CG-OD1 3.18Å; R471-D571 IonicContact NE-OD2 3.57Å
472	N	28.2	Very low	29.8	Very low	73 Å²	73	110 Å²	110	39%	0.39	56%	0.555	S	S	.	*			trans	-79	93.3	-171.5	-147.6	2.4	0	0	0	111	I470 F474	I470-N472 PolarHBondContact O-N 3.2Å; N472-F474 PolarHBondContact O-N 3.03Å
473	K	26.2	Very low	29.7	Very low	192 Å²	192	116.1 Å²	116.1	84%	0.835	59%	0.586	S	S	*	*			trans	-75.2	53	-176	-78	-171.1	174.1	-179.6	0	113.9	R471	R471-K473 PolarHBondContact O-N 3.05Å
474	F	26.9	Very low	29.1	Very low	174 Å²	174	121.9 Å²	121.9	76%	0.763	62%	0.619	S	S	*	*			trans	-117.8	57.1	171.5	-75.4	-75	0	0	0	111.3	N472	N472-F474 PolarHBondContact O-N 3.03Å
475	S	26.8	Very low	28.9	Very low	94 Å²	94	122.3 Å²	122.3	66%	0.657	64%	0.639	S	S	*	*			trans	-166.7	68.2	172	43.4	0	0	0	0	112
476	K	27.2	Very low	28.3	Very low	197 Å²	197	126.4 Å²	126.4	86%	0.857	67%	0.665	S	S	*	*			trans	-170.5	88.4	156.9	-110.3	178.5	-176	-151.3	0	109.5
477	H	26.8	Very low	28.1	Very low	195 Å²	195	130.4 Å²	130.4	90%	0.903	69%	0.694	S	S	*	*			trans	-140	26.8	174.5	-137.3	-59.2	0	0	0	112.2
478	E	26.9	Very low	27.7	Very low	176 Å²	176	131.6 Å²	131.6	82%	0.822	71%	0.708	S	S	*	*			trans	-120	114.2	171.4	-65.1	177.6	149.3	0	0	106.5
479	D	27.4	Very low	27.2	Very low	155 Å²	155	137.3 Å²	137.3	83%	0.829	74%	0.737	S	S	*	*			trans	160.3	55.4	166.2	-87.9	-23.1	0	0	0	108.6
480	F	25.3	Very low	26.9	Very low	207 Å²	207	137.6 Å²	137.6	91%	0.908	74%	0.739	S	S	*	*			trans	-154.3	31.8	-177.3	-114.4	-65.7	0	0	0	116.4
481	T	26.3	Very low	26.5	Very low	141 Å²	141	140.4 Å²	140.4	87%	0.865	76%	0.763	S	S	*	*			trans	-148.1	65.8	174	51.1	0	0	0	0	115.3
482	S	28.5	Very low	26.4	Very low	102 Å²	102	136.3 Å²	136.3	71%	0.713	76%	0.763	S	S	*	*			trans	-179.2	130.1	158.4	50	0	0	0	0	107.9
483	D	30.1	Very low	26.3	Very low	148 Å²	148	137.5 Å²	137.5	79%	0.791	78%	0.777	S	S	*	*			cis	-109.1	150.9	7.5	-54.8	-55.2	0	0	0	110.6
484	I	27.3	Very low	26.2	Very low	162 Å²	162	133 Å²	133	83%	0.831	77%	0.77	S	S	*	*			cis	68.1	81.1	43.7	-51.1	179.6	0	0	0	112.4
485	G	26.9	Very low	26.2	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	77%	0.765	S	S	*	*			trans	-164.8	118.1	174.6	0	0	0	0	0	113.2
486	C	26.2	Very low	26.2	Very low	128 Å²	128	132.5 Å²	132.5	87%	0.865	77%	0.774	S	S	*	*			trans	-54.1	158.5	172.6	-61.4	0	0	0	0	113
487	S	27.7	Very low	26.1	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	76%	0.763	S	S	*	*			cis	-164.6	149.9	10.1	17.2	0	0	0	0	112.5
488	S	24.6	Very low	26.1	Very low	95 Å²	95	122.9 Å²	122.9	66%	0.664	75%	0.754	S	S	*	*			trans	2.1	158.3	143.5	66.7	0	0	0	0	122.2
489	L	25.3	Very low	26.1	Very low	160 Å²	160	119.6 Å²	119.6	84%	0.838	75%	0.75	S	S	*	*			trans	76.4	147.8	163.5	-57	160.1	0	0	0	115.2
490	S	23.7	Very low	26.2	Very low	83 Å²	83	117.1 Å²	117.1	58%	0.58	75%	0.745	S	S	*	*			cis	-178.9	146.6	-28	50.4	0	0	0	0	108.2
491	S	23.2	Very low	26.6	Very low	103 Å²	103	112.9 Å²	112.9	72%	0.72	74%	0.738	S	S	*	*			trans	57.2	174.9	158.3	59.1	0	0	0	0	118.3
492	S	24.1	Very low	26.7	Very low	99 Å²	99	113.7 Å²	113.7	69%	0.692	74%	0.736	S	S	*	*			trans	39.7	132	150.1	57.1	0	0	0	0	120.6
493	S	24.5	Very low	26.8	Very low	99 Å²	99	113.8 Å²	113.8	69%	0.692	73%	0.734	S	S	*	*			cis	178.9	-169.6	-5.1	44	0	0	0	0	106.2
494	S	25.7	Very low	26.6	Very low	98 Å²	98	115.9 Å²	115.9	69%	0.685	74%	0.737	S	S	*	*			trans	40.7	126.1	143.5	57.2	0	0	0	0	120.1
495	S	25.8	Very low	26.5	Very low	94 Å²	94	112.7 Å²	112.7	66%	0.657	73%	0.729	S	S	*	*			cis	175.5	145.4	14.5	39.6	0	0	0	0	111.8
496	L	26.8	Very low	26.4	Very low	163 Å²	163	115.7 Å²	115.7	85%	0.853	73%	0.727	S	S	*	*			trans	62.3	148.1	141.8	-61.2	166.9	0	0	0	119
497	S	25.8	Very low	26.4	Very low	88 Å²	88	115.5 Å²	115.5	62%	0.615	72%	0.718	S	S	*	*			cis	-175	156.4	-17.5	50.3	0	0	0	0	111.2
498	S	25.9	Very low	26.3	Very low	102 Å²	102	118.3 Å²	118.3	71%	0.713	72%	0.719	S	S	*	*			trans	37	143.4	139.5	64.1	0	0	0	0	122.3
499	S	26.8	Very low	26.4	Very low	107 Å²	107	120.5 Å²	120.5	75%	0.748	72%	0.722	S	S	*	*			cis	-173.7	172.4	-5.3	50.8	0	0	0	0	111.3
500	S	30.6	Very low	26.4	Very low	102 Å²	102	119.3 Å²	119.3	71%	0.713	72%	0.716	S	S	*	*			trans	-58.1	174.4	155.1	49	0	0	0	0	112.4
501	P	33.4	Very low	26.4	Very low	119 Å²	119	124.5 Å²	124.5	77%	0.773	72%	0.724	S	S	*	*			cis	-144.3	-173.9	23.3	42.6	-20.9	0	0	0	119.2
502	L	29	Very low	26.6	Very low	158 Å²	158	127.3 Å²	127.3	83%	0.827	72%	0.724	S	S	*	*			trans	-44.1	162.4	157.3	-70.1	166.3	0	0	0	113
503	P	30.6	Very low	26.7	Very low	103 Å²	103	130.2 Å²	130.2	67%	0.669	73%	0.727	S	S	*	*			cis	-152.4	-174.7	34.9	45.3	-25	0	0	0	119.2
504	F	24.6	Very low	26.8	Very low	193 Å²	193	130.5 Å²	130.5	85%	0.846	72%	0.724	S	S	*	*			trans	71.5	140.6	148.8	-88.1	-66.9	0	0	0	122.9
505	S	25.4	Very low	26.8	Very low	94 Å²	94	131.8 Å²	131.8	66%	0.657	72%	0.723	S	S	*	*			trans	83.5	116.8	147.5	72.8	0	0	0	0	120.3
506	N	25.2	Very low	26.8	Very low	137 Å²	137	132.6 Å²	132.6	73%	0.733	72%	0.72	S	S	*	*				71.2	118.3	126.6	-62.5	6	0	0	0	121
507	N	25.6	Very low	26.8	Very low	125 Å²	125	133.2 Å²	133.2	67%	0.668	72%	0.716	S	S	*	*				81.8	101.6	125.8	-64.3	3.8	0	0	0	120.2
508	H	25.8	Very low	26.9	Very low	162 Å²	162	133 Å²	133	75%	0.75	72%	0.715	S	S	*	*				85.2	147.6	116.5	-91.8	-96.6	0	0	0	121.3
509	I	26.3	Very low	27	Very low	142 Å²	142	131.4 Å²	131.4	73%	0.728	70%	0.703	S	S	*	*			trans	78.2	97.5	149.4	-69	159.5	0	0	0	117
510	N	25.3	Very low	27.2	Very low	135 Å²	135	131.7 Å²	131.7	72%	0.722	70%	0.697	S	S	*	*			trans	-26.6	152.5	143.2	-55.6	-59	0	0	0	114.8
511	Y	25.1	Very low	27.4	Very low	191 Å²	191	131.1 Å²	131.1	75%	0.749	69%	0.691	S	S	*	*				-177.4	136	100.2	-107.5	-104.8	0	0	0	105.8
512	K	26.3	Very low	27.3	Very low	163 Å²	163	131.6 Å²	131.6	71%	0.709	69%	0.687	S	S	*	*				43	126	81.2	-80.3	178.6	-177.9	174.8	0	110.9
513	Q	26.6	Very low	27.4	Very low	160 Å²	160	131.4 Å²	131.4	75%	0.748	68%	0.681	S	S	*	*			cis	-159.6	179.3	30.4	-114	162.9	-16.2	0	0	106.5
514	T	25.4	Very low	27.3	Very low	104 Å²	104	132.3 Å²	132.3	64%	0.638	68%	0.68	S	S	*	*			cis	-168.9	179.1	29.2	-14.1	0	0	0	0	108.8
515	N	26.6	Very low	27.4	Very low	126 Å²	126	129.4 Å²	129.4	67%	0.674	67%	0.673	S	S	*	*			trans	72.5	137.7	155	-59.7	-21.3	0	0	0	118.4
516	N	26.5	Very low	27.5	Very low	110 Å²	110	130.6 Å²	130.6	59%	0.588	67%	0.672	S	S	*	*			cis	-164.2	153.6	-15	-120.8	-19	0	0	0	113.2
517	F	26.5	Very low	27.5	Very low	177 Å²	177	130.6 Å²	130.6	78%	0.776	67%	0.672	S	S	*	*			trans	58.2	147.6	161.2	-61.2	-63.4	0	0	0	120.6
518	S	27.1	Very low	27.5	Very low	84 Å²	84	135 Å²	135	59%	0.587	68%	0.679	S	S	*	*			cis	-178.8	140.9	-36.7	46.3	0	0	0	0	112.9
519	S	28.6	Very low	27.5	Very low	67 Å²	67	132 Å²	132	47%	0.469	67%	0.673	S	S	.	*			trans	68.3	157.1	143.3	82.7	0	0	0	0	119.2
520	N	29.9	Very low	27.5	Very low	113 Å²	113	131.4 Å²	131.4	60%	0.604	67%	0.671	S	S	*	*			cis	-157.3	172.3	-11.6	-123.2	33.2	0	0	0	111.7	T1053	N520-T1053 PolarHBondContact ND2-N 3.3Å
521	P	35.8	Very low	27.5	Very low	91 Å²	91	132.4 Å²	132.4	59%	0.591	68%	0.675	S	S	*	*			trans	-125.3	-169.2	-166.4	45.2	-33.8	0	0	0	116.8
522	N	31.8	Very low	27.7	Very low	129 Å²	129	126.8 Å²	126.8	69%	0.69	68%	0.675	S	S	*	*			trans	91.4	157	147.6	-72.6	-7.9	0	0	0	123
523	H	31	Very low	27.6	Very low	154 Å²	154	129.5 Å²	129.5	71%	0.713	68%	0.682	S	S	*	*			trans	82.4	145.3	159.9	-60	-53.3	0	0	0	118.5
524	N	28.1	Very low	27.6	Very low	121 Å²	121	132.9 Å²	132.9	65%	0.647	69%	0.688	S	S	*	*			cis	-158.6	151.5	-9.8	-119.9	-4.5	0	0	0	115.6
525	L	26.9	Very low	27.5	Very low	133 Å²	133	135 Å²	135	70%	0.696	70%	0.696	S	S	*	*			trans	24.3	145.7	134.9	-73.6	168.3	0	0	0	124.4
526	N	26.5	Very low	27.5	Very low	119 Å²	119	133.8 Å²	133.8	64%	0.636	70%	0.697	S	S	*	*			trans	103.4	116.3	135.8	-75.6	-21.1	0	0	0	122.1
527	N	25.5	Very low	27.4	Very low	137 Å²	137	133.8 Å²	133.8	73%	0.733	70%	0.702	S	S	*	*			trans	69.2	156.4	133	-59.1	-24.2	0	0	0	117.9
528	R	26	Very low	27.2	Very low	216 Å²	216	132.6 Å²	132.6	82%	0.815	70%	0.698	S	S	*	*			cis	-159.4	162	10.2	-143.5	-177.3	-176.5	165	-0.7	109.7
529	T	26.1	Very low	27.1	Very low	101 Å²	101	134.7 Å²	134.7	62%	0.62	70%	0.701	S	S	*	*			trans	29.8	144.3	141.2	51.9	0	0	0	0	121.3
530	D	25.2	Very low	26.8	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	71%	0.714	S	S	*	*			cis	-170.8	175.1	17.7	-125.4	-30.7	0	0	0	114.6
531	I	26.5	Very low	26.5	Very low	155 Å²	155	139.2 Å²	139.2	80%	0.795	72%	0.719	S	S	*	*			trans	53	124.4	147.1	-64.1	158.3	0	0	0	119.8
532	G	28.1	Very low	26.1	Very low	74 Å²	74	142.9 Å²	142.9	76%	0.763	73%	0.728	S	S	*	*			trans	-177.7	62.2	170.3	0	0	0	0	0	117.2
533	Y	24.3	Very low	25.7	Very low	219 Å²	219	141.9 Å²	141.9	86%	0.859	72%	0.722	S	S	*	*			trans	-61.3	159.3	164	-81.6	-98.8	0	0	0	110.3
534	R	26.4	Very low	25.5	Very low	231 Å²	231	141.8 Å²	141.8	87%	0.872	72%	0.722	S	S	*	*			cis	-166.4	167.9	44.5	-149.7	172.6	-157.6	178.5	4.6	113.3
535	N	24.1	Very low	25.4	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	72%	0.722	S	S	*	*			trans	-73.8	151.8	176.9	-44.1	-26.4	0	0	0	113.9
536	S	26.5	Very low	25.4	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	72%	0.723	S	S	*	*				-166.2	143.2	127.1	56.1	0	0	0	0	106.9
537	T	23.9	Very low	25.6	Very low	111 Å²	111	141.9 Å²	141.9	68%	0.681	73%	0.733	S	S	*	*				51.3	137.8	58.1	65.3	0	0	0	0	111.2
538	E	23.4	Very low	25.7	Very low	151 Å²	151	146 Å²	146	71%	0.706	74%	0.74	S	S	*	*			cis	-169.6	-169.2	24.2	-137.5	155.9	-123.2	0	0	110
539	I	24.5	Very low	26	Very low	128 Å²	128	140.8 Å²	140.8	66%	0.656	73%	0.734	S	S	*	*			trans	65	116.9	143	-72.8	164	0	0	0	120.9
540	L	22.9	Very low	25.9	Very low	140 Å²	140	140.7 Å²	140.7	73%	0.733	74%	0.737	S	S	*	*			trans	41.2	140.6	136.5	-76	63.9	0	0	0	123.7
541	L	22.6	Very low	26	Very low	136 Å²	136	140.3 Å²	140.3	71%	0.712	74%	0.735	S	S	*	*				21.9	121.6	129.3	-55.5	161.9	0	0	0	118.5
542	H	27.2	Very low	26.1	Very low	168 Å²	168	140.8 Å²	140.8	78%	0.778	73%	0.731	S	S	*	*				-165.6	162.8	101	-109.8	-72.8	0	0	0	115.2
543	N	24.2	Very low	26.2	Very low	107 Å²	107	143 Å²	143	57%	0.572	73%	0.726	S	S	*	*			trans	-66.6	-175.6	-176.9	-49.7	-23.1	0	0	0	115.6
544	H	27.1	Very low	26.4	Very low	153 Å²	153	139.1 Å²	139.1	71%	0.708	72%	0.72	S	S	*	*			trans	82.9	138.6	148.4	-64.2	-40.1	0	0	0	117.1
545	N	25.3	Very low	26.3	Very low	119 Å²	119	133.4 Å²	133.4	64%	0.636	72%	0.715	S	S	*	*			cis	-167.1	-177	-13.8	-133.5	45.6	0	0	0	112.7
546	D	26.5	Very low	26.4	Very low	135 Å²	135	129.3 Å²	129.3	72%	0.722	71%	0.708	S	S	*	*			trans	85.6	155.9	147.6	-61.8	-29.8	0	0	0	123.2
547	S	31.2	Very low	26.2	Very low	121 Å²	121	132.2 Å²	132.2	85%	0.846	72%	0.716	S	S	*	*			trans	80.6	63.4	168.9	64.9	0	0	0	0	120.9
548	Y	27.8	Very low	26.5	Very low	223 Å²	223	133 Å²	133	88%	0.875	73%	0.726	S	S	*	*				-48.6	163.9	128.7	-85	-84.4	0	0	0	111.1
549	P	31.7	Very low	26.5	Very low	106 Å²	106	135.6 Å²	135.6	69%	0.688	74%	0.738	S	S	*	*			cis	-158.1	141.2	40	40	-15.9	0	0	0	120.7
550	S	25.4	Very low	26.5	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	74%	0.741	S	S	*	*			trans	68.4	176.2	132.1	83.7	0	0	0	0	118.8
551	N	26.7	Very low	26.8	Very low	121 Å²	121	134.4 Å²	134.4	65%	0.647	75%	0.746	S	S	*	*			cis	-161.5	166.5	-1.1	-141	-30.5	0	0	0	112.3
552	K	29.3	Very low	26.8	Very low	165 Å²	165	139 Å²	139	72%	0.717	76%	0.755	S	S	*	*			trans	68.1	147.3	155.4	-64	164.7	-175.8	178.1	0	117.5
553	N	28.7	Very low	26.7	Very low	120 Å²	120	138.1 Å²	138.1	64%	0.642	76%	0.755	S	S	*	*			cis	-164	150	-10.2	-113.6	5.4	0	0	0	110.8
554	N	28.8	Very low	26.7	Very low	139 Å²	139	143.3 Å²	143.3	74%	0.743	77%	0.773	S	S	*	*			trans	63.6	158	151	-60.2	8.2	0	0	0	118.7
555	S	24.9	Very low	26.6	Very low	110 Å²	110	145 Å²	145	77%	0.769	78%	0.778	S	S	*	*			cis	-176.2	138.4	-32.8	54.2	0	0	0	0	109
556	G	25.6	Very low	26.5	Very low	63 Å²	63	144.3 Å²	144.3	65%	0.649	78%	0.783	S	S	*	*			trans	115	104.3	163.9	0	0	0	0	0	116.3
557	D	23.7	Very low	26.4	Very low	162 Å²	162	145.6 Å²	145.6	87%	0.866	79%	0.79	S	S	*	*			trans	44.1	105.1	133.3	-45.5	-23.3	0	0	0	120.2
558	S	28.7	Very low	26.2	Very low	126 Å²	126	151 Å²	151	88%	0.881	79%	0.792	S	S	*	*			trans	-157.8	139.6	150.1	-66.3	0	0	0	0	109.8
559	E	23.3	Very low	26.3	Very low	206 Å²	206	142.9 Å²	142.9	96%	0.963	77%	0.771	S	S	*	*			trans	-94.5	115.2	179.6	-63.5	177	111.7	0	0	111.9
560	A	25.8	Very low	26.4	Very low	86 Å²	86	143.4 Å²	143.4	71%	0.711	77%	0.768	S	S	*	*			trans	-161.9	173.9	164.4	0	0	0	0	0	111.8
561	D	28	Very low	26.9	Very low	158 Å²	158	142 Å²	142	85%	0.845	75%	0.753	S	S	*	*			trans	73.9	44.9	169.1	-64.3	-6.8	0	0	0	119.8
562	Y	23.7	Very low	27.7	Very low	232 Å²	232	138 Å²	138	91%	0.91	73%	0.731	S	S	*	*			trans	-100.1	63	155.9	-90.5	-76.8	0	0	0	112.2
563	L	24.8	Very low	28.4	Very low	149 Å²	149	133.4 Å²	133.4	78%	0.78	71%	0.714	S	S	*	*			trans	-138.4	27.4	-170.4	-121.4	163.3	0	0	0	118
564	F	23.9	Very low	29.2	Very low	217 Å²	217	128.6 Å²	128.6	95%	0.952	69%	0.689	S	S	*	*			trans	-137	73.2	162.9	-91.7	-75.1	0	0	0	113.1
565	K	24.9	Very low	30.1	Very low	187 Å²	187	123.1 Å²	123.1	81%	0.813	66%	0.659	S	S	*	*			trans	-113.1	114.2	154.9	-82.6	178.8	178.6	168.8	0	108.2	N567	K565-N567 PolarHBondContact O-N 3.15Å
566	S	24.2	Very low	31.2	Very low	106 Å²	106	118.4 Å²	118.4	74%	0.741	63%	0.625	S	S	*	*			trans	-58.2	126.8	172.7	56.2	0	0	0	0	110	R568	S566-R568 PolarHBondContact O-N 3.44Å
567	N	24.2	Very low	32.4	Very low	162 Å²	162	115.8 Å²	115.8	87%	0.866	60%	0.595	S	S	*	*			trans	-59	105.2	173.9	-78.9	-24	0	0	0	109.7	K565 A569	K565-N567 PolarHBondContact O-N 3.15Å; N567-A569 PolarHBondContact O-N 3.27Å
568	R	26.1	Very low	33.4	Very low	233 Å²	233	111.6 Å²	111.6	88%	0.879	57%	0.573	S	S	*	*			trans	-72	85.2	165.3	-73.7	-174.2	175.6	-173.8	-2	107.6	S566	S566-R568 PolarHBondContact O-N 3.44Å
569	A	30.5	Very low	34	Very low	53 Å²	53	107 Å²	107	44%	0.438	54%	0.538	S	S	.	.			trans	-56	155.3	169.9	0	0	0	0	0	110.5	N567 D571	N567-A569 PolarHBondContact O-N 3.27Å; A569-D571 VanDerWaalsContact C-N 3.32Å; A569-D571 PolarHBondContact O-N 3.23Å
570	N	33.9	Very low	34.6	Very low	117 Å²	117	99 Å²	99	63%	0.626	50%	0.5	S	S	*	.			trans	-73.7	79.1	-169	-60.5	-22.6	0	0	0	112	I572	N570-I572 PolarHBondContact O-N 3.2Å
571	D	35.3	Very low	34.7	Very low	71 Å²	71	98.7 Å²	98.7	38%	0.38	49%	0.491	S	S	.	.			trans	-76.1	108	170.5	-75.5	-15.6	0	0	0	109.5	R471 A569	R471-D571 WeakPolarHBondContact CA-OD1 2.98Å; R471-D571 VanDerWaalsContact CG-OD1 3.3Å; R471-D571 WeakPolarHBondContact CG-OD1 3.18Å; R471-D571 IonicContact NE-OD2 3.57Å; A569-D571 VanDerWaalsContact C-N 3.32Å; A569-D571 PolarHBondContact O-N 3.23Å
572	I	42.9	Very low	34.9	Very low	37 Å²	37	93.9 Å²	93.9	19%	0.19	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	117	-176.1	-55.9	169.4	0	0	0	109.3	E96 I470 N570 L574	E96-I572 HydrophobicContact CB-CD1 3.62Å; E96-I572 HydrophobicContact CG-CD1 3.8Å; I470-I572 PolarHBondContact N-O 3.38Å; N570-I572 PolarHBondContact O-N 3.2Å; I572-L574 HydrophobicContact CG2-CD2 4.12Å; I572-L574 HydrophobicContact CG2-CG 4.14Å
573	N	44.8	Very low	35	Very low	67 Å²	67	88.2 Å²	88.2	36%	0.358	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	112.1	174.7	-68.3	-14.8	0	0	0	110.4	A278 T279 L468 S469	A278-N573 HydrophobicContact CB-CB 3.96Å; A278-N573 VanDerWaalsContact CB-O 3.29Å; A278-N573 WeakPolarHBondContact CB-O 3.48Å; A278-N573 PolarHBondContact N-O 3.31Å; T279-N573 HydrophobicContact CG2-CB 4.3Å; L468-N573 WeakPolarHBondContact O-CA 3.44Å; S469-N573 WeakPolarHBondContact CA-OD1 3.49Å; S469-N573 WeakPolarHBondContact CB-OD1 3.38Å
574	L	44.9	Very low	35.1	Very low	19 Å²	19	84.3 Å²	84.3	10%	0.099	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.9	173.8	-62.2	178.3	0	0	0	109.9	L97 I284 L468 I470 I572	L97-L574 HydrophobicContact CD1-CD1 4.34Å; I284-L574 HydrophobicContact CD1-CD2 3.47Å; I284-L574 VanDerWaalsContact CD1-CD2 3.47Å; L468-L574 PolarHBondContact N-O 3.45Å; L468-L574 PolarHBondContact O-N 3.18Å; I470-L574 HydrophobicContact CD1-CD1 4.41Å; I572-L574 HydrophobicContact CG2-CD2 4.12Å; I572-L574 HydrophobicContact CG2-CG 4.14Å
575	Q	48.3	Very low	35.3	Very low	24 Å²	24	78 Å²	78	11%	0.112	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	117.3	175.4	-164.8	169.8	39.7	0	0	109.8	V276 A278 S466 N467 Y577	V276-Q575 HydrophobicContact CB-CB 4.47Å; V276-Q575 WeakPolarHBondContact CB-O 3.18Å; V276-Q575 PolarHBondContact N-O 3.38Å; V276-Q575 PolarHBondContact O-N 3.47Å; A278-Q575 HydrophobicContact CB-CB 4.12Å; S466-Q575 CarbonylContact O-C 3.43Å; S466-Q575 VanDerWaalsContact O-CA 3.3Å; S466-Q575 WeakPolarHBondContact O-CA 3.26Å; N467-Q575 PolarHBondContact OD1-NE2 3.04Å; Q575-Y577 HydrophobicContact CB-CE2 4.35Å; Q575-Y577 HydrophobicContact CG-CD2 4.46Å; Q575-Y577 HydrophobicContact CG-CE2 3.82Å; Q575-Y577 PolarHBondContact OE1-OH 2.94Å
576	I	48.5	Very low	35.5	Very low	11 Å²	11	73.4 Å²	73.4	6%	0.056	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.7	175.3	-66.5	-162.4	0	0	0	110.1	L183 A273 I274 I275 S465 S466 L578	L183-I576 HydrophobicContact CD2-CD1 3.58Å; L183-I576 HydrophobicContact CD2-CG1 4.02Å; L183-I576 HydrophobicContact CG-CD1 4.18Å; A273-I576 HydrophobicContact CB-CG2 4.39Å; I274-I576 WeakPolarHBondContact O-CA 3.37Å; I275-I576 HydrophobicContact CB-CG1 4.45Å; I275-I576 HydrophobicContact CD1-CD1 4.28Å; I275-I576 HydrophobicContact CG1-CD1 3.89Å; I275-I576 HydrophobicContact CG1-CG1 4.1Å; I275-I576 HydrophobicContact CG2-CG1 4.24Å; S465-I576 CarbonylContact C-O 3.59Å; S465-I576 WeakPolarHBondContact CA-O 3.36Å; S466-I576 PolarHBondContact N-O 3.25Å; S466-I576 PolarHBondContact O-N 2.87Å; S466-I576 PolarHBondContact OG-O 3.08Å; I576-L578 HydrophobicContact CG2-CG 4.42Å
577	Y	50.9	Low	35.7	Very low	8 Å²	8	75.2 Å²	75.2	3%	0.031	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.5	172.9	-68.3	-91.6	0	0	0	109.8	A273 I274 V276 L306 W463 N464 Q575	A273-Y577 CarbonylContact C-O 3.59Å; A273-Y577 VanDerWaalsContact CA-O 3.22Å; A273-Y577 WeakPolarHBondContact CA-O 3.43Å; I274-Y577 PolarHBondContact N-O 2.74Å; I274-Y577 PolarHBondContact O-N 2.93Å; V276-Y577 HydrophobicContact CB-CD2 4.43Å; V276-Y577 HydrophobicContact CB-CE2 4.19Å; V276-Y577 HydrophobicContact CG2-CD2 3.74Å; V276-Y577 HydrophobicContact CG2-CE2 3.8Å; L306-Y577 HydrophobicContact CD1-CE2 4.4Å; L306-Y577 HydrophobicContact CD2-CE1 4.32Å; L306-Y577 HydrophobicContact CD2-CE2 3.75Å; L306-Y577 VanDerWaalsContact CD2-CZ 3.5Å; L306-Y577 WeakPolarHBondContact CD2-OH 3.35Å; W463-Y577 HydrophobicContact CB-CD1 4.25Å; W463-Y577 WeakPolarHBondContact CZ3-O 3.44Å; N464-Y577 WeakPolarHBondContact O-CA 3.22Å; Q575-Y577 HydrophobicContact CB-CE2 4.35Å; Q575-Y577 HydrophobicContact CG-CD2 4.46Å; Q575-Y577 HydrophobicContact CG-CE2 3.82Å; Q575-Y577 PolarHBondContact OE1-OH 2.94Å
578	L	44	Very low	35.9	Very low	75 Å²	75	74.9 Å²	74.9	39%	0.393	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	127.3	175.8	-69.2	168.3	0	0	0	110.4	A273 W463 N464 I576	A273-L578 HydrophobicContact CB-CD2 3.83Å; W463-L578 VanDerWaalsContact CA-O 3.32Å; W463-L578 WeakPolarHBondContact CA-O 3.37Å; N464-L578 PolarHBondContact N-O 3.02Å; N464-L578 PolarHBondContact O-N 3.48Å; I576-L578 HydrophobicContact CG2-CG 4.42Å
579	L	41.8	Very low	35.9	Very low	28 Å²	28	70.6 Å²	70.6	15%	0.147	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.2	179.9	-166	155.8	0	0	0	111.4	V272 Y290 L293 L461 C462 W463	V272-L579 HydrophobicContact CB-CB 4.09Å; V272-L579 HydrophobicContact CG1-CB 3.68Å; V272-L579 HydrophobicContact CG1-CD1 3.8Å; V272-L579 HydrophobicContact CG1-CD2 4.3Å; V272-L579 HydrophobicContact CG1-CG 4.14Å; V272-L579 VanDerWaalsContact O-CB 3.32Å; V272-L579 WeakPolarHBondContact O-CB 3.19Å; V272-L579 PolarHBondContact O-N 3.03Å; Y290-L579 HydrophobicContact CD2-CD1 4.15Å; Y290-L579 HydrophobicContact CE2-CD1 4.1Å; L293-L579 HydrophobicContact CD2-CD1 3.9Å; L461-L579 HydrophobicContact CD2-CD1 4.29Å; L461-L579 HydrophobicContact CD2-CD2 3.94Å; C462-L579 WeakPolarHBondContact O-CA 3.28Å; W463-L579 HydrophobicContact CD2-CB 4.39Å; W463-L579 HydrophobicContact CE3-CB 3.82Å; W463-L579 HydrophobicContact CE3-CG 4.44Å; W463-L579 HydrophobicContact CH2-CB 4.06Å; W463-L579 HydrophobicContact CH2-CD1 3.82Å; W463-L579 HydrophobicContact CH2-CG 4.42Å; W463-L579 HydrophobicContact CZ2-CD1 3.76Å; W463-L579 HydrophobicContact CZ2-CG 4.49Å; W463-L579 HydrophobicContact CZ3-CB 3.65Å; W463-L579 HydrophobicContact CZ3-CD1 4.28Å; W463-L579 HydrophobicContact CZ3-CG 4.39Å
580	Q	36.3	Very low	35.7	Very low	38 Å²	38	75 Å²	75	18%	0.178	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.3	174.7	-174.5	170	-15.5	0	0	111	C462 T657 Y786	C462-Q580 PolarHBondContact N-O 2.79Å; C462-Q580 VanDerWaalsContact N-O 3.12Å; C462-Q580 PolarHBondContact O-N 3.2Å; Q580-T657 PolarHBondContact NE2-OG1 2.92Å; Q580-Y786 PolarHBondContact NE2-OH 3.47Å; Q580-Y786 PolarHBondContact OE1-OH 2.82Å
581	P	27.9	Very low	35.5	Very low	81 Å²	81	75 Å²	75	53%	0.526	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.1	174.1	31.2	-32.3	0	0	0	110.7
582	I	30.1	Very low	35	Very low	56 Å²	56	79.9 Å²	79.9	29%	0.287	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.5	171.5	-55.6	-175.6	0	0	0	109	V460 C462 L584	V460-I582 PolarHBondContact N-O 2.88Å; V460-I582 VanDerWaalsContact N-O 3.11Å; V460-I582 PolarHBondContact O-N 2.9Å; C462-I582 HydrophobicContact CB-CD1 4.12Å; C462-I582 VanDerWaalsContact SG-CD1 3.52Å; I582-L584 HydrophobicContact CG2-CD1 4.2Å
583	H	26.6	Very low	34.2	Very low	114 Å²	114	84.1 Å²	84.1	53%	0.528	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.1	174.1	175.7	-73.3	0	0	0	109.6
584	L	27.8	Very low	33.3	Very low	67 Å²	67	90.6 Å²	90.6	35%	0.351	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-95.5	130.7	173.4	-74.2	84.8	0	0	0	110.3	V460 I582	V460-L584 HydrophobicContact CB-CD1 4.08Å; V460-L584 HydrophobicContact CG2-CD1 3.59Å; I582-L584 HydrophobicContact CG2-CD1 4.2Å
585	P	27.8	Very low	32.4	Very low	84 Å²	84	95.1 Å²	95.1	55%	0.545	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-68.3	143.7	169.5	30	-33.6	0	0	0	110.5	I587	P585-I587 PolarHBondContact O-N 2.97Å; P585-I587 VanDerWaalsContact O-N 3.1Å
586	N	28.4	Very low	31.3	Very low	91 Å²	91	100.8 Å²	100.8	49%	0.487	53%	0.528	S	S	.	.			trans	-67.3	108.6	-178.7	-89.4	-40.9	0	0	0	111.8	I455 N588	I455-N586 WeakPolarHBondContact CG2-ND2 3.42Å; N586-N588 PolarHBondContact O-N 2.86Å
587	I	28.2	Very low	30.2	Very low	144 Å²	144	107.7 Å²	107.7	74%	0.738	56%	0.558	S	S	*	*			trans	-77.3	102	171.1	-58.9	176.4	0	0	0	108.5	P585 N589	P585-I587 PolarHBondContact O-N 2.97Å; P585-I587 VanDerWaalsContact O-N 3.1Å; I587-N589 PolarHBondContact O-N 3.09Å; I587-N589 VanDerWaalsContact O-N 3.16Å
588	N	28.2	Very low	28.9	Very low	154 Å²	154	113.6 Å²	113.6	82%	0.824	59%	0.585	S	S	*	*			trans	-71.7	103.5	167.5	-88.8	-23.7	0	0	0	109.3	N586 N590	N586-N588 PolarHBondContact O-N 2.86Å; N588-N590 PolarHBondContact O-N 3.32Å
589	N	26.1	Very low	28.1	Very low	143 Å²	143	116.8 Å²	116.8	77%	0.765	60%	0.603	S	S	*	*			trans	-64.1	102.1	171.3	-69	-20	0	0	0	110.4	I587	I587-N589 PolarHBondContact O-N 3.09Å; I587-N589 VanDerWaalsContact O-N 3.16Å
590	N	27.9	Very low	27.2	Very low	146 Å²	146	125.8 Å²	125.8	78%	0.781	64%	0.636	S	S	*	*			trans	-158	127.3	158.2	-101.2	-30.3	0	0	0	112.8	N588	N588-N590 PolarHBondContact O-N 3.32Å
591	T	28.3	Very low	26.7	Very low	118 Å²	118	130.9 Å²	130.9	72%	0.724	66%	0.66	S	S	*	*			trans	52.2	93.7	151.3	59.3	0	0	0	0	119.9
592	H	25	Very low	26.5	Very low	173 Å²	173	131.6 Å²	131.6	80%	0.801	67%	0.667	S	S	*	*				47.2	135.5	114	-89.8	-79.3	0	0	0	122.5
593	N	27.1	Very low	26.2	Very low	125 Å²	125	134.3 Å²	134.3	67%	0.668	69%	0.69	S	S	*	*			trans	97.3	119.5	138.8	-70.3	0.7	0	0	0	121.4
594	Y	25.9	Very low	26.1	Very low	203 Å²	203	138.1 Å²	138.1	80%	0.796	71%	0.705	S	S	*	*			trans	52.2	102.4	151.3	-71.4	-94.9	0	0	0	119.1
595	V	24.3	Very low	26.1	Very low	115 Å²	115	140.7 Å²	140.7	70%	0.697	72%	0.724	S	S	*	*				67.2	130.7	72.1	176.3	0	0	0	0	113.6
596	N	25.4	Very low	26.1	Very low	142 Å²	142	144 Å²	144	76%	0.759	74%	0.737	S	S	*	*			trans	72.3	142.4	174.3	-70	-15.4	0	0	0	117.2
597	K	25.4	Very low	26	Very low	157 Å²	157	147 Å²	147	68%	0.683	75%	0.753	S	S	*	*			cis	-166.5	175.8	-25.5	-144.7	168.1	154.5	-130	0	108.9
598	E	25.2	Very low	26.1	Very low	132 Å²	132	147.5 Å²	147.5	62%	0.617	76%	0.757	S	S	*	*			trans	74.4	132.1	153.5	-80.6	148.6	-136.4	0	0	120.9
599	N	25.6	Very low	26.1	Very low	141 Å²	141	146.8 Å²	146.8	75%	0.754	75%	0.753	S	S	*	*			trans	78.5	93.6	148.3	-55.2	-10.7	0	0	0	120.4
600	Y	23.2	Very low	26.2	Very low	218 Å²	218	146.8 Å²	146.8	86%	0.855	75%	0.753	S	S	*	*				-21.3	148.5	126	-62.7	-99.4	0	0	0	113.6
601	E	25.6	Very low	26.1	Very low	144 Å²	144	146.6 Å²	146.6	67%	0.673	75%	0.751	S	S	*	*				-163.2	164.8	62.3	-86.7	-164.7	129	0	0	114.9
602	S	24	Very low	26.2	Very low	96 Å²	96	148.4 Å²	148.4	67%	0.671	75%	0.751	S	S	*	*			trans	69.2	128.3	151.4	81.1	0	0	0	0	120.1
603	C	25.3	Very low	26.3	Very low	113 Å²	113	146 Å²	146	76%	0.764	74%	0.744	S	S	*	*				-177.3	83.2	120.1	-93.6	0	0	0	0	109.5
604	F	23	Very low	26.4	Very low	194 Å²	194	145 Å²	145	85%	0.851	74%	0.735	S	S	*	*			trans	-80	132.4	147.1	-85.9	-97.7	0	0	0	107.2
605	T	27.3	Very low	26.5	Very low	122 Å²	122	138.1 Å²	138.1	75%	0.748	72%	0.716	S	S	*	*			trans	-138.8	94.6	164.6	38.7	0	0	0	0	109.5
606	D	27.8	Very low	26.8	Very low	152 Å²	152	135.5 Å²	135.5	81%	0.813	70%	0.698	S	S	*	*			trans	-70.5	138.1	161.4	-88.4	-50.1	0	0	0	109.6	N608	D606-N608 PolarHBondContact O-N 2.95Å
607	N	26.5	Very low	27	Very low	155 Å²	155	137.8 Å²	137.8	83%	0.829	70%	0.696	S	S	*	*			trans	-71.8	123	173.2	-72.4	-61.2	0	0	0	110
608	N	30.8	Very low	27.2	Very low	155 Å²	155	137.5 Å²	137.5	83%	0.829	70%	0.701	S	S	*	*			trans	-142.9	137	152.6	-99.6	-53.2	0	0	0	111.1	D606	D606-N608 PolarHBondContact O-N 2.95Å
609	N	27.5	Very low	27.3	Very low	139 Å²	139	137.3 Å²	137.3	74%	0.743	70%	0.704	S	S	*	*			trans	-79.7	140.5	-174.9	-48.4	-77.3	0	0	0	110.5
610	N	28.2	Very low	27.5	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	70%	0.701	S	S	*	*				171.4	137.2	112	-88.6	-31.9	0	0	0	115.4
611	I	26.9	Very low	27.8	Very low	141 Å²	141	132.5 Å²	132.5	72%	0.723	69%	0.693	S	S	*	*			trans	72.8	102.4	142.6	-60	164.8	0	0	0	119.5
612	H	29.3	Very low	28	Very low	157 Å²	157	132.3 Å²	132.3	73%	0.727	70%	0.695	S	S	*	*			trans	66.7	123	138.8	-73.6	-5.4	0	0	0	124.2
613	N	28.5	Very low	28.2	Very low	122 Å²	122	134.7 Å²	134.7	65%	0.652	70%	0.697	S	S	*	*				60	143.5	122	-50.2	4.7	0	0	0	120.4
614	H	29.2	Very low	28.4	Very low	105 Å²	105	136.5 Å²	136.5	49%	0.486	70%	0.7	S	S	.	*			cis	-153.1	-179.9	-3.9	-126.7	-139	0	0	0	109.4	D229	D229-H614 IonicContact OD1-CE1 3.66Å; D229-H614 IonicContact OD1-CG 3.71Å; D229-H614 IonicContact OD1-ND1 2.69Å; D229-H614 PolarHBondContact OD1-ND1 2.99Å
615	S	28	Very low	28.8	Very low	57 Å²	57	130.3 Å²	130.3	40%	0.399	69%	0.69	S	S	.	*			trans	-92.9	-155.8	-160	55.3	0	0	0	0	117.5	S228 D229 C230	S228-S615 CarbonylContact C-O 3.57Å; S228-S615 WeakPolarHBondContact CA-O 3.4Å; S228-S615 PolarHBondContact N-O 2.97Å; D229-S615 WeakPolarHBondContact CA-OG 3.3Å; D229-S615 PolarHBondContact N-OG 2.8Å; C230-S615 PolarHBondContact N-OG 3.34Å
616	D	30.2	Very low	29	Very low	60 Å²	60	131.6 Å²	131.6	32%	0.321	69%	0.693	S	S	.	*			trans	73.5	159.3	155.2	-75.2	48	0	0	0	122.3	S228 D229	S228-D616 WeakPolarHBondContact O-CB 3.44Å; D229-D616 VanDerWaalsContact N-CB 3.35Å; D229-D616 VanDerWaalsContact N-CG 3.31Å; D229-D616 PolarHBondContact N-OD1 2.91Å
617	R	28.9	Very low	29.1	Very low	190 Å²	190	130 Å²	130	72%	0.717	68%	0.684	S	S	*	*			cis	-176.1	172.9	-24.1	-164.3	-170.6	-140.7	126.6	-4.3	108.1
618	I	29.9	Very low	29.3	Very low	151 Å²	151	129.6 Å²	129.6	77%	0.774	68%	0.68	S	S	*	*			trans	75.5	142.6	163.2	-57.3	172.8	0	0	0	115.5
619	N	28.2	Very low	29.2	Very low	129 Å²	129	126.7 Å²	126.7	69%	0.69	67%	0.672	S	S	*	*			cis	-172.7	167.5	-37.5	-142.6	-3	0	0	0	109
620	N	28.4	Very low	29.1	Very low	128 Å²	128	129.7 Å²	129.7	68%	0.684	67%	0.674	S	S	*	*			trans	69.7	156	163.1	-49.7	-28.6	0	0	0	115.6
621	N	29.9	Very low	29.2	Very low	129 Å²	129	129.4 Å²	129.4	69%	0.69	67%	0.673	S	S	*	*			cis	-161.9	160.5	11.4	-137.6	-7.7	0	0	0	112.6
622	I	29.9	Very low	29.2	Very low	141 Å²	141	128.7 Å²	128.7	72%	0.723	67%	0.671	S	S	*	*			trans	67.7	138.1	151	-66.2	161.6	0	0	0	117.7
623	M	28.7	Very low	29.1	Very low	145 Å²	145	128.7 Å²	128.7	71%	0.714	67%	0.671	S	S	*	*			cis	-167.3	156.8	-17.8	-108.9	-60.6	-162.4	0	0	108.9
624	N	29.6	Very low	29.2	Very low	152 Å²	152	133.7 Å²	133.7	81%	0.813	68%	0.68	S	S	*	*			trans	59.9	132.2	158.2	-57.5	-28	0	0	0	119.2
625	G	30.7	Very low	29.1	Very low	63 Å²	63	136.3 Å²	136.3	65%	0.649	70%	0.698	S	S	*	*			cis	162	157	-8.9	0	0	0	0	0	113.9
626	N	32	Very low	29.2	Very low	150 Å²	150	141.3 Å²	141.3	80%	0.802	72%	0.72	S	S	*	*			trans	71.5	138.1	167.8	-52.4	-25.3	0	0	0	117.1
627	N	30.6	Very low	29.2	Very low	119 Å²	119	143.4 Å²	143.4	64%	0.636	74%	0.736	S	S	*	*			cis	-167.6	143.3	-12.1	-110.9	-20.8	0	0	0	111.4
628	I	29.2	Very low	29.4	Very low	145 Å²	145	138.9 Å²	138.9	74%	0.744	73%	0.728	S	S	*	*			trans	64.2	133.3	139.2	-61.7	167.1	0	0	0	117.3
629	S	28.4	Very low	29.6	Very low	95 Å²	95	140.4 Å²	140.4	66%	0.664	73%	0.732	S	S	*	*			cis	-151.5	133.4	11.5	-140.2	0	0	0	0	114
630	Y	27.5	Very low	29.7	Very low	201 Å²	201	142.2 Å²	142.2	79%	0.788	73%	0.734	S	S	*	*			trans	37.9	141.4	131.5	-77.3	-79.2	0	0	0	125.6
631	N	28.7	Very low	29.8	Very low	138 Å²	138	140.9 Å²	140.9	74%	0.738	73%	0.727	S	S	*	*			trans	78.2	146.3	147.5	-61.9	-17.9	0	0	0	120.1
632	D	26.9	Very low	29.9	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	72%	0.721	S	S	*	*			cis	-169	177.8	-40.4	-144	-63.5	0	0	0	107.6
633	H	28.5	Very low	30.1	Very low	156 Å²	156	137.3 Å²	137.3	72%	0.722	71%	0.713	S	S	*	*			trans	62.8	89.4	160.3	-59.4	-6.3	0	0	0	117.6
634	R	29.2	Very low	30	Very low	227 Å²	227	137.2 Å²	137.2	86%	0.857	71%	0.709	S	S	*	*			trans	-164.6	13.3	135.3	-106.6	152.2	-162.9	-170.3	5.7	117.3	N636	R634-N636 VanDerWaalsContact C-N 3.3Å; R634-N636 PolarHBondContact O-N 3.3Å
635	N	26.7	Very low	30.1	Very low	160 Å²	160	134.4 Å²	134.4	86%	0.856	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	71.2	179	-68.7	-7	0	0	0	113
636	N	30.1	Very low	30.3	Very low	163 Å²	163	139.4 Å²	139.4	87%	0.872	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.8	6.3	171.7	-111.3	-30.5	0	0	0	116.5	R634	R634-N636 VanDerWaalsContact C-N 3.3Å; R634-N636 PolarHBondContact O-N 3.3Å
637	T	31.6	Very low	30.2	Very low	104 Å²	104	139.2 Å²	139.2	64%	0.638	69%	0.689	S	S	*	*	S	Bend	trans	-114	-14.4	-178.7	46.1	0	0	0	0	115	Q639	T637-Q639 PolarHBondContact O-N 3.16Å
638	V	33.7	Very low	30.3	Very low	94 Å²	94	137.7 Å²	137.7	57%	0.57	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-33	-168.7	-177.9	0	0	0	0	113.5	K640 N641	V638-K640 PolarHBondContact O-N 3.25Å; V638-K640 VanDerWaalsContact O-N 3.13Å; V638-N641 PolarHBondContact O-N 3.47Å
639	Q	32.5	Very low	30.4	Very low	183 Å²	183	135.8 Å²	135.8	86%	0.855	67%	0.671	S	S	*	*	H	α-helix	trans	-62.6	-22.5	-175.7	-78	-173.8	-15	0	0	114.9	T637	T637-Q639 PolarHBondContact O-N 3.16Å
640	K	31.7	Very low	30.7	Very low	167 Å²	167	137.5 Å²	137.5	73%	0.726	67%	0.673	S	S	*	*	H	α-helix	trans	-81.6	-16	179.6	-74.9	-175	174.5	179.3	0	114.4	V638 T643	V638-K640 PolarHBondContact O-N 3.25Å; V638-K640 VanDerWaalsContact O-N 3.13Å; K640-T643 PolarHBondContact O-OG1 3.45Å
641	N	30.2	Very low	30.8	Very low	101 Å²	101	133.3 Å²	133.3	54%	0.54	66%	0.664	S	S	.	*	H	α-helix	trans	-87.6	-32.1	-174.7	-68.7	-1.6	0	0	0	112.6	V638 T643 F644 I645	V638-N641 PolarHBondContact O-N 3.47Å; N641-T643 VanDerWaalsContact C-N 3.33Å; N641-T643 PolarHBondContact O-N 3.14Å; N641-F644 WeakPolarHBondContact O-CA 3.31Å; N641-F644 WeakPolarHBondContact O-CB 3.47Å; N641-F644 PolarHBondContact O-N 2.96Å; N641-I645 PolarHBondContact O-N 2.82Å
642	N	31.7	Very low	30.9	Very low	106 Å²	106	131.4 Å²	131.4	57%	0.567	65%	0.654	S	S	*	*	H	α-helix	trans	-68.9	-29.8	-178.3	-69.8	2.8	0	0	0	112.9	K646	N642-K646 PolarHBondContact O-N 2.89Å
643	T	32.9	Very low	31.2	Very low	89 Å²	89	130.2 Å²	130.2	55%	0.546	65%	0.647	S	S	.	*	H	α-helix	trans	-66.7	-37.6	167.2	39.4	0	0	0	0	112.1	K640 N641 F647	K640-T643 PolarHBondContact O-OG1 3.45Å; N641-T643 VanDerWaalsContact C-N 3.33Å; N641-T643 PolarHBondContact O-N 3.14Å; T643-F647 PolarHBondContact O-N 2.94Å
644	F	27.3	Very low	31.3	Very low	142 Å²	142	127 Å²	127	62%	0.623	64%	0.642	S	S	*	*	H	α-helix	trans	-68.2	-40.4	179.6	-123.6	-92.9	0	0	0	112.1	N641 F647 I648	N641-F644 WeakPolarHBondContact O-CA 3.31Å; N641-F644 WeakPolarHBondContact O-CB 3.47Å; N641-F644 PolarHBondContact O-N 2.96Å; F644-F647 PolarHBondContact O-N 3.45Å; F644-I648 HydrophobicContact CD1-CD1 4.12Å; F644-I648 WeakPolarHBondContact O-CG1 3.21Å; F644-I648 PolarHBondContact O-N 2.89Å
645	I	32.8	Very low	31.3	Very low	93 Å²	93	119.4 Å²	119.4	48%	0.477	62%	0.623	S	S	.	*	H	α-helix	trans	-66	-39.9	178.6	-65.9	167.3	0	0	0	111.5	N641 F647 I648 N649	N641-I645 PolarHBondContact O-N 2.82Å; I645-F647 VanDerWaalsContact C-N 3.33Å; I645-F647 PolarHBondContact O-N 3.45Å; I645-I648 PolarHBondContact O-N 3.16Å; I645-N649 PolarHBondContact O-N 2.99Å
646	K	33.8	Very low	31.5	Very low	168 Å²	168	113.4 Å²	113.4	73%	0.73	59%	0.594	S	S	*	*	H	α-helix	trans	-63	-36.6	171.8	-81.9	-171.7	172	-177	0	112.7	N642 N650	N642-K646 PolarHBondContact O-N 2.89Å; K646-N650 PolarHBondContact O-N 2.88Å
647	F	29.8	Very low	31.6	Very low	147 Å²	147	108.2 Å²	108.2	65%	0.645	57%	0.568	S	S	*	*	H	α-helix	trans	-69.4	-35	173.2	-99.4	-86.5	0	0	0	113.4	T643 F644 I645 N651	T643-F647 PolarHBondContact O-N 2.94Å; F644-F647 PolarHBondContact O-N 3.45Å; I645-F647 VanDerWaalsContact C-N 3.33Å; I645-F647 PolarHBondContact O-N 3.45Å; F647-N651 WeakPolarHBondContact O-CB 3.41Å; F647-N651 PolarHBondContact O-N 2.77Å; F647-N651 PolarHBondContact O-ND2 3.01Å
648	I	32.5	Very low	31.5	Very low	87 Å²	87	104.4 Å²	104.4	45%	0.446	55%	0.546	S	S	.	.	H	α-helix	trans	-67.7	-45.2	177.3	-72.3	164.5	0	0	0	110.8	F644 I645 N650 N651 N652	F644-I648 HydrophobicContact CD1-CD1 4.12Å; F644-I648 WeakPolarHBondContact O-CG1 3.21Å; F644-I648 PolarHBondContact O-N 2.89Å; I645-I648 PolarHBondContact O-N 3.16Å; I648-N650 VanDerWaalsContact C-N 3.34Å; I648-N650 PolarHBondContact O-N 3.35Å; I648-N651 CarbonylContact O-C 3.58Å; I648-N651 WeakPolarHBondContact O-CA 3.46Å; I648-N651 PolarHBondContact O-N 3.08Å; I648-N652 PolarHBondContact O-N 2.88Å
649	N	31.7	Very low	31.7	Very low	104 Å²	104	101.5 Å²	101.5	56%	0.556	53%	0.527	S	S	*	.	H	α-helix	trans	-64.7	-36.4	178.3	-76.9	0.6	0	0	0	112.6	I645 N651 N652	I645-N649 PolarHBondContact O-N 2.99Å; N649-N651 PolarHBondContact O-N 2.87Å; N649-N652 PolarHBondContact O-N 2.86Å
650	N	35.7	Very low	31.9	Very low	131 Å²	131	96.3 Å²	96.3	70%	0.701	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-12.8	171.9	-77.8	16.2	0	0	0	113.9	K646 I648 N653	K646-N650 PolarHBondContact O-N 2.88Å; I648-N650 VanDerWaalsContact C-N 3.34Å; I648-N650 PolarHBondContact O-N 3.35Å; N650-N653 PolarHBondContact O-ND2 3.39Å
651	N	29.7	Very low	32.5	Very low	113 Å²	113	91.7 Å²	91.7	60%	0.604	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	0.8	175.2	-78.9	-21.1	0	0	0	113.5	F647 I648 N649 N653	F647-N651 WeakPolarHBondContact O-CB 3.41Å; F647-N651 PolarHBondContact O-N 2.77Å; F647-N651 PolarHBondContact O-ND2 3.01Å; I648-N651 CarbonylContact O-C 3.58Å; I648-N651 WeakPolarHBondContact O-CA 3.46Å; I648-N651 PolarHBondContact O-N 3.08Å; N649-N651 PolarHBondContact O-N 2.87Å; N651-N653 PolarHBondContact O-N 2.85Å
652	N	30.5	Very low	33.9	Very low	99 Å²	99	87.9 Å²	87.9	53%	0.529	48%	0.475	S	S	.	.			trans	-73.5	51.5	169.3	-72.9	-26	0	0	0	111.9	I648 N649 S654	I648-N652 PolarHBondContact O-N 2.88Å; N649-N652 PolarHBondContact O-N 2.86Å; N652-S654 PolarHBondContact O-N 3.27Å
653	N	32.1	Very low	36.2	Very low	100 Å²	100	82.9 Å²	82.9	54%	0.535	45%	0.448	S	S	.	.			trans	-72.5	64.7	172.2	-67.1	-66.1	0	0	0	110	N650 N651	N650-N653 PolarHBondContact O-ND2 3.39Å; N651-N653 PolarHBondContact O-N 2.85Å
654	S	31.4	Very low	38.7	Very low	88 Å²	88	83.6 Å²	83.6	62%	0.615	44%	0.441	S	S	*	.			trans	-61.6	141.4	172.5	-170.3	0	0	0	0	109.6	N652 C656	N652-S654 PolarHBondContact O-N 3.27Å; S654-C656 PolarHBondContact O-N 3.42Å; S654-C656 PolarHBondContact O-SG 3.42Å
655	C	28	Very low	41.8	Very low	68 Å²	68	76.9 Å²	76.9	46%	0.459	41%	0.412	S	S	.	.			trans	-71.1	87.1	-173.2	-166.8	0	0	0	0	110.9	T657	C655-T657 VanDerWaalsContact C-N 3.27Å; C655-T657 PolarHBondContact O-N 3.47Å
656	C	31.8	Very low	44.6	Very low	34 Å²	34	74.1 Å²	74.1	23%	0.23	40%	0.395	C	S	.	.			trans	-76.2	70.1	-175.1	-65.5	0	0	0	0	112.4	S654 N661	S654-C656 PolarHBondContact O-N 3.42Å; S654-C656 PolarHBondContact O-SG 3.42Å; C656-N661 PolarHBondContact SG-ND2 3.47Å; C656-N661 VanDerWaalsContact SG-ND2 3.39Å
657	T	32.1	Very low	47.3	Very low	54 Å²	54	66.1 Å²	66.1	33%	0.331	36%	0.361	S	S	.	.			trans	-96.5	-9.7	173.9	49.1	0	0	0	0	114	Q580 C655 Y786 Q822	Q580-T657 PolarHBondContact NE2-OG1 2.92Å; C655-T657 VanDerWaalsContact C-N 3.27Å; C655-T657 PolarHBondContact O-N 3.47Å; T657-Y786 PolarHBondContact OG1-OH 3.37Å; T657-Q822 PolarHBondContact O-NE2 2.81Å
658	S	30.4	Very low	50.1	Low	25 Å²	25	59.8 Å²	59.8	18%	0.175	34%	0.335	C	S	.	.	S	Bend	trans	-82	142.7	169.2	56.7	0	0	0	0	111.2	S660	S658-S660 PolarHBondContact O-N 2.84Å; S658-S660 PolarHBondContact OG-OG 3.2Å
659	L	37.7	Very low	52.6	Low	32 Å²	32	57.4 Å²	57.4	17%	0.168	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-79.2	1.2	178.4	-80.2	93.9	0	0	0	113.9	N661 S662 F782 N783	L659-N661 PolarHBondContact O-N 3.03Å; L659-N661 VanDerWaalsContact O-N 3.11Å; L659-S662 WeakPolarHBondContact CA-OG 3.38Å; L659-S662 WeakPolarHBondContact CB-OG 3.31Å; L659-S662 VanDerWaalsContact O-CB 3.26Å; L659-S662 WeakPolarHBondContact O-CB 3.15Å; L659-S662 PolarHBondContact O-N 3.43Å; L659-S662 PolarHBondContact O-OG 2.76Å; L659-F782 HydrophobicContact CB-CB 3.92Å; L659-F782 HydrophobicContact CD1-CB 4.11Å; L659-F782 HydrophobicContact CD1-CD1 3.7Å; L659-F782 HydrophobicContact CD1-CE1 4.43Å; L659-F782 HydrophobicContact CD1-CG 4.19Å; L659-F782 HydrophobicContact CD2-CB 3.91Å; L659-F782 HydrophobicContact CD2-CD1 3.71Å; L659-F782 HydrophobicContact CD2-CD2 4.03Å; L659-F782 HydrophobicContact CD2-CE1 4.15Å; L659-F782 HydrophobicContact CD2-CE2 4.47Å; L659-F782 HydrophobicContact CD2-CG 3.65Å; L659-F782 HydrophobicContact CG-CB 4.18Å; L659-F782 HydrophobicContact CG-CD1 4.27Å; L659-F782 HydrophobicContact CG-CG 4.34Å; L659-N783 WeakPolarHBondContact CA-OD1 3.33Å
660	S	35.3	Very low	55	Low	74 Å²	74	60.5 Å²	60.5	52%	0.517	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-53.5	-29.6	168	55.3	0	0	0	0	111.9	S658 N783	S658-S660 PolarHBondContact O-N 2.84Å; S658-S660 PolarHBondContact OG-OG 3.2Å; S660-N783 PolarHBondContact N-OD1 3.28Å
661	N	45.9	Very low	57.4	Low	71 Å²	71	57.6 Å²	57.6	38%	0.38	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-103	22.4	-176.5	-57.3	20.9	0	0	0	111.7	C656 L659 C663	C656-N661 PolarHBondContact SG-ND2 3.47Å; C656-N661 VanDerWaalsContact SG-ND2 3.39Å; L659-N661 PolarHBondContact O-N 3.03Å; L659-N661 VanDerWaalsContact O-N 3.11Å; N661-C663 PolarHBondContact O-N 3.15Å; N661-C663 VanDerWaalsContact O-N 3.13Å
662	S	59.2	Low	60.2	Low	21 Å²	21	53 Å²	53	15%	0.147	29%	0.293	C	S	.	.			trans	-70.5	104.3	179.2	-59.7	0	0	0	0	110.9	L659 R664 H821	L659-S662 WeakPolarHBondContact CA-OG 3.38Å; L659-S662 WeakPolarHBondContact CB-OG 3.31Å; L659-S662 VanDerWaalsContact O-CB 3.26Å; L659-S662 WeakPolarHBondContact O-CB 3.15Å; L659-S662 PolarHBondContact O-N 3.43Å; L659-S662 PolarHBondContact O-OG 2.76Å; S662-R664 PolarHBondContact O-N 3.34Å; S662-H821 CarbonylContact C-O 3.57Å; S662-H821 WeakPolarHBondContact CA-O 3.32Å
663	C	79.1	Confident	63.2	Low	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	120.8	-175.5	-55.2	0	0	0	0	111.1	N661 D680 F681 Q684 H821	N661-C663 PolarHBondContact O-N 3.15Å; N661-C663 VanDerWaalsContact O-N 3.13Å; C663-D680 HydrophobicContact CB-CB 4.34Å; C663-F681 HydrophobicContact CB-CB 3.74Å; C663-F681 HydrophobicContact CB-CD2 3.82Å; C663-F681 HydrophobicContact CB-CG 4.28Å; C663-Q684 PolarHBondContact SG-NE2 3.38Å; C663-H821 HydrophobicContact CB-CB 4.44Å; C663-H821 PolarHBondContact N-O 2.78Å; C663-H821 PolarHBondContact O-CD2 3.46Å; C663-H821 PolarHBondContact O-N 2.92Å
664	R	86.5	Confident	66	Low	105 Å²	105	46.8 Å²	46.8	40%	0.396	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	139	-177	-58.1	-176.5	-172.2	130.9	3.5	112.3	S662 Y666 A678 C819	S662-R664 PolarHBondContact O-N 3.34Å; R664-Y666 HydrophobicContact CB-CE2 4.44Å; R664-A678 HydrophobicContact CB-CB 4.06Å; R664-A678 VanDerWaalsContact O-CB 3.27Å; R664-A678 WeakPolarHBondContact O-CB 3.43Å; R664-A678 PolarHBondContact O-N 3.12Å; R664-C819 CarbonylContact C-O 3.45Å; R664-C819 WeakPolarHBondContact CA-O 3.36Å
665	T	91.4	Very high	68.8	Low	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	145.6	172.2	68.9	0	0	0	0	109.8	H667 F674 I677 F681 C819 H821	T665-H667 PolarHBondContact OG1-NE2 2.93Å; T665-F674 HydrophobicContact CG2-CE1 3.99Å; T665-I677 HydrophobicContact CG2-CG2 4.23Å; T665-F681 HydrophobicContact CG2-CB 4.03Å; T665-F681 HydrophobicContact CG2-CD1 3.89Å; T665-F681 HydrophobicContact CG2-CD2 3.43Å; T665-F681 VanDerWaalsContact CG2-CD2 3.43Å; T665-F681 HydrophobicContact CG2-CE1 4.18Å; T665-F681 HydrophobicContact CG2-CE2 3.76Å; T665-F681 HydrophobicContact CG2-CG 3.49Å; T665-F681 VanDerWaalsContact CG2-CG 3.49Å; T665-F681 HydrophobicContact CG2-CZ 4.12Å; T665-C819 PolarHBondContact N-O 3.01Å; T665-C819 PolarHBondContact O-N 2.65Å; T665-C819 WeakPolarHBondContact OG1-CB 3.36Å; T665-H821 PolarHBondContact OG1-CD2 2.81Å; T665-H821 PolarHBondContact OG1-NE2 3.18Å
666	Y	91.2	Very high	71.7	Confident	35 Å²	35	43 Å²	43	14%	0.137	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126	-173.6	-58.9	-91.9	0	0	0	109.5	R664 I675 D676 F808 V818	R664-Y666 HydrophobicContact CB-CE2 4.44Å; Y666-I675 PolarHBondContact O-N 3.04Å; Y666-D676 HydrophobicContact CD2-CB 3.89Å; Y666-D676 HydrophobicContact CG-CB 4.36Å; Y666-D676 PolarHBondContact N-O 2.78Å; Y666-D676 PolarHBondContact O-N 3.35Å; Y666-F808 HydrophobicContact CD1-CZ 4.31Å; Y666-V818 HydrophobicContact CD1-CG1 4.24Å; Y666-V818 HydrophobicContact CD1-CG2 3.99Å; Y666-V818 HydrophobicContact CE1-CG1 4.03Å; Y666-V818 HydrophobicContact CE1-CG2 4.17Å
667	H	91.4	Very high	74.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	150.2	-172.3	-54.2	-92.7	0	0	0	112.8	T665 L672 Q673 F674 L817	T665-H667 PolarHBondContact OG1-NE2 2.93Å; H667-L672 PolarHBondContact ND1-O 3.3Å; H667-Q673 VanDerWaalsContact CA-O 3.24Å; H667-Q673 WeakPolarHBondContact CA-O 3.46Å; H667-F674 AromaticContact CE1-CD1 3.41Å; H667-F674 VanDerWaalsContact CE1-CD1 3.41Å; H667-F674 WeakPolarHBondContact CE1-CD1 3.14Å; H667-F674 AromaticContact CE1-CE1 3.35Å; H667-F674 WeakPolarHBondContact CE1-CE1 3.29Å; H667-F674 AromaticContact CE1-CG 3.94Å; H667-F674 AromaticContact CE1-CZ 3.78Å; H667-F674 AromaticContact ND1-CD1 3.99Å; H667-L817 HydrophobicContact CB-CB 4.28Å; H667-L817 PolarHBondContact N-O 3.22Å; H667-L817 PolarHBondContact O-N 2.78Å
668	S	89	Confident	77.1	Confident	15 Å²	15	40 Å²	40	11%	0.105	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	131	169.3	-163.2	0	0	0	0	110.6	K670 N671 L672 Q673 S813	S668-K670 PolarHBondContact O-N 3.17Å; S668-K670 VanDerWaalsContact O-N 3.14Å; S668-N671 WeakPolarHBondContact CB-OD1 3.44Å; S668-N671 PolarHBondContact O-N 2.85Å; S668-L672 VanDerWaalsContact O-CA 3.31Å; S668-L672 WeakPolarHBondContact O-CA 3.23Å; S668-L672 PolarHBondContact O-N 3.26Å; S668-Q673 PolarHBondContact N-O 3.33Å; S668-S813 PolarHBondContact OG-OG 3.47Å
669	T	84	Confident	79.6	Confident	37 Å²	37	43.9 Å²	43.9	23%	0.227	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.9	-178.1	54.1	0	0	0	0	113.8	Y745 E815 L817	T669-Y745 HydrophobicContact CG2-CD2 3.96Å; T669-Y745 HydrophobicContact CG2-CE2 3.55Å; T669-E815 HydrophobicContact CG2-CB 3.89Å; T669-L817 HydrophobicContact CG2-CB 4.32Å
670	K	82	Confident	81.8	Confident	168 Å²	168	46.4 Å²	46.4	73%	0.73	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-24.7	-174.2	-65.8	-178.5	179.4	176.2	0	114.9	S668	S668-K670 PolarHBondContact O-N 3.17Å; S668-K670 VanDerWaalsContact O-N 3.14Å
671	N	86.4	Confident	84.3	Confident	71 Å²	71	42.9 Å²	42.9	38%	0.38	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-150.1	3.6	-172.1	66.5	7.8	0	0	0	114.4	S668 Q673 C696	S668-N671 WeakPolarHBondContact CB-OD1 3.44Å; S668-N671 PolarHBondContact O-N 2.85Å; N671-Q673 PolarHBondContact ND2-OE1 3.4Å; N671-Q673 PolarHBondContact O-N 3.09Å; N671-Q673 VanDerWaalsContact O-N 3.16Å; N671-Q673 WeakPolarHBondContact OD1-CB 3.33Å; N671-Q673 WeakPolarHBondContact OD1-CG 3.24Å; N671-Q673 PolarHBondContact OD1-N 2.92Å; N671-Q673 VanDerWaalsContact OD1-N 3.08Å; N671-C696 PolarHBondContact O-SG 2.81Å
672	L	89.9	Confident	86.4	Confident	17 Å²	17	40.5 Å²	40.5	9%	0.089	20%	0.203	C	C	.	.			trans	54.7	30.7	179.4	-55.4	168.3	0	0	0	113.6	H667 S668 C696 L697 F698 I713 L817	H667-L672 PolarHBondContact ND1-O 3.3Å; S668-L672 VanDerWaalsContact O-CA 3.31Å; S668-L672 WeakPolarHBondContact O-CA 3.23Å; S668-L672 PolarHBondContact O-N 3.26Å; L672-C696 CarbonylContact O-C 3.59Å; L672-C696 WeakPolarHBondContact O-CA 3.26Å; L672-L697 HydrophobicContact CB-CB 4.45Å; L672-L697 PolarHBondContact O-N 3.44Å; L672-F698 HydrophobicContact CD1-CD2 4.05Å; L672-F698 HydrophobicContact CD1-CE1 4.21Å; L672-F698 HydrophobicContact CD1-CE2 3.38Å; L672-F698 HydrophobicContact CD1-CZ 3.46Å; L672-F698 VanDerWaalsContact CD1-CZ 3.46Å; L672-I713 HydrophobicContact CD1-CD1 3.86Å; L672-I713 HydrophobicContact CD1-CG2 4.17Å; L672-I713 HydrophobicContact CD2-CD1 4.35Å; L672-I713 HydrophobicContact CD2-CG2 3.96Å; L672-L817 HydrophobicContact CD2-CD2 3.52Å
673	Q	91.9	Very high	87.7	Confident	65 Å²	65	45.7 Å²	45.7	30%	0.304	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-75.9	137.1	171.6	-76.3	-179.5	-38.7	0	0	111.3	H667 S668 N671 I675 N694 K695	H667-Q673 VanDerWaalsContact CA-O 3.24Å; H667-Q673 WeakPolarHBondContact CA-O 3.46Å; S668-Q673 PolarHBondContact N-O 3.33Å; N671-Q673 PolarHBondContact ND2-OE1 3.4Å; N671-Q673 PolarHBondContact O-N 3.09Å; N671-Q673 VanDerWaalsContact O-N 3.16Å; N671-Q673 WeakPolarHBondContact OD1-CB 3.33Å; N671-Q673 WeakPolarHBondContact OD1-CG 3.24Å; N671-Q673 PolarHBondContact OD1-N 2.92Å; N671-Q673 VanDerWaalsContact OD1-N 3.08Å; Q673-I675 PolarHBondContact O-N 3.36Å; Q673-I675 VanDerWaalsContact O-N 3.14Å; Q673-N694 WeakPolarHBondContact CG-O 3.46Å; Q673-N694 PolarHBondContact NE2-O 2.9Å; Q673-K695 WeakPolarHBondContact CA-O 3.39Å
674	F	91.9	Very high	87.8	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	115.2	170.3	-66.8	-88.3	0	0	0	110.4	T665 H667 I677 F681 L692 N694 K695 L697 L700	T665-F674 HydrophobicContact CG2-CE1 3.99Å; H667-F674 AromaticContact CE1-CD1 3.41Å; H667-F674 VanDerWaalsContact CE1-CD1 3.41Å; H667-F674 WeakPolarHBondContact CE1-CD1 3.14Å; H667-F674 AromaticContact CE1-CE1 3.35Å; H667-F674 WeakPolarHBondContact CE1-CE1 3.29Å; H667-F674 AromaticContact CE1-CG 3.94Å; H667-F674 AromaticContact CE1-CZ 3.78Å; H667-F674 AromaticContact ND1-CD1 3.99Å; F674-I677 HydrophobicContact CB-CD1 4.06Å; F674-I677 HydrophobicContact CB-CG1 4.25Å; F674-I677 HydrophobicContact CD1-CD1 4.42Å; F674-I677 HydrophobicContact CD1-CG1 3.7Å; F674-I677 HydrophobicContact CE1-CG1 4.41Å; F674-I677 HydrophobicContact CG-CG1 4.26Å; F674-F681 HydrophobicContact CE1-CE1 4.34Å; F674-F681 HydrophobicContact CZ-CE1 4.48Å; F674-L692 WeakPolarHBondContact CB-O 3.47Å; F674-L692 HydrophobicContact CD2-CB 4.15Å; F674-L692 HydrophobicContact CD2-CD2 4.49Å; F674-L692 WeakPolarHBondContact CD2-O 3.15Å; F674-L692 HydrophobicContact CE1-CD1 4.47Å; F674-L692 HydrophobicContact CE2-CD2 4.11Å; F674-L692 HydrophobicContact CG-CB 4.21Å; F674-L692 HydrophobicContact CZ-CD2 4.39Å; F674-N694 PolarHBondContact O-N 2.83Å; F674-N694 VanDerWaalsContact O-N 3.17Å; F674-K695 HydrophobicContact CD2-CB 4.48Å; F674-K695 WeakPolarHBondContact CD2-O 3.32Å; F674-K695 PolarHBondContact N-O 3.23Å; F674-L697 HydrophobicContact CZ-CD1 3.98Å; F674-L700 HydrophobicContact CE2-CD1 3.86Å; F674-L700 HydrophobicContact CE2-CG 4.39Å; F674-L700 HydrophobicContact CZ-CD1 3.63Å
675	I	90.6	Very high	87.9	Confident	49 Å²	49	43.7 Å²	43.7	25%	0.251	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-43.2	169.4	-67.8	168.8	0	0	0	109.5	Y666 Q673 L693 L816	Y666-I675 PolarHBondContact O-N 3.04Å; Q673-I675 PolarHBondContact O-N 3.36Å; Q673-I675 VanDerWaalsContact O-N 3.14Å; I675-L693 WeakPolarHBondContact O-CD2 3.35Å; I675-L816 HydrophobicContact CD1-CD2 3.49Å; I675-L816 VanDerWaalsContact CD1-CD2 3.49Å
676	D	88.3	Confident	87.7	Confident	28 Å²	28	45.8 Å²	45.8	15%	0.15	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	158.8	175.5	-158.6	9.9	0	0	0	112.5	Y666 K689	Y666-D676 HydrophobicContact CD2-CB 3.89Å; Y666-D676 HydrophobicContact CG-CB 4.36Å; Y666-D676 PolarHBondContact N-O 2.78Å; Y666-D676 PolarHBondContact O-N 3.35Å; D676-K689 WeakPolarHBondContact OD1-CE 3.48Å; D676-K689 IonicContact OD1-NZ 2.71Å; D676-K689 PolarHBondContact OD1-NZ 3.15Å; D676-K689 IonicContact OD2-NZ 2.59Å
677	I	89.4	Confident	87.8	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.015	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	124	-172.9	-50.3	96.4	0	0	0	109.3	T665 F674 F681 L682 K689 L692 L693	T665-I677 HydrophobicContact CG2-CG2 4.23Å; F674-I677 HydrophobicContact CB-CD1 4.06Å; F674-I677 HydrophobicContact CB-CG1 4.25Å; F674-I677 HydrophobicContact CD1-CD1 4.42Å; F674-I677 HydrophobicContact CD1-CG1 3.7Å; F674-I677 HydrophobicContact CE1-CG1 4.41Å; F674-I677 HydrophobicContact CG-CG1 4.26Å; I677-F681 HydrophobicContact CG2-CB 3.7Å; I677-F681 HydrophobicContact CG2-CD1 3.64Å; I677-F681 HydrophobicContact CG2-CG 3.99Å; I677-L682 HydrophobicContact CB-CD2 4.02Å; I677-L682 HydrophobicContact CB-CG 4.4Å; I677-L682 HydrophobicContact CG2-CD2 3.51Å; I677-L682 HydrophobicContact CG2-CG 3.82Å; I677-K689 HydrophobicContact CD1-CG 4.13Å; I677-L692 HydrophobicContact CD1-CB 3.89Å; I677-L692 HydrophobicContact CG1-CB 4.14Å; I677-L692 HydrophobicContact CG1-CD1 4.09Å; I677-L692 HydrophobicContact CG2-CD1 4.17Å; I677-L693 HydrophobicContact CD1-CD2 3.81Å; I677-L693 HydrophobicContact CD1-CG 4.06Å
678	A	87.7	Confident	87.7	Confident	22 Å²	22	48 Å²	48	18%	0.182	26%	0.259	C	S	.	.			trans	-70.2	147.2	173.9	0	0	0	0	0	111.6	R664 D680 F681 L682	R664-A678 HydrophobicContact CB-CB 4.06Å; R664-A678 VanDerWaalsContact O-CB 3.27Å; R664-A678 WeakPolarHBondContact O-CB 3.43Å; R664-A678 PolarHBondContact O-N 3.12Å; A678-D680 PolarHBondContact O-N 3.27Å; A678-D680 VanDerWaalsContact O-N 3.14Å; A678-F681 WeakPolarHBondContact O-CB 3.28Å; A678-F681 PolarHBondContact O-N 3.18Å; A678-L682 PolarHBondContact O-N 3.12Å
679	N	83	Confident	87.8	Confident	106 Å²	106	51.4 Å²	51.4	57%	0.567	27%	0.273	S	S	*	.	H	α-helix	trans	-56.9	-33.9	-173.7	-74.1	-33.8	0	0	0	113.7	F681 L682 I683	N679-F681 VanDerWaalsContact C-N 3.29Å; N679-F681 PolarHBondContact O-N 3.04Å; N679-L682 WeakPolarHBondContact O-CB 3.37Å; N679-L682 PolarHBondContact O-N 3.35Å; N679-L682 VanDerWaalsContact O-N 3.12Å; N679-I683 WeakPolarHBondContact O-CG1 3.5Å; N679-I683 PolarHBondContact O-N 3.19Å
680	D	83.4	Confident	88	Confident	85 Å²	85	55.9 Å²	55.9	46%	0.455	30%	0.299	S	S	.	.	H	α-helix	trans	-61.4	-36.8	177.2	-55.2	-49.8	0	0	0	112.5	C663 A678 I683 Q684	C663-D680 HydrophobicContact CB-CB 4.34Å; A678-D680 PolarHBondContact O-N 3.27Å; A678-D680 VanDerWaalsContact O-N 3.14Å; D680-I683 PolarHBondContact O-N 2.65Å; D680-Q684 WeakPolarHBondContact O-CB 3.42Å; D680-Q684 WeakPolarHBondContact O-CG 3.42Å; D680-Q684 PolarHBondContact O-N 3.04Å
681	F	87.9	Confident	88.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.2	-41.8	175.5	-167.9	-91.2	0	0	0	110.6	C663 T665 F674 I677 A678 N679 S685 L692 L700 L729 H821	C663-F681 HydrophobicContact CB-CB 3.74Å; C663-F681 HydrophobicContact CB-CD2 3.82Å; C663-F681 HydrophobicContact CB-CG 4.28Å; T665-F681 HydrophobicContact CG2-CB 4.03Å; T665-F681 HydrophobicContact CG2-CD1 3.89Å; T665-F681 HydrophobicContact CG2-CD2 3.43Å; T665-F681 VanDerWaalsContact CG2-CD2 3.43Å; T665-F681 HydrophobicContact CG2-CE1 4.18Å; T665-F681 HydrophobicContact CG2-CE2 3.76Å; T665-F681 HydrophobicContact CG2-CG 3.49Å; T665-F681 VanDerWaalsContact CG2-CG 3.49Å; T665-F681 HydrophobicContact CG2-CZ 4.12Å; F674-F681 HydrophobicContact CE1-CE1 4.34Å; F674-F681 HydrophobicContact CZ-CE1 4.48Å; I677-F681 HydrophobicContact CG2-CB 3.7Å; I677-F681 HydrophobicContact CG2-CD1 3.64Å; I677-F681 HydrophobicContact CG2-CG 3.99Å; A678-F681 WeakPolarHBondContact O-CB 3.28Å; A678-F681 PolarHBondContact O-N 3.18Å; N679-F681 VanDerWaalsContact C-N 3.29Å; N679-F681 PolarHBondContact O-N 3.04Å; F681-S685 WeakPolarHBondContact O-CB 3.48Å; F681-S685 PolarHBondContact O-N 3.31Å; F681-S685 PolarHBondContact O-OG 2.86Å; F681-L692 HydrophobicContact CD1-CD1 3.85Å; F681-L692 HydrophobicContact CE1-CD1 3.69Å; F681-L700 HydrophobicContact CZ-CD1 4.47Å; F681-L729 HydrophobicContact CE2-CD2 4.02Å; F681-L729 HydrophobicContact CZ-CD2 3.92Å; F681-H821 HydrophobicContact CD2-CB 4.31Å; F681-H821 AromaticContact CD2-CD2 3.94Å; F681-H821 HydrophobicContact CE2-CB 4.18Å; F681-H821 AromaticContact CE2-CD2 3.72Å; F681-H821 AromaticContact CE2-CE1 3.94Å; F681-H821 AromaticContact CE2-CG 3.68Å; F681-H821 AromaticContact CE2-ND1 3.82Å; F681-H821 AromaticContact CE2-NE2 3.89Å
682	L	89.5	Confident	88.6	Confident	21 Å²	21	46.3 Å²	46.3	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-62.1	-46.2	177.8	-59.4	179.9	0	0	0	110.9	I677 A678 N679 G686 Y687 K689 L692	I677-L682 HydrophobicContact CB-CD2 4.02Å; I677-L682 HydrophobicContact CB-CG 4.4Å; I677-L682 HydrophobicContact CG2-CD2 3.51Å; I677-L682 HydrophobicContact CG2-CG 3.82Å; A678-L682 PolarHBondContact O-N 3.12Å; N679-L682 WeakPolarHBondContact O-CB 3.37Å; N679-L682 PolarHBondContact O-N 3.35Å; N679-L682 VanDerWaalsContact O-N 3.12Å; L682-G686 CarbonylContact O-C 3.58Å; L682-G686 WeakPolarHBondContact O-CA 3.45Å; L682-G686 PolarHBondContact O-N 3.12Å; L682-Y687 WeakPolarHBondContact CA-O 3.42Å; L682-Y687 VanDerWaalsContact CB-O 3.31Å; L682-Y687 WeakPolarHBondContact CB-O 3.42Å; L682-Y687 WeakPolarHBondContact CD2-O 3.31Å; L682-Y687 PolarHBondContact O-N 3.45Å; L682-K689 HydrophobicContact CD1-CB 3.98Å; L682-L692 HydrophobicContact CD2-CD1 3.97Å
683	I	86	Confident	88.5	Confident	131 Å²	131	48.4 Å²	48.4	67%	0.672	27%	0.267	S	S	*	.	H	α-helix	trans	-62.7	-50.4	178.4	-66.5	164.1	0	0	0	111.2	N679 D680	N679-I683 WeakPolarHBondContact O-CG1 3.5Å; N679-I683 PolarHBondContact O-N 3.19Å; D680-I683 PolarHBondContact O-N 2.65Å
684	Q	83.2	Confident	88	Confident	59 Å²	59	50.9 Å²	50.9	28%	0.276	28%	0.282	S	S	.	.	H	α-helix	trans	-75.9	-32.2	-175.7	-64.2	-177.2	28.4	0	0	113.5	C663 D680 L823	C663-Q684 PolarHBondContact SG-NE2 3.38Å; D680-Q684 WeakPolarHBondContact O-CB 3.42Å; D680-Q684 WeakPolarHBondContact O-CG 3.42Å; D680-Q684 PolarHBondContact O-N 3.04Å; Q684-L823 HydrophobicContact CB-CD1 3.78Å
685	S	87.3	Confident	88	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-81.4	-20.4	176.6	69.8	0	0	0	0	113.7	F681 Y687 K732	F681-S685 WeakPolarHBondContact O-CB 3.48Å; F681-S685 PolarHBondContact O-N 3.31Å; F681-S685 PolarHBondContact O-OG 2.86Å; S685-Y687 PolarHBondContact O-N 3Å; S685-Y687 WeakPolarHBondContact OG-CD2 3.32Å; S685-Y687 PolarHBondContact OG-N 3.49Å; S685-K732 PolarHBondContact O-N 2.9Å
686	G	88.3	Confident	88	Confident	45 Å²	45	53.6 Å²	53.6	46%	0.464	30%	0.295	S	S	.	.			trans	76.2	0.9	-172.6	0	0	0	0	0	114.5	L682 K732	L682-G686 CarbonylContact O-C 3.58Å; L682-G686 WeakPolarHBondContact O-CA 3.45Å; L682-G686 PolarHBondContact O-N 3.12Å; G686-K732 WeakPolarHBondContact O-CB 3.5Å; G686-K732 WeakPolarHBondContact O-CD 3.45Å
687	Y	91.9	Very high	88.2	Confident	23 Å²	23	52.3 Å²	52.3	9%	0.09	29%	0.288	C	S	.	.			trans	-79.7	148	176	-68.6	-66.2	0	0	0	112.1	L682 S685 D691 L692 L700 R730 L731 K732	L682-Y687 WeakPolarHBondContact CA-O 3.42Å; L682-Y687 VanDerWaalsContact CB-O 3.31Å; L682-Y687 WeakPolarHBondContact CB-O 3.42Å; L682-Y687 WeakPolarHBondContact CD2-O 3.31Å; L682-Y687 PolarHBondContact O-N 3.45Å; S685-Y687 PolarHBondContact O-N 3Å; S685-Y687 WeakPolarHBondContact OG-CD2 3.32Å; S685-Y687 PolarHBondContact OG-N 3.49Å; Y687-D691 HydrophobicContact CD1-CB 3.8Å; Y687-D691 HydrophobicContact CG-CB 4.39Å; Y687-L692 HydrophobicContact CD1-CD2 4.27Å; Y687-L692 HydrophobicContact CD2-CD1 4.24Å; Y687-L692 HydrophobicContact CD2-CD2 3.73Å; Y687-L692 HydrophobicContact CD2-CG 4.25Å; Y687-L692 HydrophobicContact CE2-CD2 4.23Å; Y687-L692 HydrophobicContact CG-CD1 4.28Å; Y687-L692 HydrophobicContact CG-CD2 3.77Å; Y687-L692 HydrophobicContact CG-CG 4Å; Y687-L700 HydrophobicContact CE2-CD1 4.19Å; Y687-L700 HydrophobicContact CE2-CD2 3.84Å; Y687-R730 WeakPolarHBondContact CE2-O 3.18Å; Y687-R730 PolarHBondContact OH-O 2.87Å; Y687-L731 PolarHBondContact OH-O 2.87Å; Y687-K732 HydrophobicContact CD1-CB 3.62Å; Y687-K732 HydrophobicContact CD1-CD 4.06Å; Y687-K732 HydrophobicContact CD1-CG 3.87Å; Y687-K732 HydrophobicContact CE1-CB 3.67Å; Y687-K732 HydrophobicContact CE1-CG 3.96Å; Y687-K732 HydrophobicContact CG-CB 4.09Å
688	T	90.5	Very high	88.4	Confident	57 Å²	57	55 Å²	55	35%	0.35	30%	0.3	S	S	.	.			trans	-83.8	161.6	163.5	70.9	0	0	0	0	110.2	V690 D691 L692	T688-V690 PolarHBondContact O-N 2.76Å; T688-D691 WeakPolarHBondContact CA-OD2 3.49Å; T688-D691 VanDerWaalsContact CB-OD2 3.29Å; T688-D691 WeakPolarHBondContact CB-OD2 3.44Å; T688-D691 WeakPolarHBondContact CG2-OD2 3.23Å; T688-D691 PolarHBondContact N-OD2 2.85Å; T688-D691 WeakPolarHBondContact O-CB 3.48Å; T688-D691 PolarHBondContact O-N 2.76Å; T688-D691 VanDerWaalsContact OG1-CG 3.24Å; T688-D691 PolarHBondContact OG1-N 2.92Å; T688-D691 VanDerWaalsContact OG1-N 3.14Å; T688-D691 PolarHBondContact OG1-OD2 2.93Å; T688-L692 PolarHBondContact O-N 2.95Å
689	K	90.5	Very high	88.6	Confident	88 Å²	88	57.9 Å²	57.9	38%	0.383	31%	0.312	S	S	.	.	H	α-helix	trans	-56	-38.6	174.7	-163.6	164.4	-175.4	156.6	0	111.7	D676 I677 L682 D691 L692 L693	D676-K689 WeakPolarHBondContact OD1-CE 3.48Å; D676-K689 IonicContact OD1-NZ 2.71Å; D676-K689 PolarHBondContact OD1-NZ 3.15Å; D676-K689 IonicContact OD2-NZ 2.59Å; I677-K689 HydrophobicContact CD1-CG 4.13Å; L682-K689 HydrophobicContact CD1-CB 3.98Å; K689-D691 VanDerWaalsContact C-N 3.34Å; K689-D691 PolarHBondContact O-N 2.9Å; K689-L692 PolarHBondContact O-N 3.36Å; K689-L693 HydrophobicContact CG-CD1 4Å; K689-L693 HydrophobicContact CG-CG 4.2Å; K689-L693 WeakPolarHBondContact O-CG 3.44Å; K689-L693 PolarHBondContact O-N 3.1Å; K689-L693 VanDerWaalsContact O-N 3.08Å
690	V	89	Confident	89.1	Confident	130 Å²	130	53 Å²	53	79%	0.788	29%	0.286	S	S	*	.	H	α-helix	trans	-67.1	-31	176.4	-174.6	0	0	0	0	112.5	T688 L692	T688-V690 PolarHBondContact O-N 2.76Å; V690-L692 VanDerWaalsContact C-N 3.26Å; V690-L692 PolarHBondContact O-N 3.06Å
691	D	89.7	Confident	89.6	Confident	39 Å²	39	49.3 Å²	49.3	21%	0.209	27%	0.266	C	S	.	.	H	α-helix	trans	-69.5	-21.3	175.4	-66.1	-72.3	0	0	0	113.2	Y687 T688 K689 K695 K732	Y687-D691 HydrophobicContact CD1-CB 3.8Å; Y687-D691 HydrophobicContact CG-CB 4.39Å; T688-D691 WeakPolarHBondContact CA-OD2 3.49Å; T688-D691 VanDerWaalsContact CB-OD2 3.29Å; T688-D691 WeakPolarHBondContact CB-OD2 3.44Å; T688-D691 WeakPolarHBondContact CG2-OD2 3.23Å; T688-D691 PolarHBondContact N-OD2 2.85Å; T688-D691 WeakPolarHBondContact O-CB 3.48Å; T688-D691 PolarHBondContact O-N 2.76Å; T688-D691 VanDerWaalsContact OG1-CG 3.24Å; T688-D691 PolarHBondContact OG1-N 2.92Å; T688-D691 VanDerWaalsContact OG1-N 3.14Å; T688-D691 PolarHBondContact OG1-OD2 2.93Å; K689-D691 VanDerWaalsContact C-N 3.34Å; K689-D691 PolarHBondContact O-N 2.9Å; D691-K695 WeakPolarHBondContact O-CD 3.48Å; D691-K695 WeakPolarHBondContact O-CE 3.48Å; D691-K695 PolarHBondContact O-NZ 3.25Å; D691-K732 VanDerWaalsContact CG-NZ 3.27Å; D691-K732 IonicContact OD1-NZ 3.57Å; D691-K732 PolarHBondContact OD1-NZ 2.73Å; D691-K732 VanDerWaalsContact OD1-NZ 3.08Å; D691-K732 IonicContact OD2-NZ 3.08Å; D691-K732 PolarHBondContact OD2-NZ 2.98Å
692	L	91.4	Very high	89.9	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-110.4	-36.8	-171.1	-69.1	-178.5	0	0	0	114.7	F674 I677 F681 L682 Y687 T688 K689 V690 N694 K695 L700	F674-L692 WeakPolarHBondContact CB-O 3.47Å; F674-L692 HydrophobicContact CD2-CB 4.15Å; F674-L692 HydrophobicContact CD2-CD2 4.49Å; F674-L692 WeakPolarHBondContact CD2-O 3.15Å; F674-L692 HydrophobicContact CE1-CD1 4.47Å; F674-L692 HydrophobicContact CE2-CD2 4.11Å; F674-L692 HydrophobicContact CG-CB 4.21Å; F674-L692 HydrophobicContact CZ-CD2 4.39Å; I677-L692 HydrophobicContact CD1-CB 3.89Å; I677-L692 HydrophobicContact CG1-CB 4.14Å; I677-L692 HydrophobicContact CG1-CD1 4.09Å; I677-L692 HydrophobicContact CG2-CD1 4.17Å; F681-L692 HydrophobicContact CD1-CD1 3.85Å; F681-L692 HydrophobicContact CE1-CD1 3.69Å; L682-L692 HydrophobicContact CD2-CD1 3.97Å; Y687-L692 HydrophobicContact CD1-CD2 4.27Å; Y687-L692 HydrophobicContact CD2-CD1 4.24Å; Y687-L692 HydrophobicContact CD2-CD2 3.73Å; Y687-L692 HydrophobicContact CD2-CG 4.25Å; Y687-L692 HydrophobicContact CE2-CD2 4.23Å; Y687-L692 HydrophobicContact CG-CD1 4.28Å; Y687-L692 HydrophobicContact CG-CD2 3.77Å; Y687-L692 HydrophobicContact CG-CG 4Å; T688-L692 PolarHBondContact O-N 2.95Å; K689-L692 PolarHBondContact O-N 3.36Å; V690-L692 VanDerWaalsContact C-N 3.26Å; V690-L692 PolarHBondContact O-N 3.06Å; L692-N694 PolarHBondContact O-N 3.23Å; L692-K695 WeakPolarHBondContact O-CB 3.44Å; L692-K695 PolarHBondContact O-N 2.83Å; L692-L700 HydrophobicContact CD2-CD1 3.83Å; L692-L700 HydrophobicContact CD2-CD2 4.3Å
693	L	87.8	Confident	90	Very high	61 Å²	61	56 Å²	56	32%	0.319	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	131.2	-178.8	-73	173.9	0	0	0	111.5	I675 I677 K689 K695	I675-L693 WeakPolarHBondContact O-CD2 3.35Å; I677-L693 HydrophobicContact CD1-CD2 3.81Å; I677-L693 HydrophobicContact CD1-CG 4.06Å; K689-L693 HydrophobicContact CG-CD1 4Å; K689-L693 HydrophobicContact CG-CG 4.2Å; K689-L693 WeakPolarHBondContact O-CG 3.44Å; K689-L693 PolarHBondContact O-N 3.1Å; K689-L693 VanDerWaalsContact O-N 3.08Å; L693-K695 PolarHBondContact O-N 3.37Å
694	N	81.6	Confident	90.3	Very high	116 Å²	116	53.4 Å²	53.4	62%	0.62	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	1.4	-174.7	-43.2	-74.3	0	0	0	117.1	Q673 F674 L692	Q673-N694 WeakPolarHBondContact CG-O 3.46Å; Q673-N694 PolarHBondContact NE2-O 2.9Å; F674-N694 PolarHBondContact O-N 2.83Å; F674-N694 VanDerWaalsContact O-N 3.17Å; L692-N694 PolarHBondContact O-N 3.23Å
695	K	90.3	Very high	90.8	Very high	85 Å²	85	51.4 Å²	51.4	37%	0.37	28%	0.278	S	S	.	.			trans	-79.1	153.5	162.8	-68.6	-172.2	-176.9	156.4	0	110.5	Q673 F674 D691 L692 L693	Q673-K695 WeakPolarHBondContact CA-O 3.39Å; F674-K695 HydrophobicContact CD2-CB 4.48Å; F674-K695 WeakPolarHBondContact CD2-O 3.32Å; F674-K695 PolarHBondContact N-O 3.23Å; D691-K695 WeakPolarHBondContact O-CD 3.48Å; D691-K695 WeakPolarHBondContact O-CE 3.48Å; D691-K695 PolarHBondContact O-NZ 3.25Å; L692-K695 WeakPolarHBondContact O-CB 3.44Å; L692-K695 PolarHBondContact O-N 2.83Å; L693-K695 PolarHBondContact O-N 3.37Å
696	C	91.8	Very high	91	Very high	24 Å²	24	53.6 Å²	53.6	16%	0.162	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-80.4	144.9	173.7	-175	0	0	0	0	110.6	N671 L672 F698 D699	N671-C696 PolarHBondContact O-SG 2.81Å; L672-C696 CarbonylContact O-C 3.59Å; L672-C696 WeakPolarHBondContact O-CA 3.26Å; C696-F698 PolarHBondContact O-N 3.3Å; C696-F698 PolarHBondContact SG-N 2.94Å; C696-D699 WeakPolarHBondContact CB-OD2 3.49Å; C696-D699 PolarHBondContact N-OD2 3.42Å; C696-D699 VanDerWaalsContact O-CB 3.26Å; C696-D699 WeakPolarHBondContact O-CB 3.38Å; C696-D699 PolarHBondContact O-N 2.82Å
697	L	92.3	Very high	91.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-55.9	-35.4	171.4	-180	56.9	0	0	0	112.3	L672 F674 D699 L700 I701 I713 M741	L672-L697 HydrophobicContact CB-CB 4.45Å; L672-L697 PolarHBondContact O-N 3.44Å; F674-L697 HydrophobicContact CZ-CD1 3.98Å; L697-D699 PolarHBondContact O-N 3.47Å; L697-L700 PolarHBondContact O-N 3.05Å; L697-L700 VanDerWaalsContact O-N 3.14Å; L697-I701 HydrophobicContact CD1-CD1 4.47Å; L697-I701 HydrophobicContact CG-CD1 4Å; L697-I713 HydrophobicContact CD2-CD1 4.4Å; L697-M741 HydrophobicContact CD2-CE 3.9Å; L697-M741 HydrophobicContact CD2-SD 3.9Å
698	F	93.5	Very high	90.9	Very high	61 Å²	61	58.4 Å²	58.4	27%	0.268	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-63.9	-23.8	175.5	-65.3	-38.8	0	0	0	113.3	L672 C696 L700 I701 L706 V709 I713	L672-F698 HydrophobicContact CD1-CD2 4.05Å; L672-F698 HydrophobicContact CD1-CE1 4.21Å; L672-F698 HydrophobicContact CD1-CE2 3.38Å; L672-F698 HydrophobicContact CD1-CZ 3.46Å; L672-F698 VanDerWaalsContact CD1-CZ 3.46Å; C696-F698 PolarHBondContact O-N 3.3Å; C696-F698 PolarHBondContact SG-N 2.94Å; F698-L700 PolarHBondContact O-N 2.78Å; F698-L700 VanDerWaalsContact O-N 3.16Å; F698-I701 HydrophobicContact CD1-CD1 4.01Å; F698-I701 PolarHBondContact O-N 2.94Å; F698-L706 HydrophobicContact CB-CD2 3.74Å; F698-L706 HydrophobicContact CD1-CD2 3.7Å; F698-L706 HydrophobicContact CG-CD2 3.97Å; F698-V709 HydrophobicContact CE1-CG1 4.42Å; F698-I713 HydrophobicContact CE1-CD1 3.98Å; F698-I713 HydrophobicContact CZ-CD1 4.14Å
699	D	92.5	Very high	90.9	Very high	81 Å²	81	55.7 Å²	55.7	43%	0.433	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-66	-16.5	175.6	-57.9	-33.2	0	0	0	112.4	C696 L697 R730	C696-D699 WeakPolarHBondContact CB-OD2 3.49Å; C696-D699 PolarHBondContact N-OD2 3.42Å; C696-D699 VanDerWaalsContact O-CB 3.26Å; C696-D699 WeakPolarHBondContact O-CB 3.38Å; C696-D699 PolarHBondContact O-N 2.82Å; L697-D699 PolarHBondContact O-N 3.47Å; D699-R730 PolarHBondContact O-NH2 2.83Å
700	L	93.1	Very high	90.9	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.016	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-101.7	-11.2	177.9	-53.4	-172.2	0	0	0	113.6	F674 F681 Y687 L692 L697 F698 L729 R730	F674-L700 HydrophobicContact CE2-CD1 3.86Å; F674-L700 HydrophobicContact CE2-CG 4.39Å; F674-L700 HydrophobicContact CZ-CD1 3.63Å; F681-L700 HydrophobicContact CZ-CD1 4.47Å; Y687-L700 HydrophobicContact CE2-CD1 4.19Å; Y687-L700 HydrophobicContact CE2-CD2 3.84Å; L692-L700 HydrophobicContact CD2-CD1 3.83Å; L692-L700 HydrophobicContact CD2-CD2 4.3Å; L697-L700 PolarHBondContact O-N 3.05Å; L697-L700 VanDerWaalsContact O-N 3.14Å; F698-L700 PolarHBondContact O-N 2.78Å; F698-L700 VanDerWaalsContact O-N 3.16Å; L700-L729 HydrophobicContact CB-CD1 3.62Å; L700-L729 HydrophobicContact CD1-CD1 4.24Å; L700-L729 CarbonylContact O-C 3.51Å; L700-R730 WeakPolarHBondContact O-CB 3.41Å; L700-R730 PolarHBondContact O-N 3.37Å
701	I	93.6	Very high	90.9	Very high	8 Å²	8	52 Å²	52	4%	0.041	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-93.6	142.2	-174.4	-67.7	160.2	0	0	0	109.8	L697 F698 D705 L706 V709 Y727	L697-I701 HydrophobicContact CD1-CD1 4.47Å; L697-I701 HydrophobicContact CG-CD1 4Å; F698-I701 HydrophobicContact CD1-CD1 4.01Å; F698-I701 PolarHBondContact O-N 2.94Å; I701-D705 HydrophobicContact CG2-CB 4.04Å; I701-L706 HydrophobicContact CB-CD2 3.77Å; I701-L706 HydrophobicContact CG2-CD2 3.78Å; I701-L706 HydrophobicContact CG2-CG 4.3Å; I701-V709 HydrophobicContact CD1-CB 4.14Å; I701-V709 HydrophobicContact CD1-CG1 3.71Å; I701-V709 HydrophobicContact CD1-CG2 4.3Å; I701-V709 HydrophobicContact CG2-CG2 4.29Å; I701-Y727 HydrophobicContact CD1-CE2 4.46Å; I701-Y727 HydrophobicContact CG1-CD2 4.03Å; I701-Y727 HydrophobicContact CG1-CE2 3.97Å; I701-Y727 HydrophobicContact CG2-CD2 4.33Å
702	H	93.7	Very high	90.9	Very high	37 Å²	37	50.5 Å²	50.5	17%	0.171	26%	0.262	C	S	.	.			trans	-65	138.7	176.4	-168.3	-72.4	0	0	0	111.3	D704 D705 L706 R728 Y736	H702-D704 IonicContact CE1-OD1 3.26Å; H702-D704 IonicContact CE1-OD2 3.45Å; H702-D704 PolarHBondContact CE1-OD2 3.11Å; H702-D704 IonicContact ND1-OD1 2.98Å; H702-D704 IonicContact ND1-OD2 3.76Å; H702-D704 PolarHBondContact ND1-OD2 2.87Å; H702-D704 VanDerWaalsContact ND1-OD2 3.09Å; H702-D704 PolarHBondContact O-N 2.85Å; H702-D705 WeakPolarHBondContact O-CA 3.32Å; H702-D705 WeakPolarHBondContact O-CB 3.42Å; H702-D705 PolarHBondContact O-N 2.9Å; H702-L706 PolarHBondContact O-N 2.82Å; H702-R728 HydrophobicContact CB-CB 3.68Å; H702-R728 PolarHBondContact CD2-NH1 2.68Å; H702-R728 PolarHBondContact CE1-NH1 2.81Å; H702-R728 VanDerWaalsContact CG-CZ 3.4Å; H702-R728 PolarHBondContact N-O 2.85Å; H702-R728 VanDerWaalsContact ND1-CZ 3.34Å; H702-R728 PolarHBondContact ND1-NH1 3.32Å; H702-R728 PolarHBondContact ND1-NH2 3.14Å; H702-R728 PolarHBondContact NE2-NH1 3.17Å; H702-Y736 HydrophobicContact CB-CD1 4.1Å; H702-Y736 HydrophobicContact CB-CE1 3.65Å; H702-Y736 AromaticContact CD2-CE1 3.87Å; H702-Y736 AromaticContact CD2-CE2 3.67Å; H702-Y736 AromaticContact CD2-CZ 3.56Å
703	I	92.5	Very high	90.8	Very high	124 Å²	124	51.3 Å²	51.3	64%	0.636	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-52.1	-47.2	-168.8	-170.1	169	0	0	0	114.2	D705 L706	I703-D705 PolarHBondContact O-N 3.28Å; I703-L706 HydrophobicContact CB-CD1 4.5Å; I703-L706 HydrophobicContact CG1-CD1 4.21Å; I703-L706 WeakPolarHBondContact O-CB 3.35Å; I703-L706 WeakPolarHBondContact O-CG 3.4Å; I703-L706 PolarHBondContact O-N 2.79Å
704	D	92.5	Very high	90.8	Very high	78 Å²	78	54.6 Å²	54.6	42%	0.417	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-60.6	-29.5	177.5	-27.7	-41.2	0	0	0	113.9	F259 H702 R728	F259-D704 HydrophobicContact CE2-CB 3.88Å; F259-D704 HydrophobicContact CZ-CB 3.59Å; F259-D704 VanDerWaalsContact CZ-OD2 3.32Å; F259-D704 WeakPolarHBondContact CZ-OD2 3.21Å; H702-D704 IonicContact CE1-OD1 3.26Å; H702-D704 IonicContact CE1-OD2 3.45Å; H702-D704 PolarHBondContact CE1-OD2 3.11Å; H702-D704 IonicContact ND1-OD1 2.98Å; H702-D704 IonicContact ND1-OD2 3.76Å; H702-D704 PolarHBondContact ND1-OD2 2.87Å; H702-D704 VanDerWaalsContact ND1-OD2 3.09Å; H702-D704 PolarHBondContact O-N 2.85Å; D704-R728 IonicContact OD2-CZ 2.87Å; D704-R728 IonicContact OD2-NH1 2.65Å; D704-R728 PolarHBondContact OD2-NH1 2.83Å; D704-R728 IonicContact OD2-NH2 3.35Å; D704-R728 PolarHBondContact OD2-NH2 3.16Å
705	D	92.8	Very high	91	Very high	17 Å²	17	53.4 Å²	53.4	9%	0.091	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-87.1	-13.3	-175	-56.2	-16.3	0	0	0	111.6	I701 H702 I703 V707 H708 V709 R728	I701-D705 HydrophobicContact CG2-CB 4.04Å; H702-D705 WeakPolarHBondContact O-CA 3.32Å; H702-D705 WeakPolarHBondContact O-CB 3.42Å; H702-D705 PolarHBondContact O-N 2.9Å; I703-D705 PolarHBondContact O-N 3.28Å; D705-V707 VanDerWaalsContact C-N 3.28Å; D705-V707 PolarHBondContact O-N 2.99Å; D705-H708 PolarHBondContact O-N 2.89Å; D705-V709 PolarHBondContact O-N 3Å; D705-V709 VanDerWaalsContact O-N 3.07Å; D705-R728 VanDerWaalsContact CG-NH2 3.3Å; D705-R728 IonicContact OD1-CZ 3.09Å; D705-R728 IonicContact OD1-NE 3.38Å; D705-R728 IonicContact OD1-NH2 3.54Å; D705-R728 PolarHBondContact OD1-NH2 3.17Å; D705-R728 WeakPolarHBondContact OD2-CB 3.48Å; D705-R728 IonicContact OD2-CZ 2.71Å; D705-R728 PolarHBondContact OD2-N 3.38Å; D705-R728 IonicContact OD2-NE 3.85Å; D705-R728 PolarHBondContact OD2-NE 3.12Å; D705-R728 IonicContact OD2-NH2 3.45Å; D705-R728 PolarHBondContact OD2-NH2 2.71Å
706	L	91.7	Very high	90.7	Very high	49 Å²	49	50 Å²	50	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-56.6	-39.8	-179	-71.2	174.7	0	0	0	112.5	F698 I701 H702 I703 V709 S710	F698-L706 HydrophobicContact CB-CD2 3.74Å; F698-L706 HydrophobicContact CD1-CD2 3.7Å; F698-L706 HydrophobicContact CG-CD2 3.97Å; I701-L706 HydrophobicContact CB-CD2 3.77Å; I701-L706 HydrophobicContact CG2-CD2 3.78Å; I701-L706 HydrophobicContact CG2-CG 4.3Å; H702-L706 PolarHBondContact O-N 2.82Å; I703-L706 HydrophobicContact CB-CD1 4.5Å; I703-L706 HydrophobicContact CG1-CD1 4.21Å; I703-L706 WeakPolarHBondContact O-CB 3.35Å; I703-L706 WeakPolarHBondContact O-CG 3.4Å; I703-L706 PolarHBondContact O-N 2.79Å; L706-V709 PolarHBondContact O-N 3.28Å; L706-S710 WeakPolarHBondContact O-CB 3.39Å; L706-S710 PolarHBondContact O-N 3.22Å; L706-S710 PolarHBondContact O-OG 3.23Å
707	V	89.8	Confident	90.2	Very high	90 Å²	90	53.6 Å²	53.6	55%	0.545	28%	0.281	S	S	.	.	H	α-helix	trans	-58.7	-52.7	179.1	-178.9	0	0	0	0	109.5	D705 V709 S710 E711	D705-V707 VanDerWaalsContact C-N 3.28Å; D705-V707 PolarHBondContact O-N 2.99Å; V707-V709 PolarHBondContact O-N 3.46Å; V707-S710 PolarHBondContact O-N 2.95Å; V707-S710 PolarHBondContact O-OG 3.45Å; V707-E711 WeakPolarHBondContact O-CG 3.34Å; V707-E711 PolarHBondContact O-N 3.2Å
708	H	87.6	Confident	89.4	Confident	79 Å²	79	57.8 Å²	57.8	37%	0.366	30%	0.301	S	S	.	.	H	α-helix	trans	-63.2	-42.5	-178.5	-171.1	83.8	0	0	0	112.8	D705 A712 S725	D705-H708 PolarHBondContact O-N 2.89Å; H708-A712 WeakPolarHBondContact O-CB 3.41Å; H708-A712 PolarHBondContact O-N 3.42Å; H708-S725 PolarHBondContact CD2-OG 3.21Å; H708-S725 WeakPolarHBondContact NE2-CB 3.33Å; H708-S725 PolarHBondContact NE2-N 3.12Å; H708-S725 VanDerWaalsContact NE2-N 3.17Å; H708-S725 PolarHBondContact NE2-OG 2.91Å
709	V	90.6	Very high	88.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-70.8	-33.7	178.5	-175.5	0	0	0	0	111.4	F698 I701 D705 L706 V707 A712 I713 T724 Y727 M741	F698-V709 HydrophobicContact CE1-CG1 4.42Å; I701-V709 HydrophobicContact CD1-CB 4.14Å; I701-V709 HydrophobicContact CD1-CG1 3.71Å; I701-V709 HydrophobicContact CD1-CG2 4.3Å; I701-V709 HydrophobicContact CG2-CG2 4.29Å; D705-V709 PolarHBondContact O-N 3Å; D705-V709 VanDerWaalsContact O-N 3.07Å; L706-V709 PolarHBondContact O-N 3.28Å; V707-V709 PolarHBondContact O-N 3.46Å; V709-A712 PolarHBondContact O-N 3.39Å; V709-I713 HydrophobicContact CG1-CD1 3.91Å; V709-I713 HydrophobicContact CG1-CG1 4.42Å; V709-I713 VanDerWaalsContact O-CG1 3.3Å; V709-I713 WeakPolarHBondContact O-CG1 3.39Å; V709-I713 PolarHBondContact O-N 3.23Å; V709-T724 HydrophobicContact CG1-CG2 4.35Å; V709-Y727 HydrophobicContact CG2-CD1 3.93Å; V709-Y727 HydrophobicContact CG2-CD2 4.26Å; V709-Y727 HydrophobicContact CG2-CG 3.74Å; V709-M741 HydrophobicContact CG1-CE 3.77Å
710	S	91	Very high	87.8	Confident	34 Å²	34	62.5 Å²	62.5	24%	0.238	33%	0.325	C	S	.	.	H	α-helix	trans	-68	-42	174.5	75.3	0	0	0	0	112.4	L706 V707 A712 I713 N714	L706-S710 WeakPolarHBondContact O-CB 3.39Å; L706-S710 PolarHBondContact O-N 3.22Å; L706-S710 PolarHBondContact O-OG 3.23Å; V707-S710 PolarHBondContact O-N 2.95Å; V707-S710 PolarHBondContact O-OG 3.45Å; S710-A712 VanDerWaalsContact C-N 3.34Å; S710-A712 PolarHBondContact O-N 2.65Å; S710-I713 PolarHBondContact O-N 3.08Å; S710-N714 VanDerWaalsContact O-CB 3.3Å; S710-N714 WeakPolarHBondContact O-CB 3.26Å; S710-N714 PolarHBondContact O-N 3.47Å; S710-N714 PolarHBondContact O-ND2 3.23Å; S710-N714 VanDerWaalsContact O-ND2 3.11Å
711	E	89.8	Confident	87.2	Confident	107 Å²	107	64 Å²	64	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-59.5	-45.8	172.4	-74.3	176.9	175.7	0	0	110.8	V707 I713 N714 I715	V707-E711 WeakPolarHBondContact O-CG 3.34Å; V707-E711 PolarHBondContact O-N 3.2Å; E711-I713 PolarHBondContact O-N 2.94Å; E711-N714 PolarHBondContact O-N 3.26Å; E711-I715 WeakPolarHBondContact O-CD1 3.31Å; E711-I715 VanDerWaalsContact O-CG1 3.26Å; E711-I715 WeakPolarHBondContact O-CG1 3.36Å; E711-I715 PolarHBondContact O-N 3.2Å
712	A	88.5	Confident	86.7	Confident	7 Å²	7	64.6 Å²	64.6	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-60.8	-44	177.4	0	0	0	0	0	112.7	H708 V709 S710 I715 V716 V722 T724 I743	H708-A712 WeakPolarHBondContact O-CB 3.41Å; H708-A712 PolarHBondContact O-N 3.42Å; V709-A712 PolarHBondContact O-N 3.39Å; S710-A712 VanDerWaalsContact C-N 3.34Å; S710-A712 PolarHBondContact O-N 2.65Å; A712-I715 PolarHBondContact O-N 3.35Å; A712-V716 WeakPolarHBondContact O-CG2 3.35Å; A712-V722 HydrophobicContact CB-CG1 3.92Å; A712-V722 WeakPolarHBondContact O-CG1 3.47Å; A712-T724 HydrophobicContact CB-CG2 3.57Å; A712-I743 HydrophobicContact CB-CD1 4.36Å
713	I	89.2	Confident	86.2	Confident	17 Å²	17	65.5 Å²	65.5	9%	0.087	35%	0.347	C	S	.	.	H	α-helix	trans	-65.7	-42.9	176.9	-71	168.2	0	0	0	111.3	L672 L697 F698 V709 S710 E711 I715 V716 M741 I743 L817	L672-I713 HydrophobicContact CD1-CD1 3.86Å; L672-I713 HydrophobicContact CD1-CG2 4.17Å; L672-I713 HydrophobicContact CD2-CD1 4.35Å; L672-I713 HydrophobicContact CD2-CG2 3.96Å; L697-I713 HydrophobicContact CD2-CD1 4.4Å; F698-I713 HydrophobicContact CE1-CD1 3.98Å; F698-I713 HydrophobicContact CZ-CD1 4.14Å; V709-I713 HydrophobicContact CG1-CD1 3.91Å; V709-I713 HydrophobicContact CG1-CG1 4.42Å; V709-I713 VanDerWaalsContact O-CG1 3.3Å; V709-I713 WeakPolarHBondContact O-CG1 3.39Å; V709-I713 PolarHBondContact O-N 3.23Å; S710-I713 PolarHBondContact O-N 3.08Å; E711-I713 PolarHBondContact O-N 2.94Å; I713-I715 PolarHBondContact O-N 3.29Å; I713-I715 VanDerWaalsContact O-N 3.16Å; I713-V716 WeakPolarHBondContact O-CB 3.45Å; I713-V716 WeakPolarHBondContact O-CG2 3.45Å; I713-V716 PolarHBondContact O-N 2.88Å; I713-V716 VanDerWaalsContact O-N 3.13Å; I713-M741 HydrophobicContact CD1-CE 4.37Å; I713-M741 HydrophobicContact CG1-CE 4.48Å; I713-I743 HydrophobicContact CG1-CD1 3.77Å; I713-L817 HydrophobicContact CG2-CD2 4.11Å
714	N	87.5	Confident	85.8	Confident	130 Å²	130	59.7 Å²	59.7	70%	0.695	32%	0.317	S	S	*	.	H	α-helix	trans	-66.6	-14.5	-178.9	-70.4	-24.1	0	0	0	114	S710 E711	S710-N714 VanDerWaalsContact O-CB 3.3Å; S710-N714 WeakPolarHBondContact O-CB 3.26Å; S710-N714 PolarHBondContact O-N 3.47Å; S710-N714 PolarHBondContact O-ND2 3.23Å; S710-N714 VanDerWaalsContact O-ND2 3.11Å; E711-N714 PolarHBondContact O-N 3.26Å
715	I	86.7	Confident	85	Confident	90 Å²	90	57.9 Å²	57.9	46%	0.462	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.4	178	-66.7	165.5	0	0	0	111.8	E711 A712 I713 N717 V722	E711-I715 WeakPolarHBondContact O-CD1 3.31Å; E711-I715 VanDerWaalsContact O-CG1 3.26Å; E711-I715 WeakPolarHBondContact O-CG1 3.36Å; E711-I715 PolarHBondContact O-N 3.2Å; A712-I715 PolarHBondContact O-N 3.35Å; I713-I715 PolarHBondContact O-N 3.29Å; I713-I715 VanDerWaalsContact O-N 3.16Å; I715-N717 PolarHBondContact O-N 2.95Å; I715-N717 PolarHBondContact O-ND2 2.88Å; I715-V722 HydrophobicContact CB-CG2 4.16Å; I715-V722 HydrophobicContact CG2-CG2 3.92Å
716	V	84.8	Confident	84.8	Confident	14 Å²	14	61.1 Å²	61.1	9%	0.085	32%	0.324	C	S	.	.			trans	-66.2	127.4	-179.5	-172.5	0	0	0	0	110.5	A712 I713 V722 I743 L817	A712-V716 WeakPolarHBondContact O-CG2 3.35Å; I713-V716 WeakPolarHBondContact O-CB 3.45Å; I713-V716 WeakPolarHBondContact O-CG2 3.45Å; I713-V716 PolarHBondContact O-N 2.88Å; I713-V716 VanDerWaalsContact O-N 3.13Å; V716-V722 HydrophobicContact CB-CG2 4.33Å; V716-V722 HydrophobicContact CG2-CB 3.85Å; V716-V722 HydrophobicContact CG2-CG2 3.71Å; V716-I743 HydrophobicContact CG1-CG2 4.31Å; V716-I743 HydrophobicContact CG2-CB 3.78Å; V716-I743 HydrophobicContact CG2-CD1 4.13Å; V716-I743 HydrophobicContact CG2-CG2 3.67Å; V716-L817 HydrophobicContact CB-CD1 4.4Å; V716-L817 HydrophobicContact CG1-CD1 4.12Å
717	N	80.7	Confident	84.7	Confident	100 Å²	100	58.9 Å²	58.9	54%	0.535	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-133	163.8	174.4	-72.8	-84.5	0	0	0	109.6	I715 N719 Q720	I715-N717 PolarHBondContact O-N 2.95Å; I715-N717 PolarHBondContact O-ND2 2.88Å; N717-N719 PolarHBondContact O-N 2.96Å; N717-Q720 PolarHBondContact N-O 3.45Å; N717-Q720 CarbonylContact O-C 3.53Å; N717-Q720 PolarHBondContact O-N 3Å
718	E	76.1	Confident	84.8	Confident	88 Å²	88	55.8 Å²	55.8	41%	0.411	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-33.5	178.3	-75.3	160.3	-109.4	0	0	113.7	Y745 K747	E718-Y745 HydrophobicContact CG-CD1 3.45Å; E718-Y745 VanDerWaalsContact CG-CD1 3.45Å; E718-Y745 HydrophobicContact CG-CE1 3.82Å; E718-Y745 HydrophobicContact CG-CG 4.44Å; E718-K747 VanDerWaalsContact CD-CE 3.49Å; E718-K747 WeakPolarHBondContact OE1-CE 3.35Å; E718-K747 IonicContact OE1-NZ 3.82Å; E718-K747 PolarHBondContact OE1-NZ 2.8Å; E718-K747 WeakPolarHBondContact OE2-CD 3.46Å; E718-K747 WeakPolarHBondContact OE2-CE 3.36Å; E718-K747 IonicContact OE2-NZ 2.95Å; E718-K747 PolarHBondContact OE2-NZ 2.59Å
719	N	73.2	Confident	85	Confident	126 Å²	126	52 Å²	52	67%	0.674	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-2.8	-176.9	-59	-13.7	0	0	0	113.8	N717	N717-N719 PolarHBondContact O-N 2.96Å
720	Q	77.6	Confident	85.2	Confident	115 Å²	115	56 Å²	56	54%	0.537	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-144.7	97	-171.6	-172	170.1	-3.4	0	0	111.4	N717	N717-Q720 PolarHBondContact N-O 3.45Å; N717-Q720 CarbonylContact O-C 3.53Å; N717-Q720 PolarHBondContact O-N 3Å
721	P	82.4	Confident	85.2	Confident	35 Å²	35	54.9 Å²	54.9	23%	0.227	28%	0.279	C	S	.	.			trans	-68.1	148.9	168.3	29.8	-34	0	0	0	110.7	L742 I743 F744	P721-L742 HydrophobicContact CB-CD1 4.14Å; P721-I743 CarbonylContact C-O 3.56Å; P721-I743 WeakPolarHBondContact CA-O 3.43Å; P721-I743 VanDerWaalsContact CB-O 3.29Å; P721-I743 WeakPolarHBondContact CB-O 3.04Å; P721-F744 HydrophobicContact CB-CD1 3.59Å; P721-F744 HydrophobicContact CB-CE1 3.73Å; P721-F744 HydrophobicContact CB-CG 4.31Å; P721-F744 HydrophobicContact CG-CD1 4.28Å; P721-F744 HydrophobicContact CG-CE1 4.13Å
722	V	83.1	Confident	85.3	Confident	20 Å²	20	54.4 Å²	54.4	12%	0.121	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.7	-179.6	-177	0	0	0	0	110.1	A712 I715 V716 I743	A712-V722 HydrophobicContact CB-CG1 3.92Å; A712-V722 WeakPolarHBondContact O-CG1 3.47Å; I715-V722 HydrophobicContact CB-CG2 4.16Å; I715-V722 HydrophobicContact CG2-CG2 3.92Å; V716-V722 HydrophobicContact CB-CG2 4.33Å; V716-V722 HydrophobicContact CG2-CB 3.85Å; V716-V722 HydrophobicContact CG2-CG2 3.71Å; V722-I743 PolarHBondContact N-O 3.31Å; V722-I743 PolarHBondContact O-N 3.08Å
723	V	82.9	Confident	85.3	Confident	56 Å²	56	58 Å²	58	34%	0.339	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.7	171	-168.4	0	0	0	0	108.8	R740 L742	V723-R740 HydrophobicContact CG1-CG 4.2Å; V723-R740 VanDerWaalsContact CG1-NE 3.31Å; V723-L742 HydrophobicContact CG2-CB 4.43Å; V723-L742 HydrophobicContact CG2-CD1 3.68Å
724	T	82.6	Confident	85.2	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.006	33%	0.328	C	S	.	.			trans	-61.2	162.5	173.2	47.4	0	0	0	0	112.7	V709 A712 R740 M741 I743	V709-T724 HydrophobicContact CG1-CG2 4.35Å; A712-T724 HydrophobicContact CB-CG2 3.57Å; T724-R740 WeakPolarHBondContact O-CG 3.28Å; T724-R740 PolarHBondContact O-NE 3.13Å; T724-M741 HydrophobicContact CG2-CB 4.4Å; T724-M741 HydrophobicContact CG2-CE 4.25Å; T724-M741 PolarHBondContact N-O 3.41Å; T724-M741 WeakPolarHBondContact OG1-CA 3.24Å; T724-M741 WeakPolarHBondContact OG1-CB 3.48Å; T724-M741 PolarHBondContact OG1-N 3.23Å; T724-M741 PolarHBondContact OG1-O 2.86Å; T724-I743 HydrophobicContact CG2-CD1 4.13Å
725	S	77.1	Confident	85.3	Confident	41 Å²	41	63.4 Å²	63.4	29%	0.287	32%	0.318	S	S	.	.			trans	-63.6	179.4	155.6	72.8	0	0	0	0	111.2	H708	H708-S725 PolarHBondContact CD2-OG 3.21Å; H708-S725 WeakPolarHBondContact NE2-CB 3.33Å; H708-S725 PolarHBondContact NE2-N 3.12Å; H708-S725 VanDerWaalsContact NE2-N 3.17Å; H708-S725 PolarHBondContact NE2-OG 2.91Å
726	F	87.1	Confident	85.4	Confident	85 Å²	85	62.6 Å²	62.6	37%	0.373	31%	0.31	S	S	.	.			trans	-62.1	138.9	158.2	-70.2	-67.3	0	0	0	110.4	W188 W738 A739 R740	W188-F726 AromaticContact CE2-CE2 3.64Å; W188-F726 HydrophobicContact CH2-CD2 4.15Å; W188-F726 HydrophobicContact CH2-CE2 4.2Å; W188-F726 AromaticContact CZ2-CD2 3.59Å; W188-F726 HydrophobicContact CZ2-CD2 3.59Å; W188-F726 AromaticContact CZ2-CE2 3.24Å; W188-F726 HydrophobicContact CZ2-CE2 3.24Å; W188-F726 HydrophobicContact CZ2-CG 4.44Å; W188-F726 AromaticContact CZ2-CZ 3.85Å; W188-F726 HydrophobicContact CZ2-CZ 3.85Å; W188-F726 AromaticContact NE1-CE2 3.72Å; W188-F726 AromaticContact NE1-CZ 3.84Å; F726-W738 HydrophobicContact CB-CE3 3.87Å; F726-W738 HydrophobicContact CB-CZ3 4.3Å; F726-A739 CarbonylContact C-O 3.6Å; F726-A739 VanDerWaalsContact CA-O 3.28Å; F726-A739 WeakPolarHBondContact CA-O 3.18Å; F726-R740 HydrophobicContact CD1-CB 4.08Å; F726-R740 HydrophobicContact CE1-CB 4.12Å
727	Y	90.3	Very high	85.5	Confident	1 Å²	1	62.3 Å²	62.3	0%	0.004	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	164.7	171.9	65.7	-88.8	0	0	0	109.4	I701 V709 L729 A739 M741 H821	I701-Y727 HydrophobicContact CD1-CE2 4.46Å; I701-Y727 HydrophobicContact CG1-CD2 4.03Å; I701-Y727 HydrophobicContact CG1-CE2 3.97Å; I701-Y727 HydrophobicContact CG2-CD2 4.33Å; V709-Y727 HydrophobicContact CG2-CD1 3.93Å; V709-Y727 HydrophobicContact CG2-CD2 4.26Å; V709-Y727 HydrophobicContact CG2-CG 3.74Å; Y727-L729 HydrophobicContact CE2-CB 4.07Å; Y727-L729 HydrophobicContact CE2-CD1 4.24Å; Y727-A739 WeakPolarHBondContact CD1-O 3.43Å; Y727-A739 HydrophobicContact CD2-CB 4.4Å; Y727-A739 HydrophobicContact CE1-CB 4.12Å; Y727-A739 HydrophobicContact CE2-CB 3.85Å; Y727-A739 PolarHBondContact N-O 3.36Å; Y727-A739 PolarHBondContact O-N 2.86Å; Y727-M741 HydrophobicContact CE1-CB 3.66Å; Y727-H821 PolarHBondContact OH-CE1 3.12Å; Y727-H821 PolarHBondContact OH-ND1 3.29Å
728	R	92.4	Very high	85.9	Confident	25 Å²	25	61.1 Å²	61.1	9%	0.094	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	119.7	178.9	-70.5	163.2	-69.3	169.7	-2.9	110.9	F259 H702 D704 D705 Y736 C737 W738	F259-R728 VanDerWaalsContact CZ-NH2 3.3Å; H702-R728 HydrophobicContact CB-CB 3.68Å; H702-R728 PolarHBondContact CD2-NH1 2.68Å; H702-R728 PolarHBondContact CE1-NH1 2.81Å; H702-R728 VanDerWaalsContact CG-CZ 3.4Å; H702-R728 PolarHBondContact N-O 2.85Å; H702-R728 VanDerWaalsContact ND1-CZ 3.34Å; H702-R728 PolarHBondContact ND1-NH1 3.32Å; H702-R728 PolarHBondContact ND1-NH2 3.14Å; H702-R728 PolarHBondContact NE2-NH1 3.17Å; D704-R728 IonicContact OD2-CZ 2.87Å; D704-R728 IonicContact OD2-NH1 2.65Å; D704-R728 PolarHBondContact OD2-NH1 2.83Å; D704-R728 IonicContact OD2-NH2 3.35Å; D704-R728 PolarHBondContact OD2-NH2 3.16Å; D705-R728 VanDerWaalsContact CG-NH2 3.3Å; D705-R728 IonicContact OD1-CZ 3.09Å; D705-R728 IonicContact OD1-NE 3.38Å; D705-R728 IonicContact OD1-NH2 3.54Å; D705-R728 PolarHBondContact OD1-NH2 3.17Å; D705-R728 WeakPolarHBondContact OD2-CB 3.48Å; D705-R728 IonicContact OD2-CZ 2.71Å; D705-R728 PolarHBondContact OD2-N 3.38Å; D705-R728 IonicContact OD2-NE 3.85Å; D705-R728 PolarHBondContact OD2-NE 3.12Å; D705-R728 IonicContact OD2-NH2 3.45Å; D705-R728 PolarHBondContact OD2-NH2 2.71Å; R728-Y736 HydrophobicContact CB-CD1 3.74Å; R728-Y736 HydrophobicContact CB-CG 4.18Å; R728-C737 WeakPolarHBondContact CA-O 3.35Å; R728-W738 HydrophobicContact CG-CD2 3.9Å; R728-W738 HydrophobicContact CG-CE3 3.82Å; R728-W738 HydrophobicContact CG-CH2 3.78Å; R728-W738 HydrophobicContact CG-CZ2 3.82Å; R728-W738 HydrophobicContact CG-CZ3 3.78Å
729	L	92.3	Very high	86.5	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.3	174.5	-175	74	0	0	0	109.9	F681 L700 Y727 Y736 C737 A739 L823	F681-L729 HydrophobicContact CE2-CD2 4.02Å; F681-L729 HydrophobicContact CZ-CD2 3.92Å; L700-L729 HydrophobicContact CB-CD1 3.62Å; L700-L729 HydrophobicContact CD1-CD1 4.24Å; L700-L729 CarbonylContact O-C 3.51Å; Y727-L729 HydrophobicContact CE2-CB 4.07Å; Y727-L729 HydrophobicContact CE2-CD1 4.24Å; L729-Y736 CarbonylContact O-C 3.59Å; L729-Y736 VanDerWaalsContact O-CA 3.31Å; L729-Y736 WeakPolarHBondContact O-CA 3.39Å; L729-C737 PolarHBondContact N-O 2.62Å; L729-C737 PolarHBondContact O-N 3.29Å; L729-A739 HydrophobicContact CB-CB 3.99Å; L729-L823 HydrophobicContact CD2-CD2 3.68Å
730	R	93.8	Very high	87.2	Confident	84 Å²	84	52.4 Å²	52.4	32%	0.317	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.5	176.6	-175.2	163.5	59	150.4	-6.3	110.2	Y687 D699 L700 Y736	Y687-R730 WeakPolarHBondContact CE2-O 3.18Å; Y687-R730 PolarHBondContact OH-O 2.87Å; D699-R730 PolarHBondContact O-NH2 2.83Å; L700-R730 WeakPolarHBondContact O-CB 3.41Å; L700-R730 PolarHBondContact O-N 3.37Å; R730-Y736 HydrophobicContact CB-CD1 4.03Å; R730-Y736 HydrophobicContact CB-CE1 3.65Å; R730-Y736 HydrophobicContact CG-CE1 4.42Å
731	L	92.1	Very high	87.8	Confident	10 Å²	10	47 Å²	47	5%	0.052	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-84.6	165.6	174.2	-57.1	172	0	0	0	110.6	Y687 C733 E734 K735 C737 Y827	Y687-L731 PolarHBondContact OH-O 2.87Å; L731-C733 PolarHBondContact O-N 3.3Å; L731-C733 VanDerWaalsContact O-N 3.12Å; L731-E734 WeakPolarHBondContact O-CA 3.39Å; L731-E734 PolarHBondContact O-N 3.08Å; L731-K735 WeakPolarHBondContact CB-O 3.4Å; L731-K735 WeakPolarHBondContact CG-O 3.43Å; L731-K735 PolarHBondContact N-O 3.24Å; L731-C737 HydrophobicContact CD1-CB 4.34Å; L731-Y827 HydrophobicContact CD1-CE1 4.36Å
732	K	91.1	Very high	88.1	Confident	97 Å²	97	45.9 Å²	45.9	42%	0.422	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.8	174.2	-171	169.3	-175	165.9	0	113.2	S685 G686 Y687 D691 E734	S685-K732 PolarHBondContact O-N 2.9Å; G686-K732 WeakPolarHBondContact O-CB 3.5Å; G686-K732 WeakPolarHBondContact O-CD 3.45Å; Y687-K732 HydrophobicContact CD1-CB 3.62Å; Y687-K732 HydrophobicContact CD1-CD 4.06Å; Y687-K732 HydrophobicContact CD1-CG 3.87Å; Y687-K732 HydrophobicContact CE1-CB 3.67Å; Y687-K732 HydrophobicContact CE1-CG 3.96Å; Y687-K732 HydrophobicContact CG-CB 4.09Å; D691-K732 VanDerWaalsContact CG-NZ 3.27Å; D691-K732 IonicContact OD1-NZ 3.57Å; D691-K732 PolarHBondContact OD1-NZ 2.73Å; D691-K732 VanDerWaalsContact OD1-NZ 3.08Å; D691-K732 IonicContact OD2-NZ 3.08Å; D691-K732 PolarHBondContact OD2-NZ 2.98Å; K732-E734 PolarHBondContact O-N 3.3Å
733	C	87.7	Confident	88.4	Confident	82 Å²	82	44.9 Å²	44.9	55%	0.554	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	17.8	174.1	63.4	0	0	0	0	114.2	L731 K735	L731-C733 PolarHBondContact O-N 3.3Å; L731-C733 VanDerWaalsContact O-N 3.12Å; C733-K735 PolarHBondContact O-N 3.39Å
734	E	87.7	Confident	88.5	Confident	147 Å²	147	43 Å²	43	69%	0.687	20%	0.199	S	C	*	.	S	Bend	trans	60.8	-7.7	-179.6	-54.6	-163.1	128.7	0	0	116.6	L731 K732	L731-E734 WeakPolarHBondContact O-CA 3.39Å; L731-E734 PolarHBondContact O-N 3.08Å; K732-E734 PolarHBondContact O-N 3.3Å
735	K	88.8	Confident	88.6	Confident	114 Å²	114	45.5 Å²	45.5	50%	0.496	21%	0.208	S	C	.	.			trans	-72	149.2	171.1	-62.7	-177.1	-179.5	-175.6	0	111.4	L731 C733	L731-K735 WeakPolarHBondContact CB-O 3.4Å; L731-K735 WeakPolarHBondContact CG-O 3.43Å; L731-K735 PolarHBondContact N-O 3.24Å; C733-K735 PolarHBondContact O-N 3.39Å
736	Y	90.4	Very high	88.7	Confident	73 Å²	73	45.2 Å²	45.2	29%	0.286	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	140.4	171.9	-69.9	-85.3	0	0	0	111.7	H702 R728 L729 R730	H702-Y736 HydrophobicContact CB-CD1 4.1Å; H702-Y736 HydrophobicContact CB-CE1 3.65Å; H702-Y736 AromaticContact CD2-CE1 3.87Å; H702-Y736 AromaticContact CD2-CE2 3.67Å; H702-Y736 AromaticContact CD2-CZ 3.56Å; R728-Y736 HydrophobicContact CB-CD1 3.74Å; R728-Y736 HydrophobicContact CB-CG 4.18Å; L729-Y736 CarbonylContact O-C 3.59Å; L729-Y736 VanDerWaalsContact O-CA 3.31Å; L729-Y736 WeakPolarHBondContact O-CA 3.39Å; R730-Y736 HydrophobicContact CB-CD1 4.03Å; R730-Y736 HydrophobicContact CB-CE1 3.65Å; R730-Y736 HydrophobicContact CG-CE1 4.42Å
737	C	86.6	Confident	88	Confident	9 Å²	9	44.5 Å²	44.5	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	155.9	161.9	67.8	0	0	0	0	110.3	R728 L729 L731	R728-C737 WeakPolarHBondContact CA-O 3.35Å; L729-C737 PolarHBondContact N-O 2.62Å; L729-C737 PolarHBondContact O-N 3.29Å; L731-C737 HydrophobicContact CD1-CB 4.34Å
738	W	89.7	Confident	86.2	Confident	75 Å²	75	47 Å²	47	28%	0.284	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.7	172.6	-76.2	103.9	0	0	0	110	F726 R728 S824	F726-W738 HydrophobicContact CB-CE3 3.87Å; F726-W738 HydrophobicContact CB-CZ3 4.3Å; R728-W738 HydrophobicContact CG-CD2 3.9Å; R728-W738 HydrophobicContact CG-CE3 3.82Å; R728-W738 HydrophobicContact CG-CH2 3.78Å; R728-W738 HydrophobicContact CG-CZ2 3.82Å; R728-W738 HydrophobicContact CG-CZ3 3.78Å; W738-S824 WeakPolarHBondContact CB-OG 3.46Å; W738-S824 WeakPolarHBondContact O-CB 3.06Å; W738-S824 PolarHBondContact O-N 3.48Å; W738-S824 PolarHBondContact O-OG 3.35Å
739	A	88.4	Confident	83.7	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	152.3	-178.7	0	0	0	0	0	110.9	F726 Y727 L729 Q822 L823	F726-A739 CarbonylContact C-O 3.6Å; F726-A739 VanDerWaalsContact CA-O 3.28Å; F726-A739 WeakPolarHBondContact CA-O 3.18Å; Y727-A739 WeakPolarHBondContact CD1-O 3.43Å; Y727-A739 HydrophobicContact CD2-CB 4.4Å; Y727-A739 HydrophobicContact CE1-CB 4.12Å; Y727-A739 HydrophobicContact CE2-CB 3.85Å; Y727-A739 PolarHBondContact N-O 3.36Å; Y727-A739 PolarHBondContact O-N 2.86Å; L729-A739 HydrophobicContact CB-CB 3.99Å; A739-Q822 CarbonylContact C-O 3.52Å; A739-Q822 WeakPolarHBondContact CA-O 3.21Å; A739-L823 HydrophobicContact CB-CD2 3.51Å
740	R	87.6	Confident	81.3	Confident	30 Å²	30	55.2 Å²	55.2	11%	0.113	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.9	162	-162	179.1	-171.1	-172.2	-1.9	108.1	W188 V723 T724 F726 H821 Q822	W188-R740 VanDerWaalsContact CE2-NH1 3.33Å; W188-R740 VanDerWaalsContact CZ2-CZ 3.41Å; W188-R740 PolarHBondContact O-NH1 3.03Å; V723-R740 HydrophobicContact CG1-CG 4.2Å; V723-R740 VanDerWaalsContact CG1-NE 3.31Å; T724-R740 WeakPolarHBondContact O-CG 3.28Å; T724-R740 PolarHBondContact O-NE 3.13Å; F726-R740 HydrophobicContact CD1-CB 4.08Å; F726-R740 HydrophobicContact CE1-CB 4.12Å; R740-H821 WeakPolarHBondContact O-CA 3.11Å; R740-Q822 PolarHBondContact N-O 2.98Å; R740-Q822 PolarHBondContact O-N 3.27Å
741	M	89.6	Confident	78.5	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	127.3	-176.2	-176.2	171.3	74	0	0	111.2	L697 V709 I713 T724 Y727 I743 C819 C820 H821	L697-M741 HydrophobicContact CD2-CE 3.9Å; L697-M741 HydrophobicContact CD2-SD 3.9Å; V709-M741 HydrophobicContact CG1-CE 3.77Å; I713-M741 HydrophobicContact CD1-CE 4.37Å; I713-M741 HydrophobicContact CG1-CE 4.48Å; T724-M741 HydrophobicContact CG2-CB 4.4Å; T724-M741 HydrophobicContact CG2-CE 4.25Å; T724-M741 PolarHBondContact N-O 3.41Å; T724-M741 WeakPolarHBondContact OG1-CA 3.24Å; T724-M741 WeakPolarHBondContact OG1-CB 3.48Å; T724-M741 PolarHBondContact OG1-N 3.23Å; T724-M741 PolarHBondContact OG1-O 2.86Å; Y727-M741 HydrophobicContact CE1-CB 3.66Å; M741-I743 HydrophobicContact CE-CD1 3.76Å; M741-I743 HydrophobicContact CE-CG1 3.83Å; M741-I743 HydrophobicContact CG-CG1 3.94Å; M741-I743 HydrophobicContact SD-CG1 4.48Å; M741-C819 HydrophobicContact CG-CB 3.96Å; M741-C819 HydrophobicContact SD-CB 3.67Å; M741-C820 WeakPolarHBondContact CA-O 3.42Å; M741-H821 PolarHBondContact SD-CE1 2.84Å
742	L	88.2	Confident	75.6	Confident	12 Å²	12	61.5 Å²	61.5	6%	0.063	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.6	169.1	163.7	66.3	0	0	0	107.8	P721 V723 F744 F782 C820	P721-L742 HydrophobicContact CB-CD1 4.14Å; V723-L742 HydrophobicContact CG2-CB 4.43Å; V723-L742 HydrophobicContact CG2-CD1 3.68Å; L742-F744 HydrophobicContact CD1-CE1 4.45Å; L742-F744 HydrophobicContact CD1-CE2 4.09Å; L742-F744 HydrophobicContact CD1-CZ 3.91Å; L742-F744 HydrophobicContact CD2-CE2 3.65Å; L742-F744 HydrophobicContact CD2-CZ 3.62Å; L742-F744 HydrophobicContact CG-CD2 4.32Å; L742-F744 HydrophobicContact CG-CE2 3.52Å; L742-F744 HydrophobicContact CG-CZ 3.75Å; L742-F782 HydrophobicContact CD2-CD2 4.11Å; L742-F782 HydrophobicContact CD2-CE2 3.83Å; L742-C820 HydrophobicContact CB-CB 4.31Å; L742-C820 PolarHBondContact N-O 3.2Å; L742-C820 PolarHBondContact O-N 2.88Å
743	I	89.3	Confident	72.8	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.5	-168.7	-43.3	162.1	0	0	0	110	A712 I713 V716 P721 V722 T724 M741 L817 V818	A712-I743 HydrophobicContact CB-CD1 4.36Å; I713-I743 HydrophobicContact CG1-CD1 3.77Å; V716-I743 HydrophobicContact CG1-CG2 4.31Å; V716-I743 HydrophobicContact CG2-CB 3.78Å; V716-I743 HydrophobicContact CG2-CD1 4.13Å; V716-I743 HydrophobicContact CG2-CG2 3.67Å; P721-I743 CarbonylContact C-O 3.56Å; P721-I743 WeakPolarHBondContact CA-O 3.43Å; P721-I743 VanDerWaalsContact CB-O 3.29Å; P721-I743 WeakPolarHBondContact CB-O 3.04Å; V722-I743 PolarHBondContact N-O 3.31Å; V722-I743 PolarHBondContact O-N 3.08Å; T724-I743 HydrophobicContact CG2-CD1 4.13Å; M741-I743 HydrophobicContact CE-CD1 3.76Å; M741-I743 HydrophobicContact CE-CG1 3.83Å; M741-I743 HydrophobicContact CG-CG1 3.94Å; M741-I743 HydrophobicContact SD-CG1 4.48Å; I743-L817 HydrophobicContact CG2-CD1 3.67Å; I743-L817 HydrophobicContact CG2-CD2 3.81Å; I743-L817 HydrophobicContact CG2-CG 3.61Å; I743-V818 WeakPolarHBondContact CA-O 3.5Å
744	F	85.1	Confident	70.2	Confident	17 Å²	17	64.5 Å²	64.5	8%	0.075	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	155.3	175	-55	-94	0	0	0	111.1	P721 L742 I775 L817 V818	P721-F744 HydrophobicContact CB-CD1 3.59Å; P721-F744 HydrophobicContact CB-CE1 3.73Å; P721-F744 HydrophobicContact CB-CG 4.31Å; P721-F744 HydrophobicContact CG-CD1 4.28Å; P721-F744 HydrophobicContact CG-CE1 4.13Å; L742-F744 HydrophobicContact CD1-CE1 4.45Å; L742-F744 HydrophobicContact CD1-CE2 4.09Å; L742-F744 HydrophobicContact CD1-CZ 3.91Å; L742-F744 HydrophobicContact CD2-CE2 3.65Å; L742-F744 HydrophobicContact CD2-CZ 3.62Å; L742-F744 HydrophobicContact CG-CD2 4.32Å; L742-F744 HydrophobicContact CG-CE2 3.52Å; L742-F744 HydrophobicContact CG-CZ 3.75Å; F744-I775 HydrophobicContact CE1-CG2 4.39Å; F744-L817 WeakPolarHBondContact O-CA 3.08Å; F744-L817 WeakPolarHBondContact O-CD1 3.31Å; F744-V818 HydrophobicContact CB-CB 4.42Å; F744-V818 PolarHBondContact N-O 2.82Å; F744-V818 PolarHBondContact O-N 2.92Å
745	Y	85.5	Confident	67.4	Low	52 Å²	52	63.1 Å²	63.1	20%	0.204	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.4	173.1	-172.2	-83.4	0	0	0	110.3	T669 E718 K747 E815 L817	T669-Y745 HydrophobicContact CG2-CD2 3.96Å; T669-Y745 HydrophobicContact CG2-CE2 3.55Å; E718-Y745 HydrophobicContact CG-CD1 3.45Å; E718-Y745 VanDerWaalsContact CG-CD1 3.45Å; E718-Y745 HydrophobicContact CG-CE1 3.82Å; E718-Y745 HydrophobicContact CG-CG 4.44Å; Y745-K747 HydrophobicContact CE1-CG 4.02Å; Y745-E815 WeakPolarHBondContact OH-CG 3.27Å; Y745-E815 PolarHBondContact OH-OE1 2.97Å; Y745-L817 HydrophobicContact CD2-CD1 4.38Å
746	C	78.8	Confident	64.5	Low	35 Å²	35	62.5 Å²	62.5	24%	0.236	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.3	-176.3	-66.3	0	0	0	0	110.7	L816 V818	C746-L816 HydrophobicContact CB-CB 4.38Å; C746-L816 PolarHBondContact N-O 3.28Å; C746-L816 PolarHBondContact O-N 2.75Å; C746-V818 HydrophobicContact CB-CG2 4.42Å
747	K	72	Confident	61.4	Low	70 Å²	70	64.2 Å²	64.2	30%	0.304	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	144.3	167.4	-78.1	177.8	177.8	152.6	0	110.9	E718 Y745 S749 Y750 S814 E815	E718-K747 VanDerWaalsContact CD-CE 3.49Å; E718-K747 WeakPolarHBondContact OE1-CE 3.35Å; E718-K747 IonicContact OE1-NZ 3.82Å; E718-K747 PolarHBondContact OE1-NZ 2.8Å; E718-K747 WeakPolarHBondContact OE2-CD 3.46Å; E718-K747 WeakPolarHBondContact OE2-CE 3.36Å; E718-K747 IonicContact OE2-NZ 2.95Å; E718-K747 PolarHBondContact OE2-NZ 2.59Å; Y745-K747 HydrophobicContact CE1-CG 4.02Å; K747-S749 PolarHBondContact O-N 3.21Å; K747-S749 VanDerWaalsContact O-N 3.09Å; K747-Y750 WeakPolarHBondContact O-CD2 3.32Å; K747-S814 WeakPolarHBondContact CA-O 3.39Å; K747-E815 HydrophobicContact CG-CG 4.42Å
748	Q	54.1	Low	58.5	Low	53 Å²	53	68.7 Å²	68.7	25%	0.248	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-72.3	0.2	-179.6	-155.4	174.1	6.4	0	0	113.3	Y750 Y751 S813 S814	Q748-Y750 PolarHBondContact O-N 3.28Å; Q748-Y751 HydrophobicContact CB-CD2 4.45Å; Q748-Y751 HydrophobicContact CG-CD2 3.88Å; Q748-Y751 HydrophobicContact CG-CE2 4.1Å; Q748-Y751 HydrophobicContact CG-CG 4.37Å; Q748-Y751 VanDerWaalsContact O-CD2 3.28Å; Q748-Y751 WeakPolarHBondContact O-CD2 3.17Å; Q748-Y751 PolarHBondContact O-N 2.83Å; Q748-S813 PolarHBondContact OE1-O 3.06Å; Q748-S814 PolarHBondContact N-O 2.8Å
749	S	39.7	Very low	55.6	Low	88 Å²	88	72.7 Å²	72.7	62%	0.615	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-67.1	-15.1	178.1	47.9	0	0	0	0	115.2	K747 Y751	K747-S749 PolarHBondContact O-N 3.21Å; K747-S749 VanDerWaalsContact O-N 3.09Å; S749-Y751 VanDerWaalsContact C-N 3.33Å
750	Y	41.7	Very low	52.7	Low	111 Å²	111	77.2 Å²	77.2	44%	0.435	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-76.4	-17.1	177.5	-66.6	-78.3	0	0	0	114.1	K747 Q748 H752 Y770	K747-Y750 WeakPolarHBondContact O-CD2 3.32Å; Q748-Y750 PolarHBondContact O-N 3.28Å; Y750-H752 VanDerWaalsContact C-N 3.29Å; Y750-H752 PolarHBondContact O-N 3.05Å; Y750-Y770 WeakPolarHBondContact OH-CB 3.37Å; Y750-Y770 VanDerWaalsContact OH-CG 3.32Å
751	Y	34.4	Very low	49.8	Very low	66 Å²	66	81.4 Å²	81.4	26%	0.259	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-75.1	-14.3	-170.6	-72.2	-110.3	0	0	0	113.9	Q748 S749 L805 F808	Q748-Y751 HydrophobicContact CB-CD2 4.45Å; Q748-Y751 HydrophobicContact CG-CD2 3.88Å; Q748-Y751 HydrophobicContact CG-CE2 4.1Å; Q748-Y751 HydrophobicContact CG-CG 4.37Å; Q748-Y751 VanDerWaalsContact O-CD2 3.28Å; Q748-Y751 WeakPolarHBondContact O-CD2 3.17Å; Q748-Y751 PolarHBondContact O-N 2.83Å; S749-Y751 VanDerWaalsContact C-N 3.33Å; Y751-L805 HydrophobicContact CE1-CB 4.05Å; Y751-F808 HydrophobicContact CD1-CB 4.5Å; Y751-F808 HydrophobicContact CE1-CB 3.86Å; Y751-F808 HydrophobicContact CE1-CD2 4.28Å; Y751-F808 AromaticContact CE1-CG 3.96Å; Y751-F808 HydrophobicContact CE1-CG 3.96Å
752	H	31.5	Very low	46.9	Very low	159 Å²	159	89 Å²	89	74%	0.736	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-94.9	-4.9	-171.6	-135.9	-52.7	0	0	0	114.9	Y750	Y750-H752 VanDerWaalsContact C-N 3.29Å; Y750-H752 PolarHBondContact O-N 3.05Å
753	L	33.3	Very low	44	Very low	155 Å²	155	95.6 Å²	95.6	81%	0.812	53%	0.53	S	S	*	.	S	Bend	trans	-100.9	-12.3	-174.5	-130.3	72.9	0	0	0	114.4
754	S	31.6	Very low	41	Very low	87 Å²	87	106.3 Å²	106.3	61%	0.608	57%	0.571	S	S	*	*	S	Bend	trans	-89.2	-24.3	177	49.3	0	0	0	0	113.6
755	N	28.8	Very low	38.1	Very low	119 Å²	119	112.3 Å²	112.3	64%	0.636	60%	0.603	S	S	*	*	S	Bend	trans	-87.6	-1.9	-172	-70.3	1.9	0	0	0	114.1	S757	N755-S757 VanDerWaalsContact C-N 3.27Å; N755-S757 PolarHBondContact O-N 3.25Å; N755-S757 VanDerWaalsContact O-N 3.09Å
756	T	28.4	Very low	35.4	Very low	101 Å²	101	117.2 Å²	117.2	62%	0.62	63%	0.633	S	S	*	*			trans	-84.5	68	171.3	53.7	0	0	0	0	111.3	S758	T756-S758 PolarHBondContact O-N 3.46Å
757	S	26.2	Very low	32.7	Very low	108 Å²	108	122.6 Å²	122.6	76%	0.755	66%	0.659	S	S	*	*			trans	-67.7	121.8	160.6	-77.5	0	0	0	0	108.9	N755	N755-S757 VanDerWaalsContact C-N 3.27Å; N755-S757 PolarHBondContact O-N 3.25Å; N755-S757 VanDerWaalsContact O-N 3.09Å
758	S	25.4	Very low	30.5	Very low	104 Å²	104	129.5 Å²	129.5	73%	0.727	68%	0.684	S	S	*	*			trans	83.8	168.5	-171.9	84.6	0	0	0	0	116.5	T756	T756-S758 PolarHBondContact O-N 3.46Å
759	I	28.1	Very low	29.2	Very low	158 Å²	158	135.8 Å²	135.8	81%	0.81	71%	0.714	S	S	*	*			trans	69.5	79	-164	-47.2	177.5	0	0	0	111.8
760	S	27	Very low	28.6	Very low	96 Å²	96	137.1 Å²	137.1	67%	0.671	71%	0.706	S	S	*	*				74.2	95.4	84.3	-171.1	0	0	0	0	114.5
761	T	27.3	Very low	28.1	Very low	117 Å²	117	133.8 Å²	133.8	72%	0.718	70%	0.698	S	S	*	*			trans	27.2	101.3	137	53.1	0	0	0	0	118.4
762	N	27.9	Very low	28	Very low	162 Å²	162	135.1 Å²	135.1	87%	0.866	71%	0.708	S	S	*	*				-171.4	151.5	116.1	-101.2	-51.8	0	0	0	113.5
763	N	27.8	Very low	27.8	Very low	149 Å²	149	133.1 Å²	133.1	80%	0.797	70%	0.703	S	S	*	*			trans	-71.7	133.6	174	-68	-42.8	0	0	0	111.5
764	R	26.4	Very low	27.6	Very low	226 Å²	226	131 Å²	131	85%	0.853	69%	0.689	S	S	*	*				176.9	131.6	121.5	-95	152.6	-175.8	174.6	1.7	113.1
765	L	25.4	Very low	27.8	Very low	143 Å²	143	129.8 Å²	129.8	75%	0.749	68%	0.675	S	S	*	*			trans	43.6	104.2	141.2	-62	162	0	0	0	118.3
766	N	27.2	Very low	27.9	Very low	155 Å²	155	126.1 Å²	126.1	83%	0.829	66%	0.659	S	S	*	*				-168.3	150.9	120.6	-94.3	-30.8	0	0	0	112.1	Y768	N766-Y768 PolarHBondContact O-N 2.92Å
767	N	23.8	Very low	27.9	Very low	147 Å²	147	125.4 Å²	125.4	79%	0.786	65%	0.651	S	S	*	*			trans	-94.1	90.4	-164.4	-61.5	-18.9	0	0	0	113.3
768	Y	24.9	Very low	28.3	Very low	215 Å²	215	126 Å²	126	84%	0.843	64%	0.637	S	S	*	*			trans	-145.2	81.7	166.2	-69.7	-69.7	0	0	0	111.8	N766	N766-Y768 PolarHBondContact O-N 2.92Å
769	Q	25.7	Very low	28.6	Very low	185 Å²	185	122.8 Å²	122.8	86%	0.864	62%	0.615	S	S	*	*			trans	-112.7	86	177.7	-171.5	164.7	-5.3	0	0	110.7
770	Y	28.3	Very low	28.6	Very low	116 Å²	116	118.9 Å²	118.9	46%	0.455	59%	0.594	S	S	.	*			trans	-76.1	149.2	169.2	-87.5	-84.4	0	0	0	111.1	Y750 M772	Y750-Y770 WeakPolarHBondContact OH-CB 3.37Å; Y750-Y770 VanDerWaalsContact OH-CG 3.32Å; Y770-M772 PolarHBondContact O-N 3.3Å
771	P	31.3	Very low	28.9	Very low	41 Å²	41	117.2 Å²	117.2	27%	0.266	58%	0.578	S	S	.	*			trans	-105.6	84.3	-156.5	37.9	-30.9	0	0	0	113.4	N773 E774 I775	P771-N773 PolarHBondContact O-N 3.36Å; P771-N773 VanDerWaalsContact O-N 3.17Å; P771-E774 HydrophobicContact CB-CB 3.7Å; P771-E774 HydrophobicContact CB-CG 3.63Å; P771-E774 HydrophobicContact CG-CB 3.77Å; P771-E774 HydrophobicContact CG-CG 3.87Å; P771-E774 WeakPolarHBondContact CG-OE2 3.42Å; P771-E774 PolarHBondContact O-N 3.39Å; P771-I775 PolarHBondContact O-N 2.91Å
772	M	30.8	Very low	29.1	Very low	94 Å²	94	114.2 Å²	114.2	46%	0.463	56%	0.555	S	S	.	*	H	α-helix	trans	-53.7	-30.1	159.6	-73.6	-65.9	-71	0	0	111.3	Y770 E774 I775 S776 F802	Y770-M772 PolarHBondContact O-N 3.3Å; M772-E774 VanDerWaalsContact C-N 3.34Å; M772-E774 PolarHBondContact O-N 3.29Å; M772-I775 PolarHBondContact O-N 3.2Å; M772-I775 HydrophobicContact SD-CD1 4.13Å; M772-S776 PolarHBondContact O-N 3.29Å; M772-F802 HydrophobicContact CE-CE1 4.31Å; M772-F802 HydrophobicContact CE-CZ 4.23Å
773	N	28.4	Very low	29.2	Very low	118 Å²	118	108.1 Å²	108.1	63%	0.631	52%	0.522	S	S	*	.	H	α-helix	trans	-65.1	-31.7	172.8	-63.7	12.5	0	0	0	112.9	P771 S776 N777	P771-N773 PolarHBondContact O-N 3.36Å; P771-N773 VanDerWaalsContact O-N 3.17Å; N773-S776 WeakPolarHBondContact O-CB 3.33Å; N773-N777 WeakPolarHBondContact O-CB 3.12Å; N773-N777 PolarHBondContact O-N 3.41Å; N773-N777 PolarHBondContact O-ND2 3.25Å; N773-N777 PolarHBondContact O-OD1 3.09Å
774	E	29	Very low	29.3	Very low	111 Å²	111	106 Å²	106	52%	0.519	51%	0.507	S	S	.	.	H	α-helix	trans	-77.8	-33.9	173.8	-75.3	169.7	-146	0	0	111.8	P771 M772 S776 N777 Y778	P771-E774 HydrophobicContact CB-CB 3.7Å; P771-E774 HydrophobicContact CB-CG 3.63Å; P771-E774 HydrophobicContact CG-CB 3.77Å; P771-E774 HydrophobicContact CG-CG 3.87Å; P771-E774 WeakPolarHBondContact CG-OE2 3.42Å; P771-E774 PolarHBondContact O-N 3.39Å; M772-E774 VanDerWaalsContact C-N 3.34Å; M772-E774 PolarHBondContact O-N 3.29Å; E774-S776 VanDerWaalsContact C-N 3.28Å; E774-S776 PolarHBondContact O-N 3.02Å; E774-N777 CarbonylContact O-C 3.49Å; E774-N777 PolarHBondContact O-N 3.09Å; E774-Y778 WeakPolarHBondContact O-CD2 3.4Å; E774-Y778 PolarHBondContact O-N 3.17Å
775	I	36	Very low	29.6	Very low	61 Å²	61	100.7 Å²	100.7	31%	0.313	49%	0.492	S	S	.	.	H	α-helix	trans	-62.5	-42.1	171.3	-59	175.1	0	0	0	109.6	F744 P771 M772 Y778 C779	F744-I775 HydrophobicContact CE1-CG2 4.39Å; P771-I775 PolarHBondContact O-N 2.91Å; M772-I775 PolarHBondContact O-N 3.2Å; M772-I775 HydrophobicContact SD-CD1 4.13Å; I775-Y778 PolarHBondContact O-N 2.98Å; I775-C779 PolarHBondContact O-N 3.42Å; I775-C779 PolarHBondContact O-SG 3.49Å
776	S	30.1	Very low	29.9	Very low	42 Å²	42	98.2 Å²	98.2	29%	0.294	47%	0.473	S	S	.	.	H	α-helix	trans	-58.3	-51.3	169.6	-171.7	0	0	0	0	111.2	M772 N773 E774 Y778 C779 M780	M772-S776 PolarHBondContact O-N 3.29Å; N773-S776 WeakPolarHBondContact O-CB 3.33Å; E774-S776 VanDerWaalsContact C-N 3.28Å; E774-S776 PolarHBondContact O-N 3.02Å; S776-Y778 PolarHBondContact O-N 2.82Å; S776-C779 CarbonylContact O-C 3.59Å; S776-C779 PolarHBondContact O-N 3.14Å; S776-C779 VanDerWaalsContact O-N 3.15Å; S776-M780 VanDerWaalsContact O-CB 3.29Å; S776-M780 WeakPolarHBondContact O-CB 3.2Å; S776-M780 WeakPolarHBondContact O-CG 3.45Å; S776-M780 PolarHBondContact O-N 3.23Å
777	N	29.4	Very low	29.8	Very low	85 Å²	85	96.3 Å²	96.3	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-61.5	-38.4	178.8	-67.2	-8.4	0	0	0	112.4	N773 E774 M780 N781	N773-N777 WeakPolarHBondContact O-CB 3.12Å; N773-N777 PolarHBondContact O-N 3.41Å; N773-N777 PolarHBondContact O-ND2 3.25Å; N773-N777 PolarHBondContact O-OD1 3.09Å; E774-N777 CarbonylContact O-C 3.49Å; E774-N777 PolarHBondContact O-N 3.09Å; N777-M780 PolarHBondContact O-N 2.67Å; N777-N781 WeakPolarHBondContact O-CB 3.4Å; N777-N781 PolarHBondContact O-N 3.37Å; N777-N781 PolarHBondContact O-OD1 2.75Å
778	Y	33.9	Very low	30.1	Very low	120 Å²	120	96.3 Å²	96.3	47%	0.471	46%	0.459	S	S	.	.	H	α-helix	trans	-62.8	-44.4	173.8	-93.3	-79.5	0	0	0	111.3	E774 I775 S776 M780 F782	E774-Y778 WeakPolarHBondContact O-CD2 3.4Å; E774-Y778 PolarHBondContact O-N 3.17Å; I775-Y778 PolarHBondContact O-N 2.98Å; S776-Y778 PolarHBondContact O-N 2.82Å; Y778-M780 VanDerWaalsContact C-N 3.35Å; Y778-F782 VanDerWaalsContact O-CD2 3.23Å; Y778-F782 WeakPolarHBondContact O-CD2 3.3Å; Y778-F782 PolarHBondContact O-N 3.22Å
779	C	32	Very low	30.3	Very low	38 Å²	38	90.5 Å²	90.5	26%	0.257	44%	0.438	S	S	.	.	H	α-helix	trans	-67.6	-34.1	176.7	-62.7	0	0	0	0	112.8	I775 S776 N783	I775-C779 PolarHBondContact O-N 3.42Å; I775-C779 PolarHBondContact O-SG 3.49Å; S776-C779 CarbonylContact O-C 3.59Å; S776-C779 PolarHBondContact O-N 3.14Å; S776-C779 VanDerWaalsContact O-N 3.15Å; C779-N783 VanDerWaalsContact O-CG 3.3Å; C779-N783 PolarHBondContact O-ND2 3.42Å; C779-N783 VanDerWaalsContact O-ND2 3.16Å
780	M	28.9	Very low	30.5	Very low	75 Å²	75	86.5 Å²	86.5	37%	0.369	42%	0.423	S	S	.	.	H	α-helix	trans	-83.7	-40.7	-176.9	-66.7	-68.4	-87.1	0	0	112.4	S776 N777 Y778 F782 N783 E784 L799	S776-M780 VanDerWaalsContact O-CB 3.29Å; S776-M780 WeakPolarHBondContact O-CB 3.2Å; S776-M780 WeakPolarHBondContact O-CG 3.45Å; S776-M780 PolarHBondContact O-N 3.23Å; N777-M780 PolarHBondContact O-N 2.67Å; Y778-M780 VanDerWaalsContact C-N 3.35Å; M780-F782 PolarHBondContact O-N 2.94Å; M780-N783 CarbonylContact O-C 3.5Å; M780-N783 VanDerWaalsContact O-CA 3.31Å; M780-N783 WeakPolarHBondContact O-CA 3.47Å; M780-N783 WeakPolarHBondContact O-CB 3.43Å; M780-N783 PolarHBondContact O-N 2.83Å; M780-E784 WeakPolarHBondContact O-CG 3.42Å; M780-E784 PolarHBondContact O-N 3.35Å; M780-L799 HydrophobicContact CE-CD1 4.36Å; M780-L799 HydrophobicContact SD-CD1 3.99Å
781	N	32.3	Very low	30.4	Very low	62 Å²	62	86.7 Å²	86.7	33%	0.332	43%	0.432	S	S	.	.	H	α-helix	trans	-62	-31.9	174.9	-64.7	5.4	0	0	0	111.3	T193 N777 N783	T193-N781 HydrophobicContact CG2-CB 4.35Å; N777-N781 WeakPolarHBondContact O-CB 3.4Å; N777-N781 PolarHBondContact O-N 3.37Å; N777-N781 PolarHBondContact O-OD1 2.75Å; N781-N783 PolarHBondContact O-N 3.09Å
782	F	30.6	Very low	30.3	Very low	54 Å²	54	93.1 Å²	93.1	24%	0.237	46%	0.455	C	S	.	.	H	α-helix	trans	-69.7	-15	170	-92.8	-56.4	0	0	0	113.8	L659 L742 Y778 M780	L659-F782 HydrophobicContact CB-CB 3.92Å; L659-F782 HydrophobicContact CD1-CB 4.11Å; L659-F782 HydrophobicContact CD1-CD1 3.7Å; L659-F782 HydrophobicContact CD1-CE1 4.43Å; L659-F782 HydrophobicContact CD1-CG 4.19Å; L659-F782 HydrophobicContact CD2-CB 3.91Å; L659-F782 HydrophobicContact CD2-CD1 3.71Å; L659-F782 HydrophobicContact CD2-CD2 4.03Å; L659-F782 HydrophobicContact CD2-CE1 4.15Å; L659-F782 HydrophobicContact CD2-CE2 4.47Å; L659-F782 HydrophobicContact CD2-CG 3.65Å; L659-F782 HydrophobicContact CG-CB 4.18Å; L659-F782 HydrophobicContact CG-CD1 4.27Å; L659-F782 HydrophobicContact CG-CG 4.34Å; L742-F782 HydrophobicContact CD2-CD2 4.11Å; L742-F782 HydrophobicContact CD2-CE2 3.83Å; Y778-F782 VanDerWaalsContact O-CD2 3.23Å; Y778-F782 WeakPolarHBondContact O-CD2 3.3Å; Y778-F782 PolarHBondContact O-N 3.22Å; M780-F782 PolarHBondContact O-N 2.94Å
783	N	31.8	Very low	30.1	Very low	33 Å²	33	97.5 Å²	97.5	18%	0.176	48%	0.475	C	S	.	.	H	α-helix	trans	-104.9	-28.6	178	-68.6	-19.5	0	0	0	114	L659 S660 C779 M780 N781 H785 Y786	L659-N783 WeakPolarHBondContact CA-OD1 3.33Å; S660-N783 PolarHBondContact N-OD1 3.28Å; C779-N783 VanDerWaalsContact O-CG 3.3Å; C779-N783 PolarHBondContact O-ND2 3.42Å; C779-N783 VanDerWaalsContact O-ND2 3.16Å; M780-N783 CarbonylContact O-C 3.5Å; M780-N783 VanDerWaalsContact O-CA 3.31Å; M780-N783 WeakPolarHBondContact O-CA 3.47Å; M780-N783 WeakPolarHBondContact O-CB 3.43Å; M780-N783 PolarHBondContact O-N 2.83Å; N781-N783 PolarHBondContact O-N 3.09Å; N783-H785 PolarHBondContact O-N 2.94Å; N783-Y786 PolarHBondContact O-N 2.98Å
784	E	29.2	Very low	29.9	Very low	105 Å²	105	99.5 Å²	99.5	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-60.1	-30.3	-173.1	-81.5	-178	165.1	0	0	113.4	M780 Y786 M787	M780-E784 WeakPolarHBondContact O-CG 3.42Å; M780-E784 PolarHBondContact O-N 3.35Å; E784-Y786 PolarHBondContact O-N 3.26Å; E784-M787 PolarHBondContact O-N 3.31Å
785	H	32.1	Very low	29.7	Very low	114 Å²	114	98 Å²	98	53%	0.528	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-0.6	171.8	-92.7	68.1	0	0	0	114.9	N783	N783-H785 PolarHBondContact O-N 2.94Å
786	Y	31.2	Very low	29.4	Very low	91 Å²	91	101.3 Å²	101.3	36%	0.357	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-1.5	177.5	-109.6	-86.2	0	0	0	115.2	Q580 T657 N783 E784	Q580-Y786 PolarHBondContact NE2-OH 3.47Å; Q580-Y786 PolarHBondContact OE1-OH 2.82Å; T657-Y786 PolarHBondContact OG1-OH 3.37Å; N783-Y786 PolarHBondContact O-N 2.98Å; E784-Y786 PolarHBondContact O-N 3.26Å
787	M	27	Very low	29.3	Very low	115 Å²	115	102.2 Å²	102.2	57%	0.567	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-1.7	-167.6	-73.9	-92.7	65.2	0	0	116.5	E784 K789	E784-M787 PolarHBondContact O-N 3.31Å; M787-K789 PolarHBondContact O-N 2.92Å
788	I	29.7	Very low	29.3	Very low	148 Å²	148	104.1 Å²	104.1	76%	0.759	52%	0.521	S	S	*	.	S	Bend	trans	-79.1	54.1	-179.1	-42.1	-177.7	0	0	0	112.7
789	K	28.7	Very low	29.1	Very low	93 Å²	93	102.4 Å²	102.4	40%	0.404	52%	0.519	S	S	.	.			trans	179.5	94.4	147.7	-99.8	-165.1	-146.3	161.2	0	109.5	L406 S410 M787	L406-K789 HydrophobicContact CD1-CB 4.18Å; L406-K789 HydrophobicContact CD2-CB 3.92Å; L406-K789 HydrophobicContact CD2-CD 3.57Å; L406-K789 HydrophobicContact CD2-CG 3.9Å; L406-K789 HydrophobicContact CG-CB 3.96Å; L406-K789 HydrophobicContact CG-CD 4.02Å; L406-K789 HydrophobicContact CG-CG 4.41Å; S410-K789 VanDerWaalsContact CB-NZ 3.31Å; S410-K789 WeakPolarHBondContact OG-CE 3.37Å; S410-K789 PolarHBondContact OG-NZ 3.11Å; M787-K789 PolarHBondContact O-N 2.92Å
790	N	29.2	Very low	29	Very low	100 Å²	100	103.1 Å²	103.1	54%	0.535	53%	0.533	S	S	.	.			trans	-156.6	126.2	135	-103.4	-17.5	0	0	0	107.5
791	D	26.4	Very low	28.9	Very low	121 Å²	121	104.2 Å²	104.2	65%	0.647	54%	0.54	S	S	*	.			trans	-67.4	132.5	-180	-89.4	-88.2	0	0	0	111.4	H793	D791-H793 PolarHBondContact O-N 3.02Å
792	K	28.7	Very low	28.9	Very low	175 Å²	175	107.2 Å²	107.2	76%	0.761	55%	0.551	S	S	*	*	S	Bend	trans	52.2	63.3	142.9	-52.4	170.4	-171.9	176	0	117.2
793	H	26.6	Very low	29.1	Very low	187 Å²	187	109.1 Å²	109.1	87%	0.866	56%	0.564	S	S	*	*			trans	-169.7	77.8	149.2	-94.1	-62.5	0	0	0	110.4	D791	D791-H793 PolarHBondContact O-N 3.02Å
794	F	25.3	Very low	29.3	Very low	159 Å²	159	114.5 Å²	114.5	70%	0.697	59%	0.588	S	S	*	*			trans	-145.4	107.3	165.3	-106.3	-86.3	0	0	0	109	E798	F794-E798 HydrophobicContact CD1-CB 4.19Å; F794-E798 HydrophobicContact CE1-CB 3.85Å; F794-E798 HydrophobicContact CE1-CG 4.27Å; F794-E798 WeakPolarHBondContact CE1-OE2 3.29Å
795	S	24.7	Very low	29.8	Very low	79 Å²	79	111.5 Å²	111.5	55%	0.552	58%	0.575	S	S	*	*			trans	-79.6	159.9	169.6	40.8	0	0	0	0	110.5	S797	S795-S797 PolarHBondContact O-N 2.71Å; S795-S797 PolarHBondContact OG-OG 2.63Å
796	S	28.9	Very low	29.8	Very low	132 Å²	132	111.2 Å²	111.2	92%	0.923	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	37.4	177.7	59.6	0	0	0	0	113.7
797	S	29	Very low	30.1	Very low	61 Å²	61	110.2 Å²	110.2	43%	0.427	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.8	-5.3	-175.7	53	0	0	0	0	113.2	S795	S795-S797 PolarHBondContact O-N 2.71Å; S795-S797 PolarHBondContact OG-OG 2.63Å
798	E	30.3	Very low	30.7	Very low	125 Å²	125	105.3 Å²	105.3	58%	0.584	56%	0.559	S	S	*	*			trans	-110.5	1.7	-175.7	-67.9	-173.5	-134.7	0	0	114.1	F794 G800	F794-E798 HydrophobicContact CD1-CB 4.19Å; F794-E798 HydrophobicContact CE1-CB 3.85Å; F794-E798 HydrophobicContact CE1-CG 4.27Å; F794-E798 WeakPolarHBondContact CE1-OE2 3.29Å; E798-G800 PolarHBondContact O-N 2.8Å
799	L	29.5	Very low	31.2	Very low	84 Å²	84	106.1 Å²	106.1	44%	0.44	57%	0.565	S	S	.	*	S	Bend	trans	-69.1	95.6	141.3	-93.4	74.9	0	0	0	105.5	M780 N801	M780-L799 HydrophobicContact CE-CD1 4.36Å; M780-L799 HydrophobicContact SD-CD1 3.99Å; L799-N801 PolarHBondContact O-N 3.08Å
800	G	28.9	Very low	31.7	Very low	53 Å²	53	111 Å²	111	55%	0.546	59%	0.586	S	S	.	*			trans	-45.7	128.2	-172.8	0	0	0	0	0	112.1	E798 F802	E798-G800 PolarHBondContact O-N 2.8Å; G800-F802 PolarHBondContact O-N 2.96Å
801	N	27.5	Very low	32.3	Very low	97 Å²	97	107.2 Å²	107.2	52%	0.519	57%	0.567	S	S	.	*			trans	-44.9	130.8	-166	-78.8	19.5	0	0	0	112.5	L799 D803 E804	L799-N801 PolarHBondContact O-N 3.08Å; N801-D803 HydrophobicContact CB-CB 4.01Å; N801-D803 WeakPolarHBondContact CB-OD2 3.49Å; N801-D803 PolarHBondContact ND2-OD2 2.87Å; N801-D803 PolarHBondContact O-N 3.43Å; N801-E804 PolarHBondContact O-N 3.42Å
802	F	31.8	Very low	33	Very low	125 Å²	125	108.5 Å²	108.5	55%	0.548	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-62.2	-1	169.8	-75.7	-79.8	0	0	0	113.2	M772 G800 E804 L805	M772-F802 HydrophobicContact CE-CE1 4.31Å; M772-F802 HydrophobicContact CE-CZ 4.23Å; G800-F802 PolarHBondContact O-N 2.96Å; F802-E804 PolarHBondContact O-N 2.94Å; F802-L805 HydrophobicContact CB-CD1 4.39Å; F802-L805 HydrophobicContact CD1-CD1 3.84Å; F802-L805 HydrophobicContact CD1-CG 4.43Å; F802-L805 WeakPolarHBondContact O-CB 3.41Å; F802-L805 WeakPolarHBondContact O-CG 3.1Å; F802-L805 PolarHBondContact O-N 3.39Å
803	D	34.3	Very low	34	Very low	95 Å²	95	100.9 Å²	100.9	51%	0.508	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-58.1	-20.6	170.6	-62.4	-37.3	0	0	0	114	N801 L805 N806	N801-D803 HydrophobicContact CB-CB 4.01Å; N801-D803 WeakPolarHBondContact CB-OD2 3.49Å; N801-D803 PolarHBondContact ND2-OD2 2.87Å; N801-D803 PolarHBondContact O-N 3.43Å; D803-L805 PolarHBondContact O-N 2.79Å; D803-N806 WeakPolarHBondContact CA-ND2 3.36Å; D803-N806 VanDerWaalsContact O-CB 3.22Å; D803-N806 WeakPolarHBondContact O-CB 3.37Å; D803-N806 PolarHBondContact O-N 3.47Å; D803-N806 PolarHBondContact O-ND2 3.14Å
804	E	37.4	Very low	35.5	Very low	146 Å²	146	95.3 Å²	95.3	68%	0.682	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-62.9	-21.5	169.7	-69.2	-164.1	140.5	0	0	112.3	N801 F802 N806 S807	N801-E804 PolarHBondContact O-N 3.42Å; F802-E804 PolarHBondContact O-N 2.94Å; E804-N806 PolarHBondContact O-N 3.27Å; E804-S807 PolarHBondContact O-N 3Å; E804-S807 PolarHBondContact O-OG 3.48Å
805	L	38.9	Very low	37.8	Very low	42 Å²	42	90.4 Å²	90.4	22%	0.22	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-70.6	-9.3	171.8	-58.6	-177.1	0	0	0	113.6	Y751 F802 D803 S807 F808	Y751-L805 HydrophobicContact CE1-CB 4.05Å; F802-L805 HydrophobicContact CB-CD1 4.39Å; F802-L805 HydrophobicContact CD1-CD1 3.84Å; F802-L805 HydrophobicContact CD1-CG 4.43Å; F802-L805 WeakPolarHBondContact O-CB 3.41Å; F802-L805 WeakPolarHBondContact O-CG 3.1Å; F802-L805 PolarHBondContact O-N 3.39Å; D803-L805 PolarHBondContact O-N 2.79Å; L805-S807 PolarHBondContact O-N 3.26Å; L805-F808 HydrophobicContact CB-CD2 4.32Å; L805-F808 HydrophobicContact CD2-CD2 4.13Å; L805-F808 HydrophobicContact CD2-CE2 3.61Å; L805-F808 HydrophobicContact CD2-CZ 4.33Å; L805-F808 WeakPolarHBondContact O-CD2 3.44Å; L805-F808 PolarHBondContact O-N 3.12Å
806	N	32.6	Very low	40.7	Very low	107 Å²	107	86.8 Å²	86.8	57%	0.572	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-68.2	-0.6	173.2	-65.2	-43.5	0	0	0	113.2	D803 E804	D803-N806 WeakPolarHBondContact CA-ND2 3.36Å; D803-N806 VanDerWaalsContact O-CB 3.22Å; D803-N806 WeakPolarHBondContact O-CB 3.37Å; D803-N806 PolarHBondContact O-N 3.47Å; D803-N806 PolarHBondContact O-ND2 3.14Å; E804-N806 PolarHBondContact O-N 3.27Å
807	S	36.8	Very low	43.5	Very low	70 Å²	70	80.8 Å²	80.8	49%	0.49	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-85.7	-6.3	174.5	60.4	0	0	0	0	114.7	E804 L805 D809	E804-S807 PolarHBondContact O-N 3Å; E804-S807 PolarHBondContact O-OG 3.48Å; L805-S807 PolarHBondContact O-N 3.26Å; S807-D809 VanDerWaalsContact C-N 3.3Å; S807-D809 PolarHBondContact O-N 2.92Å
808	F	39.9	Very low	46.3	Very low	13 Å²	13	78.9 Å²	78.9	6%	0.057	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-76.3	-0.8	-167.7	-88.3	-99.8	0	0	0	116.8	Y666 Y751 L805 K810 C811 L816	Y666-F808 HydrophobicContact CD1-CZ 4.31Å; Y751-F808 HydrophobicContact CD1-CB 4.5Å; Y751-F808 HydrophobicContact CE1-CB 3.86Å; Y751-F808 HydrophobicContact CE1-CD2 4.28Å; Y751-F808 AromaticContact CE1-CG 3.96Å; Y751-F808 HydrophobicContact CE1-CG 3.96Å; L805-F808 HydrophobicContact CB-CD2 4.32Å; L805-F808 HydrophobicContact CD2-CD2 4.13Å; L805-F808 HydrophobicContact CD2-CE2 3.61Å; L805-F808 HydrophobicContact CD2-CZ 4.33Å; L805-F808 WeakPolarHBondContact O-CD2 3.44Å; L805-F808 PolarHBondContact O-N 3.12Å; F808-K810 PolarHBondContact O-N 3.44Å; F808-C811 HydrophobicContact CD1-CB 3.97Å; F808-C811 WeakPolarHBondContact O-CB 3.33Å; F808-C811 PolarHBondContact O-N 3.14Å; F808-L816 HydrophobicContact CD1-CD1 3.86Å; F808-L816 HydrophobicContact CE1-CD1 3.45Å; F808-L816 VanDerWaalsContact CE1-CD1 3.45Å; F808-L816 HydrophobicContact CE1-CD2 3.86Å; F808-L816 HydrophobicContact CE1-CG 4.31Å; F808-L816 HydrophobicContact CZ-CD1 4.39Å
809	D	39.3	Very low	49.1	Very low	164 Å²	164	73 Å²	73	88%	0.877	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-56.2	-10.5	178.9	-83.6	-3.1	0	0	0	115.7	S807	S807-D809 VanDerWaalsContact C-N 3.3Å; S807-D809 PolarHBondContact O-N 2.92Å
810	K	40.2	Very low	51.9	Low	195 Å²	195	69.5 Å²	69.5	85%	0.848	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-106	-2.5	178	-67.7	175.7	-177.8	169.1	0	114.1	F808 T812	F808-K810 PolarHBondContact O-N 3.44Å; K810-T812 PolarHBondContact O-N 3.05Å
811	C	42	Very low	54.7	Low	21 Å²	21	67 Å²	67	14%	0.142	36%	0.357	C	S	.	.			trans	-84.9	112.7	-177	-162.8	0	0	0	0	111.2	F808 S813	F808-C811 HydrophobicContact CD1-CB 3.97Å; F808-C811 WeakPolarHBondContact O-CB 3.33Å; F808-C811 PolarHBondContact O-N 3.14Å; C811-S813 PolarHBondContact SG-OG 3.2Å
812	T	41.3	Very low	57.3	Low	149 Å²	149	64.6 Å²	64.6	91%	0.914	34%	0.342	S	S	*	.			trans	-89.8	-2.5	-178.2	54.2	0	0	0	0	114.1	K810	K810-T812 PolarHBondContact O-N 3.05Å
813	S	49.8	Very low	59.6	Low	14 Å²	14	59.4 Å²	59.4	10%	0.098	32%	0.32	C	S	.	.			trans	-98.9	113.5	173.1	53	0	0	0	0	110.7	S668 Q748 C811 E815	S668-S813 PolarHBondContact OG-OG 3.47Å; Q748-S813 PolarHBondContact OE1-O 3.06Å; C811-S813 PolarHBondContact SG-OG 3.2Å; S813-E815 PolarHBondContact O-N 2.99Å
814	S	58.3	Low	61	Low	71 Å²	71	56.2 Å²	56.2	50%	0.497	31%	0.305	S	S	.	.	S	Bend	trans	-60.7	2.3	176.2	50.7	0	0	0	0	115.5	K747 Q748	K747-S814 WeakPolarHBondContact CA-O 3.39Å; Q748-S814 PolarHBondContact N-O 2.8Å
815	E	73.4	Confident	61.5	Low	55 Å²	55	53.6 Å²	53.6	26%	0.257	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	128	-166.7	-60	177.3	136.6	0	0	107.8	T669 Y745 K747 S813	T669-E815 HydrophobicContact CG2-CB 3.89Å; Y745-E815 WeakPolarHBondContact OH-CG 3.27Å; Y745-E815 PolarHBondContact OH-OE1 2.97Å; K747-E815 HydrophobicContact CG-CG 4.42Å; S813-E815 PolarHBondContact O-N 2.99Å
816	L	84.5	Confident	61.2	Low	4 Å²	4	59.4 Å²	59.4	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.6	-170.6	-73.6	160	0	0	0	109.9	I675 C746 F808	I675-L816 HydrophobicContact CD1-CD2 3.49Å; I675-L816 VanDerWaalsContact CD1-CD2 3.49Å; C746-L816 HydrophobicContact CB-CB 4.38Å; C746-L816 PolarHBondContact N-O 3.28Å; C746-L816 PolarHBondContact O-N 2.75Å; F808-L816 HydrophobicContact CD1-CD1 3.86Å; F808-L816 HydrophobicContact CE1-CD1 3.45Å; F808-L816 VanDerWaalsContact CE1-CD1 3.45Å; F808-L816 HydrophobicContact CE1-CD2 3.86Å; F808-L816 HydrophobicContact CE1-CG 4.31Å; F808-L816 HydrophobicContact CZ-CD1 4.39Å
817	L	88.1	Confident	61.3	Low	6 Å²	6	60 Å²	60	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.7	172.5	-162.6	80.1	0	0	0	108.9	H667 T669 L672 I713 V716 I743 F744 Y745	H667-L817 HydrophobicContact CB-CB 4.28Å; H667-L817 PolarHBondContact N-O 3.22Å; H667-L817 PolarHBondContact O-N 2.78Å; T669-L817 HydrophobicContact CG2-CB 4.32Å; L672-L817 HydrophobicContact CD2-CD2 3.52Å; I713-L817 HydrophobicContact CG2-CD2 4.11Å; V716-L817 HydrophobicContact CB-CD1 4.4Å; V716-L817 HydrophobicContact CG1-CD1 4.12Å; I743-L817 HydrophobicContact CG2-CD1 3.67Å; I743-L817 HydrophobicContact CG2-CD2 3.81Å; I743-L817 HydrophobicContact CG2-CG 3.61Å; F744-L817 WeakPolarHBondContact O-CA 3.08Å; F744-L817 WeakPolarHBondContact O-CD1 3.31Å; Y745-L817 HydrophobicContact CD2-CD1 4.38Å
818	V	88.5	Confident	61.1	Low	21 Å²	21	59.9 Å²	59.9	13%	0.127	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.5	-179.1	-172.5	0	0	0	0	109.1	Y666 I743 F744 C746	Y666-V818 HydrophobicContact CD1-CG1 4.24Å; Y666-V818 HydrophobicContact CD1-CG2 3.99Å; Y666-V818 HydrophobicContact CE1-CG1 4.03Å; Y666-V818 HydrophobicContact CE1-CG2 4.17Å; I743-V818 WeakPolarHBondContact CA-O 3.5Å; F744-V818 HydrophobicContact CB-CB 4.42Å; F744-V818 PolarHBondContact N-O 2.82Å; F744-V818 PolarHBondContact O-N 2.92Å; C746-V818 HydrophobicContact CB-CG2 4.42Å
819	C	89.1	Confident	60.5	Low	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.9	-175.4	-70.4	0	0	0	0	110.5	R664 T665 M741 H821	R664-C819 CarbonylContact C-O 3.45Å; R664-C819 WeakPolarHBondContact CA-O 3.36Å; T665-C819 PolarHBondContact N-O 3.01Å; T665-C819 PolarHBondContact O-N 2.65Å; T665-C819 WeakPolarHBondContact OG1-CB 3.36Å; M741-C819 HydrophobicContact CG-CB 3.96Å; M741-C819 HydrophobicContact SD-CB 3.67Å; C819-H821 PolarHBondContact O-CD2 3.32Å
820	C	88.5	Confident	60.1	Low	12 Å²	12	60.5 Å²	60.5	8%	0.081	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.2	174.6	-67.7	0	0	0	0	109.4	M741 L742	M741-C820 WeakPolarHBondContact CA-O 3.42Å; L742-C820 HydrophobicContact CB-CB 4.31Å; L742-C820 PolarHBondContact N-O 3.2Å; L742-C820 PolarHBondContact O-N 2.88Å
821	H	86.9	Confident	59.8	Low	0 Å²	0	56 Å²	56	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124.5	-176.2	-59.5	-105.9	0	0	0	111.8	S662 C663 T665 F681 Y727 R740 M741 C819 L823	S662-H821 CarbonylContact C-O 3.57Å; S662-H821 WeakPolarHBondContact CA-O 3.32Å; C663-H821 HydrophobicContact CB-CB 4.44Å; C663-H821 PolarHBondContact N-O 2.78Å; C663-H821 PolarHBondContact O-CD2 3.46Å; C663-H821 PolarHBondContact O-N 2.92Å; T665-H821 PolarHBondContact OG1-CD2 2.81Å; T665-H821 PolarHBondContact OG1-NE2 3.18Å; F681-H821 HydrophobicContact CD2-CB 4.31Å; F681-H821 AromaticContact CD2-CD2 3.94Å; F681-H821 HydrophobicContact CE2-CB 4.18Å; F681-H821 AromaticContact CE2-CD2 3.72Å; F681-H821 AromaticContact CE2-CE1 3.94Å; F681-H821 AromaticContact CE2-CG 3.68Å; F681-H821 AromaticContact CE2-ND1 3.82Å; F681-H821 AromaticContact CE2-NE2 3.89Å; Y727-H821 PolarHBondContact OH-CE1 3.12Å; Y727-H821 PolarHBondContact OH-ND1 3.29Å; R740-H821 WeakPolarHBondContact O-CA 3.11Å; M741-H821 PolarHBondContact SD-CE1 2.84Å; C819-H821 PolarHBondContact O-CD2 3.32Å; H821-L823 HydrophobicContact CB-CD2 4.2Å
822	Q	82.3	Confident	59.4	Low	47 Å²	47	59.3 Å²	59.3	22%	0.22	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	106.5	165.9	-173.5	179.8	32.6	0	0	108.4	T657 A739 R740	T657-Q822 PolarHBondContact O-NE2 2.81Å; A739-Q822 CarbonylContact C-O 3.52Å; A739-Q822 WeakPolarHBondContact CA-O 3.21Å; R740-Q822 PolarHBondContact N-O 2.98Å; R740-Q822 PolarHBondContact O-N 3.27Å
823	L	79.3	Confident	59	Low	15 Å²	15	55.6 Å²	55.6	8%	0.079	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	141.6	178.6	-54.2	-173.4	0	0	0	110.6	Q684 L729 A739 H821	Q684-L823 HydrophobicContact CB-CD1 3.78Å; L729-L823 HydrophobicContact CD2-CD2 3.68Å; A739-L823 HydrophobicContact CB-CD2 3.51Å; H821-L823 HydrophobicContact CB-CD2 4.2Å
824	S	63.8	Low	58.2	Low	28 Å²	28	62.4 Å²	62.4	20%	0.196	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.7	177.2	73.3	0	0	0	0	111.7	W738 F826	W738-S824 WeakPolarHBondContact CB-OG 3.46Å; W738-S824 WeakPolarHBondContact O-CB 3.06Å; W738-S824 PolarHBondContact O-N 3.48Å; W738-S824 PolarHBondContact O-OG 3.35Å; S824-F826 PolarHBondContact O-N 3.23Å
825	H	49.1	Very low	56.9	Low	91 Å²	91	61 Å²	61	42%	0.421	32%	0.315	S	S	.	.			trans	-75.7	18.8	-176.7	-62.7	-59.9	0	0	0	114.6	Y827	H825-Y827 VanDerWaalsContact C-N 3.31Å; H825-Y827 WeakPolarHBondContact O-CD2 2.88Å; H825-Y827 PolarHBondContact O-N 2.78Å
826	F	31.6	Very low	55	Low	165 Å²	165	59.7 Å²	59.7	72%	0.724	31%	0.312	S	S	*	.			trans	-76.1	82.7	172.7	-75.7	-72.9	0	0	0	110.6	S824	S824-F826 PolarHBondContact O-N 3.23Å
827	Y	34.2	Very low	52.8	Low	118 Å²	118	63.1 Å²	63.1	46%	0.463	33%	0.333	S	S	.	.			trans	-61.7	148.7	165.1	-63.9	-77.8	0	0	0	110.7	L731 H825 C829	L731-Y827 HydrophobicContact CD1-CE1 4.36Å; H825-Y827 VanDerWaalsContact C-N 3.31Å; H825-Y827 WeakPolarHBondContact O-CD2 2.88Å; H825-Y827 PolarHBondContact O-N 2.78Å; Y827-C829 PolarHBondContact O-N 2.74Å; Y827-C829 VanDerWaalsContact O-N 3.12Å
828	H	32.4	Very low	50.3	Low	69 Å²	69	66.5 Å²	66.5	32%	0.319	35%	0.354	S	S	.	.			trans	-69.4	111.6	178.1	-150.7	-21.4	0	0	0	109.9	N830 D831	H828-N830 PolarHBondContact CE1-ND2 2.82Å; H828-N830 PolarHBondContact O-N 3.45Å; H828-D831 WeakPolarHBondContact CB-OD2 3.21Å; H828-D831 PolarHBondContact O-N 3.32Å
829	C	28	Very low	47.6	Very low	91 Å²	91	71.8 Å²	71.8	62%	0.615	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-3.5	-179.9	-65.5	0	0	0	0	115	Y827	Y827-C829 PolarHBondContact O-N 2.74Å; Y827-C829 VanDerWaalsContact O-N 3.12Å
830	N	31.2	Very low	45.1	Very low	98 Å²	98	76.8 Å²	76.8	52%	0.524	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-39.9	178.8	-64.6	-0.4	0	0	0	111.1	H828 L832 S833	H828-N830 PolarHBondContact CE1-ND2 2.82Å; H828-N830 PolarHBondContact O-N 3.45Å; N830-L832 PolarHBondContact O-N 3.37Å; N830-S833 VanDerWaalsContact O-CB 3.24Å; N830-S833 WeakPolarHBondContact O-CB 3.37Å; N830-S833 PolarHBondContact O-N 3.14Å; N830-S833 PolarHBondContact O-OG 2.79Å
831	D	34.5	Very low	42.8	Very low	102 Å²	102	82.6 Å²	82.6	55%	0.545	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.9	-178.7	-50.2	-10	0	0	0	111.6	H828 S833 E834	H828-D831 WeakPolarHBondContact CB-OD2 3.21Å; H828-D831 PolarHBondContact O-N 3.32Å; D831-S833 PolarHBondContact O-N 3.28Å; D831-E834 PolarHBondContact O-N 3.35Å
832	L	32.4	Very low	40.4	Very low	90 Å²	90	87.4 Å²	87.4	47%	0.471	45%	0.445	S	S	.	.	H	α-helix	trans	-63.4	-15.2	170.2	-71.8	175.5	0	0	0	113.3	N830 S835 S836	N830-L832 PolarHBondContact O-N 3.37Å; L832-S835 WeakPolarHBondContact CA-OG 3.36Å; L832-S835 PolarHBondContact O-OG 2.86Å; L832-S836 WeakPolarHBondContact O-CB 3.1Å; L832-S836 PolarHBondContact O-N 3.42Å; L832-S836 PolarHBondContact O-OG 3.38Å
833	S	32.5	Very low	38.4	Very low	70 Å²	70	89.4 Å²	89.4	49%	0.49	46%	0.456	S	S	.	.	H	α-helix	trans	-69.3	-35	178.4	65.5	0	0	0	0	113.2	N830 D831 S836 V837	N830-S833 VanDerWaalsContact O-CB 3.24Å; N830-S833 WeakPolarHBondContact O-CB 3.37Å; N830-S833 PolarHBondContact O-N 3.14Å; N830-S833 PolarHBondContact O-OG 2.79Å; D831-S833 PolarHBondContact O-N 3.28Å; S833-S836 WeakPolarHBondContact CA-OG 3.22Å; S833-S836 PolarHBondContact O-OG 3.26Å; S833-V837 VanDerWaalsContact O-CG2 3.28Å; S833-V837 WeakPolarHBondContact O-CG2 3.42Å; S833-V837 PolarHBondContact O-N 3.46Å
834	E	33.2	Very low	36.5	Very low	157 Å²	157	91.5 Å²	91.5	73%	0.734	47%	0.472	S	S	*	.	H	α-helix	trans	-76.1	-43.1	173.7	-63.3	-163	141.6	0	0	111.1	D831 S836 V837 T838	D831-E834 PolarHBondContact O-N 3.35Å; E834-S836 VanDerWaalsContact C-N 3.33Å; E834-S836 PolarHBondContact O-N 3.47Å; E834-V837 PolarHBondContact O-N 3.35Å; E834-T838 PolarHBondContact O-N 2.97Å
835	S	31.5	Very low	35.4	Very low	43 Å²	43	95.6 Å²	95.6	30%	0.301	49%	0.492	S	S	.	.	H	α-helix	trans	-71.1	-24.9	179.5	68.7	0	0	0	0	114	L832 T838 F839	L832-S835 WeakPolarHBondContact CA-OG 3.36Å; L832-S835 PolarHBondContact O-OG 2.86Å; S835-T838 WeakPolarHBondContact CA-OG1 3.27Å; S835-T838 PolarHBondContact O-OG1 3.49Å; S835-F839 WeakPolarHBondContact O-CB 3.33Å; S835-F839 PolarHBondContact O-N 3.04Å
836	S	33.9	Very low	34.9	Very low	26 Å²	26	98 Å²	98	18%	0.182	50%	0.503	C	S	.	.	H	α-helix	trans	-76.8	-35.6	170.6	54	0	0	0	0	111.6	L832 S833 E834 T838 F839 E840	L832-S836 WeakPolarHBondContact O-CB 3.1Å; L832-S836 PolarHBondContact O-N 3.42Å; L832-S836 PolarHBondContact O-OG 3.38Å; S833-S836 WeakPolarHBondContact CA-OG 3.22Å; S833-S836 PolarHBondContact O-OG 3.26Å; E834-S836 VanDerWaalsContact C-N 3.33Å; E834-S836 PolarHBondContact O-N 3.47Å; S836-T838 VanDerWaalsContact C-N 3.28Å; S836-T838 PolarHBondContact O-N 3.2Å; S836-F839 PolarHBondContact O-N 3.46Å; S836-E840 WeakPolarHBondContact O-CB 3.25Å; S836-E840 WeakPolarHBondContact O-CG 3.31Å; S836-E840 PolarHBondContact O-N 2.85Å
837	V	38.4	Very low	35.1	Very low	76 Å²	76	96.1 Å²	96.1	46%	0.461	50%	0.5	S	S	.	.	H	α-helix	trans	-66.5	-29.6	171.2	169.7	0	0	0	0	111.9	S833 E834 K841	S833-V837 VanDerWaalsContact O-CG2 3.28Å; S833-V837 WeakPolarHBondContact O-CG2 3.42Å; S833-V837 PolarHBondContact O-N 3.46Å; E834-V837 PolarHBondContact O-N 3.35Å; V837-K841 WeakPolarHBondContact O-CB 3.33Å; V837-K841 VanDerWaalsContact O-CG 3.27Å; V837-K841 WeakPolarHBondContact O-CG 3.31Å; V837-K841 PolarHBondContact O-N 3.28Å
838	T	35.1	Very low	35.1	Very low	78 Å²	78	96 Å²	96	48%	0.479	51%	0.507	S	S	.	.	H	α-helix	trans	-73.7	-46.5	167	59.7	0	0	0	0	112.1	E834 S835 S836 E840 K841 E842	E834-T838 PolarHBondContact O-N 2.97Å; S835-T838 WeakPolarHBondContact CA-OG1 3.27Å; S835-T838 PolarHBondContact O-OG1 3.49Å; S836-T838 VanDerWaalsContact C-N 3.28Å; S836-T838 PolarHBondContact O-N 3.2Å; T838-E840 PolarHBondContact O-N 3.31Å; T838-K841 CarbonylContact O-C 3.57Å; T838-K841 PolarHBondContact O-N 3.26Å; T838-E842 VanDerWaalsContact O-CB 3.25Å; T838-E842 WeakPolarHBondContact O-CB 3.26Å; T838-E842 PolarHBondContact O-N 3.41Å
839	F	32.9	Very low	35.2	Very low	132 Å²	132	97.8 Å²	97.8	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-64.5	-38.3	179.9	-113.6	-97.1	0	0	0	113.4	S835 S836 E842 I843	S835-F839 WeakPolarHBondContact O-CB 3.33Å; S835-F839 PolarHBondContact O-N 3.04Å; S836-F839 PolarHBondContact O-N 3.46Å; F839-E842 PolarHBondContact O-N 3.1Å; F839-I843 HydrophobicContact CD1-CD1 3.89Å; F839-I843 HydrophobicContact CD1-CG1 4.35Å; F839-I843 VanDerWaalsContact O-CB 3.26Å; F839-I843 WeakPolarHBondContact O-CB 3.45Å; F839-I843 VanDerWaalsContact O-CG1 3.31Å; F839-I843 WeakPolarHBondContact O-CG1 3.44Å; F839-I843 PolarHBondContact O-N 3.43Å
840	E	35.4	Very low	35.3	Very low	104 Å²	104	102.4 Å²	102.4	49%	0.486	53%	0.533	S	S	.	.	H	α-helix	trans	-69.3	-35	174.3	-72.8	-169.3	153.5	0	0	111.5	Y336 S836 T838 S844	Y336-E840 WeakPolarHBondContact CE1-OE1 3.49Å; S836-E840 WeakPolarHBondContact O-CB 3.25Å; S836-E840 WeakPolarHBondContact O-CG 3.31Å; S836-E840 PolarHBondContact O-N 2.85Å; T838-E840 PolarHBondContact O-N 3.31Å; E840-S844 WeakPolarHBondContact O-CB 3.22Å; E840-S844 PolarHBondContact O-N 3.37Å; E840-S844 PolarHBondContact O-OG 3.42Å
841	K	40.3	Very low	35.2	Very low	134 Å²	134	107.2 Å²	107.2	58%	0.583	55%	0.549	S	S	*	.	H	α-helix	trans	-66.9	-39.3	169.2	-82.7	177	176.4	173.5	0	112.4	V837 T838 S844 N845	V837-K841 WeakPolarHBondContact O-CB 3.33Å; V837-K841 VanDerWaalsContact O-CG 3.27Å; V837-K841 WeakPolarHBondContact O-CG 3.31Å; V837-K841 PolarHBondContact O-N 3.28Å; T838-K841 CarbonylContact O-C 3.57Å; T838-K841 PolarHBondContact O-N 3.26Å; K841-S844 PolarHBondContact O-N 2.82Å; K841-N845 WeakPolarHBondContact O-CB 3.11Å; K841-N845 PolarHBondContact O-N 3.19Å; K841-N845 PolarHBondContact O-ND2 2.98Å; K841-N845 PolarHBondContact O-OD1 3.22Å
842	E	37.3	Very low	34.8	Very low	102 Å²	102	111.4 Å²	111.4	48%	0.477	57%	0.566	S	S	.	*	H	α-helix	trans	-75.4	-40.9	-176	-166.9	155.1	-143.7	0	0	111.4	T838 F839 N845 Q846	T838-E842 VanDerWaalsContact O-CB 3.25Å; T838-E842 WeakPolarHBondContact O-CB 3.26Å; T838-E842 PolarHBondContact O-N 3.41Å; F839-E842 PolarHBondContact O-N 3.1Å; E842-N845 PolarHBondContact O-N 2.88Å; E842-Q846 WeakPolarHBondContact O-CG 3.47Å; E842-Q846 PolarHBondContact O-N 3.4Å
843	I	39.2	Very low	34.7	Very low	89 Å²	89	112 Å²	112	46%	0.456	58%	0.575	S	S	.	*	H	α-helix	trans	-65.5	-41.4	168.5	-70.1	173.4	0	0	0	110.8	F839 N845 Q846 L847	F839-I843 HydrophobicContact CD1-CD1 3.89Å; F839-I843 HydrophobicContact CD1-CG1 4.35Å; F839-I843 VanDerWaalsContact O-CB 3.26Å; F839-I843 WeakPolarHBondContact O-CB 3.45Å; F839-I843 VanDerWaalsContact O-CG1 3.31Å; F839-I843 WeakPolarHBondContact O-CG1 3.44Å; F839-I843 PolarHBondContact O-N 3.43Å; I843-N845 VanDerWaalsContact C-N 3.34Å; I843-N845 PolarHBondContact O-N 3.25Å; I843-Q846 PolarHBondContact O-N 3.07Å; I843-L847 HydrophobicContact CG2-CD1 3.64Å; I843-L847 HydrophobicContact CG2-CG 4.22Å; I843-L847 VanDerWaalsContact O-CB 3.31Å; I843-L847 WeakPolarHBondContact O-CB 3.41Å; I843-L847 WeakPolarHBondContact O-CG 3.47Å; I843-L847 PolarHBondContact O-N 2.93Å
844	S	40.5	Very low	34.5	Very low	59 Å²	59	116.6 Å²	116.6	41%	0.413	59%	0.588	S	S	.	*	H	α-helix	trans	-61.8	-42.4	173	-64.5	0	0	0	0	111.6	E840 K841 Q846 L847 N848	E840-S844 WeakPolarHBondContact O-CB 3.22Å; E840-S844 PolarHBondContact O-N 3.37Å; E840-S844 PolarHBondContact O-OG 3.42Å; K841-S844 PolarHBondContact O-N 2.82Å; S844-Q846 PolarHBondContact O-N 3.32Å; S844-L847 PolarHBondContact O-N 3.18Å; S844-N848 WeakPolarHBondContact O-CB 3.18Å; S844-N848 PolarHBondContact O-N 3.46Å; S844-N848 PolarHBondContact O-ND2 3.39Å; S844-N848 VanDerWaalsContact O-ND2 3.14Å
845	N	39.4	Very low	34.1	Very low	113 Å²	113	117 Å²	117	60%	0.604	59%	0.588	S	S	*	*	H	α-helix	trans	-67.9	-33.9	179.3	-73.4	-16.8	0	0	0	112.6	K841 E842 I843	K841-N845 WeakPolarHBondContact O-CB 3.11Å; K841-N845 PolarHBondContact O-N 3.19Å; K841-N845 PolarHBondContact O-ND2 2.98Å; K841-N845 PolarHBondContact O-OD1 3.22Å; E842-N845 PolarHBondContact O-N 2.88Å; I843-N845 VanDerWaalsContact C-N 3.34Å; I843-N845 PolarHBondContact O-N 3.25Å
846	Q	40	Very low	33.8	Very low	142 Å²	142	122 Å²	122	66%	0.664	61%	0.607	S	S	*	*	H	α-helix	trans	-80.3	-30.9	174.4	-67.3	-164.7	28.4	0	0	113.3	E842 I843 S844	E842-Q846 WeakPolarHBondContact O-CG 3.47Å; E842-Q846 PolarHBondContact O-N 3.4Å; I843-Q846 PolarHBondContact O-N 3.07Å; S844-Q846 PolarHBondContact O-N 3.32Å
847	L	34.6	Very low	33.4	Very low	125 Å²	125	127.4 Å²	127.4	65%	0.654	63%	0.633	S	S	*	*	H	α-helix	trans	-77.4	-27.3	174.1	-70.7	175.4	0	0	0	113.3	I843 S844 V849 F850	I843-L847 HydrophobicContact CG2-CD1 3.64Å; I843-L847 HydrophobicContact CG2-CG 4.22Å; I843-L847 VanDerWaalsContact O-CB 3.31Å; I843-L847 WeakPolarHBondContact O-CB 3.41Å; I843-L847 WeakPolarHBondContact O-CG 3.47Å; I843-L847 PolarHBondContact O-N 2.93Å; S844-L847 PolarHBondContact O-N 3.18Å; L847-V849 PolarHBondContact O-N 3.16Å; L847-V849 VanDerWaalsContact O-N 3.07Å; L847-F850 PolarHBondContact O-N 3.43Å
848	N	35.1	Very low	32.9	Very low	116 Å²	116	129.6 Å²	129.6	62%	0.62	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-66.7	-3.9	175.5	-78.9	-22	0	0	0	114.2	S844 F850	S844-N848 WeakPolarHBondContact O-CB 3.18Å; S844-N848 PolarHBondContact O-N 3.46Å; S844-N848 PolarHBondContact O-ND2 3.39Å; S844-N848 VanDerWaalsContact O-ND2 3.14Å; N848-F850 VanDerWaalsContact C-N 3.29Å
849	V	34.7	Very low	32.3	Very low	107 Å²	107	132.4 Å²	132.4	65%	0.648	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-74.1	-19.1	172.5	-177.4	0	0	0	0	112.2	L847	L847-V849 PolarHBondContact O-N 3.16Å; L847-V849 VanDerWaalsContact O-N 3.07Å
850	F	29.1	Very low	31.9	Very low	188 Å²	188	131.1 Å²	131.1	83%	0.825	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-121.6	45.6	-176.5	-83.4	-81.8	0	0	0	114.8	L847 N848	L847-F850 PolarHBondContact O-N 3.43Å; N848-F850 VanDerWaalsContact C-N 3.29Å
851	K	29.8	Very low	31.3	Very low	199 Å²	199	135.5 Å²	135.5	87%	0.865	68%	0.679	S	S	*	*			trans	-163.4	111.8	154	-107.3	152.2	-172.5	178.3	0	111.5
852	Q	26.7	Very low	30.7	Very low	190 Å²	190	136.9 Å²	136.9	89%	0.888	69%	0.687	S	S	*	*			trans	-128.5	162.2	177	-115.1	-144.1	3.2	0	0	110.7
853	P	28.8	Very low	30	Very low	102 Å²	102	139.8 Å²	139.8	66%	0.662	71%	0.706	S	S	*	*				-135.7	160.9	-105.6	39.9	-23.5	0	0	0	115.8
854	Q	28.9	Very low	29.4	Very low	166 Å²	166	144.3 Å²	144.3	78%	0.776	72%	0.724	S	S	*	*			trans	-151.8	137.1	163.6	-72.5	-166	-5.5	0	0	108.4
855	F	25.8	Very low	28.8	Very low	166 Å²	166	144.6 Å²	144.6	73%	0.728	74%	0.737	S	S	*	*			cis	-141.9	166.4	-5	-108	-63.9	0	0	0	111.4
856	E	23.8	Very low	28.1	Very low	149 Å²	149	149.1 Å²	149.1	70%	0.696	75%	0.747	S	S	*	*			trans	-71.5	159.3	-179.5	-54.8	149.7	106.4	0	0	113.6
857	L	25.7	Very low	27.3	Very low	138 Å²	138	150.2 Å²	150.2	72%	0.723	76%	0.757	S	S	*	*				-178.8	86.4	127.2	-96.8	162.2	0	0	0	113.2
858	I	27.5	Very low	27	Very low	123 Å²	123	150.3 Å²	150.3	63%	0.631	76%	0.759	S	S	*	*				48.9	112.1	122.2	-58.3	178.1	0	0	0	119.4
859	N	22.6	Very low	26.7	Very low	137 Å²	137	149.7 Å²	149.7	73%	0.733	76%	0.763	S	S	*	*			trans	18	131.9	135.7	-51.7	-0.1	0	0	0	119.5
860	C	25.4	Very low	26.5	Very low	104 Å²	104	150.4 Å²	150.4	70%	0.703	77%	0.768	S	S	*	*				-170.7	144.7	93.6	-96	0	0	0	0	111.7	H862	C860-H862 PolarHBondContact O-N 3.38Å
861	E	22.6	Very low	26.6	Very low	196 Å²	196	146 Å²	146	92%	0.916	76%	0.76	S	S	*	*			trans	-68.3	107.7	158	-67.6	-178.7	132.8	0	0	108.2	L863	E861-L863 PolarHBondContact O-N 3.15Å
862	H	27.6	Very low	26.6	Very low	163 Å²	163	143.3 Å²	143.3	76%	0.755	76%	0.756	S	S	*	*			trans	-89.6	99.6	173.2	-111.8	-61.6	0	0	0	110.6	C860 H864	C860-H862 PolarHBondContact O-N 3.38Å; H862-H864 PolarHBondContact O-N 3.3Å; H862-H864 VanDerWaalsContact O-N 3.12Å
863	L	23.3	Very low	26.7	Very low	164 Å²	164	139.5 Å²	139.5	86%	0.859	75%	0.75	S	S	*	*			trans	-46.6	113.1	156.5	-81.8	143.9	0	0	0	110.3	E861	E861-L863 PolarHBondContact O-N 3.15Å
864	H	26.4	Very low	26.8	Very low	183 Å²	183	138.9 Å²	138.9	85%	0.847	75%	0.748	S	S	*	*			trans	-159.1	122.5	156.4	-95.5	71.2	0	0	0	106.3	H862	H862-H864 PolarHBondContact O-N 3.3Å; H862-H864 VanDerWaalsContact O-N 3.12Å
865	G	26.2	Very low	26.9	Very low	66 Å²	66	138.6 Å²	138.6	68%	0.68	75%	0.75	S	S	*	*			cis	-174.2	179.4	-6.5	0	0	0	0	0	110.8
866	Y	26.6	Very low	26.8	Very low	207 Å²	207	139.7 Å²	139.7	81%	0.812	76%	0.755	S	S	*	*			trans	56.3	91.8	172.6	-74.5	-89.9	0	0	0	117.6	D868	Y866-D868 HydrophobicContact CD1-CB 4.48Å
867	N	23	Very low	27	Very low	165 Å²	165	139.1 Å²	139.1	88%	0.882	76%	0.762	S	S	*	*				-60.3	144.3	125.5	-67.7	-28.9	0	0	0	108.1
868	D	27.8	Very low	26.9	Very low	128 Å²	128	137.3 Å²	137.3	68%	0.684	76%	0.761	S	S	*	*			trans	-153.2	132.3	151.7	-129.5	-28	0	0	0	111.2	Y866	Y866-D868 HydrophobicContact CD1-CB 4.48Å
869	S	28.6	Very low	27	Very low	103 Å²	103	140.1 Å²	140.1	72%	0.72	77%	0.771	S	S	*	*			trans	58.4	142.3	174.4	70.5	0	0	0	0	118.7
870	T	31.3	Very low	27.1	Very low	121 Å²	121	140.3 Å²	140.3	74%	0.742	77%	0.771	S	S	*	*			cis	-165.8	151.7	-16.1	19.7	0	0	0	0	108
871	S	30.2	Very low	27	Very low	95 Å²	95	142.4 Å²	142.4	66%	0.664	78%	0.775	S	S	*	*			trans	53.3	146.3	147.1	65	0	0	0	0	121.5
872	D	29.1	Very low	27.1	Very low	144 Å²	144	138.3 Å²	138.3	77%	0.77	76%	0.764	S	S	*	*			cis	-169.8	140.9	-19.3	-105.1	-45.1	0	0	0	108.3
873	S	29.9	Very low	27	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	76%	0.762	S	S	*	*			trans	64.6	173.9	159.8	97.5	0	0	0	0	115.6
874	S	31.3	Very low	27.3	Very low	89 Å²	89	134 Å²	134	62%	0.622	76%	0.755	S	S	*	*			cis	-154.1	145.1	-20.7	23.7	0	0	0	0	111.4
875	I	29.6	Very low	27.3	Very low	159 Å²	159	130.8 Å²	130.8	82%	0.815	75%	0.749	S	S	*	*			trans	57.4	111.8	137.1	-61.2	167.2	0	0	0	119.2
876	F	23.7	Very low	27.3	Very low	190 Å²	190	132.5 Å²	132.5	83%	0.833	75%	0.751	S	S	*	*			trans	-27.9	138.7	147.8	-80.7	-110.1	0	0	0	115.2
877	T	27.9	Very low	27.3	Very low	136 Å²	136	128.4 Å²	128.4	83%	0.834	75%	0.748	S	S	*	*				-171.7	163.3	102.9	19.9	0	0	0	0	113.1
878	S	24.9	Very low	27.4	Very low	101 Å²	101	125.1 Å²	125.1	71%	0.706	74%	0.738	S	S	*	*			trans	-61.4	151.2	173.4	45.3	0	0	0	0	113.7
879	Q	29.7	Very low	27.5	Very low	182 Å²	182	126.4 Å²	126.4	85%	0.85	74%	0.739	S	S	*	*				-169.5	173.4	116.6	-103.4	171.8	22.8	0	0	114.4
880	L	24.6	Very low	27.5	Very low	140 Å²	140	128.5 Å²	128.5	73%	0.733	74%	0.738	S	S	*	*			trans	-29.6	142.2	178.8	-86.3	70.7	0	0	0	119.5
881	L	22.6	Very low	27.5	Very low	148 Å²	148	128.9 Å²	128.9	78%	0.775	74%	0.735	S	S	*	*				43	160.5	122	-89.1	118	0	0	0	123
882	T	26.1	Very low	27.2	Very low	111 Å²	111	130.7 Å²	130.7	68%	0.681	74%	0.737	S	S	*	*			trans	78.9	101.9	155.9	42.9	0	0	0	0	121
883	T	25.4	Very low	27.1	Very low	119 Å²	119	131.4 Å²	131.4	73%	0.73	74%	0.737	S	S	*	*				74.4	162.9	125.4	57.5	0	0	0	0	122.4
884	T	28.7	Very low	27	Very low	116 Å²	116	130.6 Å²	130.6	71%	0.712	73%	0.728	S	S	*	*			trans	61.3	95.9	160.6	44.7	0	0	0	0	117.2
885	T	25.9	Very low	26.9	Very low	117 Å²	117	135.2 Å²	135.2	72%	0.718	74%	0.737	S	S	*	*				76.6	143.2	72	60.9	0	0	0	0	115.4
886	S	25.8	Very low	26.8	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	73%	0.727	S	S	*	*			trans	64.9	147.4	157.5	50.7	0	0	0	0	117.3
887	T	27.4	Very low	27	Very low	121 Å²	121	129.1 Å²	129.1	74%	0.742	72%	0.721	S	S	*	*			cis	-165	176.5	-8.2	16.4	0	0	0	0	108.1
888	S	26	Very low	27.1	Very low	96 Å²	96	128.6 Å²	128.6	67%	0.671	71%	0.714	S	S	*	*			trans	66.9	160.5	153.4	34.2	0	0	0	0	116.8
889	Q	29.9	Very low	27.4	Very low	154 Å²	154	129.8 Å²	129.8	72%	0.72	71%	0.712	S	S	*	*			cis	-149.7	133.3	-11.1	-119.5	159.1	-8.3	0	0	107.4
890	Q	27.8	Very low	27.3	Very low	147 Å²	147	125.6 Å²	125.6	69%	0.687	70%	0.703	S	S	*	*				69	154.2	108.9	-78.6	-176.2	-11.5	0	0	118.2
891	N	30.5	Very low	27.4	Very low	129 Å²	129	125.7 Å²	125.7	69%	0.69	70%	0.704	S	S	*	*			trans	74.8	150.5	156.4	-61.4	-26.6	0	0	0	118.7
892	L	24.9	Very low	27.8	Very low	134 Å²	134	125.2 Å²	125.2	70%	0.702	70%	0.701	S	S	*	*			cis	-166.6	171.1	-35.4	-152.9	69.4	0	0	0	107.5
893	M	26.6	Very low	28	Very low	158 Å²	158	126.4 Å²	126.4	78%	0.778	70%	0.703	S	S	*	*			trans	67.9	159	161.3	-64.6	-166.6	170.1	0	0	117.6
894	T	28	Very low	28.3	Very low	93 Å²	93	127 Å²	127	57%	0.571	70%	0.702	S	S	*	*			cis	-166.9	155.9	-31.6	37.9	0	0	0	0	107.7
895	K	28.3	Very low	28.3	Very low	186 Å²	186	128.1 Å²	128.1	81%	0.809	70%	0.703	S	S	*	*			trans	67.3	158.5	148.1	-74.3	161.7	-174.9	175.9	0	116
896	S	28.3	Very low	28.7	Very low	88 Å²	88	128.9 Å²	128.9	62%	0.615	70%	0.703	S	S	*	*			cis	-169.6	150.7	-19.4	50.1	0	0	0	0	111.7
897	N	28.3	Very low	29	Very low	133 Å²	133	130 Å²	130	71%	0.711	70%	0.701	S	S	*	*			trans	64.7	135.7	135.1	-69.3	18.6	0	0	0	122.2
898	N	30.4	Very low	29.1	Very low	126 Å²	126	129.6 Å²	129.6	67%	0.674	70%	0.695	S	S	*	*			trans	72.4	154.9	141.2	-60.2	5.3	0	0	0	118.7
899	N	29.4	Very low	29.2	Very low	126 Å²	126	133.4 Å²	133.4	67%	0.674	70%	0.699	S	S	*	*			cis	-167.3	172	-24.9	-96.9	-12.8	0	0	0	107.1
900	S	27.7	Very low	29.2	Very low	94 Å²	94	131.9 Å²	131.9	66%	0.657	70%	0.7	S	S	*	*			trans	43.8	145.5	140.1	62.7	0	0	0	0	122.5
901	D	28.4	Very low	29.2	Very low	142 Å²	142	133 Å²	133	76%	0.759	70%	0.703	S	S	*	*			cis	-178.5	-171.9	-8.8	-94.7	-34.7	0	0	0	107.9
902	I	30.7	Very low	29	Very low	137 Å²	137	137.8 Å²	137.8	70%	0.703	71%	0.713	S	S	*	*			trans	83.3	89.1	150	-68.6	143.4	0	0	0	119.6
903	N	28.8	Very low	29.2	Very low	136 Å²	136	138.6 Å²	138.6	73%	0.727	71%	0.711	S	S	*	*				65	160.4	111.5	-53.5	-20.3	0	0	0	125.2
904	N	31.7	Very low	29.2	Very low	133 Å²	133	139.6 Å²	139.6	71%	0.711	71%	0.707	S	S	*	*			trans	85.8	109.9	163	-55.8	-33	0	0	0	115.8
905	N	30.4	Very low	29.2	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	72%	0.719	S	S	*	*				88	111.1	60.1	-79.7	-2.3	0	0	0	112.7
906	D	33.4	Very low	29	Very low	134 Å²	134	140.2 Å²	140.2	72%	0.717	72%	0.715	S	S	*	*				170.7	132.8	102.8	-101.5	-7.4	0	0	0	117.6
907	N	31.3	Very low	29	Very low	124 Å²	124	143 Å²	143	66%	0.663	73%	0.728	S	S	*	*			trans	68.3	140.9	135.5	-67.2	-47.1	0	0	0	126.6
908	N	29.8	Very low	28.8	Very low	114 Å²	114	143.7 Å²	143.7	61%	0.61	73%	0.732	S	S	*	*			trans	77.3	114	157.4	-62.3	-49.3	0	0	0	119.3
909	K	28.3	Very low	28.6	Very low	176 Å²	176	147.5 Å²	147.5	77%	0.765	74%	0.743	S	S	*	*				83.3	141.6	75.8	-75.9	177	-167.2	140.7	0	113.6
910	T	29.7	Very low	28.4	Very low	121 Å²	121	147.4 Å²	147.4	74%	0.742	75%	0.747	S	S	*	*			cis	-171	167.1	-3.5	22.9	0	0	0	0	111.1
911	K	27.5	Very low	28.2	Very low	172 Å²	172	148.1 Å²	148.1	75%	0.748	75%	0.751	S	S	*	*			cis	176.5	64.2	-29.9	-167.7	-177.5	179.1	179.8	0	113.9
912	Y	27.8	Very low	28.1	Very low	229 Å²	229	148 Å²	148	90%	0.898	75%	0.75	S	S	*	*			trans	-131.6	136.5	170.8	-66.7	-83.4	0	0	0	110.2
913	K	28.7	Very low	27.8	Very low	150 Å²	150	146 Å²	146	65%	0.652	75%	0.749	S	S	*	*			cis	81.6	134.7	25.5	-68.9	-146.1	165.1	-145.8	0	115.9
914	Y	26.4	Very low	27.8	Very low	179 Å²	179	149.1 Å²	149.1	70%	0.702	75%	0.752	S	S	*	*			cis	-143.9	-178.2	-12.1	-119.8	-151.6	0	0	0	105.5
915	E	28.4	Very low	27.6	Very low	174 Å²	174	150.3 Å²	150.3	81%	0.813	75%	0.753	S	S	*	*				-175.4	174	53.1	-159.9	149.1	-102.9	0	0	110.5
916	T	23.7	Very low	27.2	Very low	119 Å²	119	147.5 Å²	147.5	73%	0.73	74%	0.744	S	S	*	*			trans	-142.7	139.1	-165.3	54.1	0	0	0	0	115.4
917	T	27.8	Very low	26.8	Very low	147 Å²	147	149.4 Å²	149.4	90%	0.902	75%	0.749	S	S	*	*			trans	-138.6	151.8	156	50.1	0	0	0	0	111.4
918	N	25	Very low	26.4	Very low	146 Å²	146	149 Å²	149	78%	0.781	75%	0.754	S	S	*	*			trans	-108.3	143.7	-160.3	-53.4	-35.2	0	0	0	113.4
919	F	25.6	Very low	26.2	Very low	207 Å²	207	149.3 Å²	149.3	91%	0.908	76%	0.76	S	S	*	*			trans	-139.9	149	147.7	-99.9	-78.1	0	0	0	110.7	S921	F919-S921 PolarHBondContact O-N 3.18Å
920	V	25	Very low	25.9	Very low	124 Å²	124	146.2 Å²	146.2	75%	0.752	76%	0.761	S	S	*	*			trans	-60.3	128.2	-160.4	179	0	0	0	0	113.4
921	S	23.9	Very low	25.7	Very low	108 Å²	108	146.3 Å²	146.3	76%	0.755	76%	0.761	S	S	*	*			trans	-133.8	110.3	157	46.8	0	0	0	0	108	F919	F919-S921 PolarHBondContact O-N 3.18Å
922	D	27.2	Very low	25.6	Very low	139 Å²	139	143.9 Å²	143.9	74%	0.743	76%	0.763	S	S	*	*			trans	-103.9	91.8	175.2	-81.4	-46.7	0	0	0	109.3
923	S	24	Very low	25.6	Very low	96 Å²	96	137.4 Å²	137.4	67%	0.671	76%	0.757	S	S	*	*			trans	-101.5	113	160.1	54.8	0	0	0	0	108.9
924	Y	28.6	Very low	25.4	Very low	202 Å²	202	136 Å²	136	79%	0.792	77%	0.766	S	S	*	*			trans	-120.9	116.2	160.2	-86.3	-89.1	0	0	0	105.3
925	E	26.4	Very low	25.3	Very low	157 Å²	157	132.3 Å²	132.3	73%	0.734	77%	0.766	S	S	*	*				51.6	96.4	55.4	-59.1	-153.7	137.6	0	0	111.2
926	S	23.2	Very low	25.1	Very low	79 Å²	79	133.5 Å²	133.5	55%	0.552	77%	0.765	S	S	*	*				91.1	148.2	69.6	84.5	0	0	0	0	112
927	Q	24	Very low	25.3	Very low	175 Å²	175	134.4 Å²	134.4	82%	0.818	77%	0.77	S	S	*	*			trans	65.4	115.2	172.1	-54.5	162.7	68.7	0	0	113.2
928	C	23.9	Very low	25.1	Very low	114 Å²	114	134 Å²	134	77%	0.77	76%	0.758	S	S	*	*				-168	151.7	74.6	-100.7	0	0	0	0	114.2
929	V	24.8	Very low	25.2	Very low	122 Å²	122	130.1 Å²	130.1	74%	0.739	75%	0.752	S	S	*	*			trans	42.8	109.6	140.9	-172.2	0	0	0	0	118.8	V931	V929-V931 HydrophobicContact CG1-CG2 4.42Å
930	S	22.7	Very low	25.2	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	75%	0.745	S	S	*	*			trans	-57.1	127.8	156.9	50.6	0	0	0	0	113.8
931	V	26.3	Very low	25.1	Very low	124 Å²	124	128.2 Å²	128.2	75%	0.752	74%	0.741	S	S	*	*			trans	-136.6	115.5	149.4	-178	0	0	0	0	108.2	V929	V929-V931 HydrophobicContact CG1-CG2 4.42Å
932	P	24.3	Very low	25.2	Very low	120 Å²	120	130.9 Å²	130.9	78%	0.779	75%	0.745	S	S	*	*			trans	-84.5	134.6	169.6	32.9	-30.5	0	0	0	110.3
933	A	27.5	Very low	25	Very low	94 Å²	94	133.2 Å²	133.2	78%	0.777	75%	0.749	S	S	*	*			trans	-139.7	85.2	174.9	0	0	0	0	0	110.4
934	S	24.5	Very low	25.2	Very low	121 Å²	121	133.6 Å²	133.6	85%	0.846	75%	0.749	S	S	*	*			trans	-94	99.9	171.9	54.2	0	0	0	0	110.3
935	S	24.9	Very low	25	Very low	101 Å²	101	128 Å²	128	71%	0.706	74%	0.74	S	S	*	*			trans	-155.9	113.5	170.3	51.6	0	0	0	0	109.4
936	Y	24.7	Very low	25.1	Very low	199 Å²	199	128.1 Å²	128.1	78%	0.78	75%	0.745	S	S	*	*				68.6	88	80.2	-96.8	-84.3	0	0	0	115.1	Q938	Y936-Q938 VanDerWaalsContact CE1-OE1 3.28Å
937	V	26.2	Very low	25.2	Very low	138 Å²	138	132.8 Å²	132.8	84%	0.836	76%	0.758	S	S	*	*			trans	-161.4	117.7	137.8	-179.3	0	0	0	0	103.3
938	Q	25.1	Very low	25.6	Very low	139 Å²	139	128.6 Å²	128.6	65%	0.65	75%	0.746	S	S	*	*			cis	68.4	84.3	15.1	-159.1	176.9	12.1	0	0	115.5	Y936	Y936-Q938 VanDerWaalsContact CE1-OE1 3.28Å
939	G	26.3	Very low	25.8	Very low	64 Å²	64	128.9 Å²	128.9	66%	0.66	74%	0.74	S	S	*	*			trans	-152.9	108.3	174.7	0	0	0	0	0	113
940	Y	26.1	Very low	25.9	Very low	195 Å²	195	130.4 Å²	130.4	77%	0.765	74%	0.739	S	S	*	*			trans	-20.3	134.9	157.7	-51.8	-84.8	0	0	0	115.2
941	S	22.9	Very low	26.1	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	73%	0.734	S	S	*	*				54.9	100.2	53	82.9	0	0	0	0	115.1
942	I	25.4	Very low	26.4	Very low	165 Å²	165	131.2 Å²	131.2	85%	0.846	73%	0.73	S	S	*	*			trans	-174.9	148.9	145	-98.3	150.9	0	0	0	110.8
943	F	23.1	Very low	26.6	Very low	188 Å²	188	132.7 Å²	132.7	83%	0.825	73%	0.726	S	S	*	*			trans	-68.4	-178.2	175.4	-68.5	-101.4	0	0	0	114
944	P	28.9	Very low	26.7	Very low	103 Å²	103	134 Å²	134	67%	0.669	72%	0.72	S	S	*	*				-131.4	-149.1	-53.3	36.2	-15.7	0	0	0	109.7
945	S	22.8	Very low	26.9	Very low	85 Å²	85	135.2 Å²	135.2	59%	0.594	72%	0.716	S	S	*	*			trans	35.3	115.5	147.3	67	0	0	0	0	120
946	D	28.6	Very low	27	Very low	160 Å²	160	134.7 Å²	134.7	86%	0.856	71%	0.712	S	S	*	*				-171.4	151.5	89.4	-94.9	-31.5	0	0	0	113.6
947	E	26.4	Very low	27.1	Very low	177 Å²	177	130 Å²	130	83%	0.827	71%	0.708	S	S	*	*			trans	-78.3	-177.1	167.9	-124.4	-171.7	-143.3	0	0	109.4
948	P	31.7	Very low	27.3	Very low	86 Å²	86	128.1 Å²	128.1	56%	0.558	70%	0.701	S	S	*	*			cis	-144.5	-170.3	0.6	32.8	-7.9	0	0	0	117
949	N	27.9	Very low	27.5	Very low	121 Å²	121	126.6 Å²	126.6	65%	0.647	71%	0.705	S	S	*	*				86.7	130.8	129.5	-91.6	-29.3	0	0	0	123.1
950	Q	28.3	Very low	28	Very low	153 Å²	153	129.4 Å²	129.4	72%	0.715	71%	0.712	S	S	*	*			trans	75.5	145.7	135.5	-63.1	170.4	23.6	0	0	118.8
951	L	26.6	Very low	28.1	Very low	127 Å²	127	124.6 Å²	124.6	67%	0.665	71%	0.707	S	S	*	*			cis	-162.7	174.4	-10.1	-114.2	166.3	0	0	0	109.7
952	D	31.2	Very low	28.4	Very low	125 Å²	125	126.4 Å²	126.4	67%	0.668	71%	0.71	S	S	*	*			trans	66.2	147.2	152.1	-58.1	-17.9	0	0	0	120.8
953	E	30.5	Very low	28.6	Very low	150 Å²	150	125.2 Å²	125.2	70%	0.701	70%	0.7	S	S	*	*			cis	-158.6	144.8	-17.3	-111.6	-162.3	146.5	0	0	112.2
954	L	28.2	Very low	29	Very low	123 Å²	123	124.1 Å²	124.1	64%	0.644	70%	0.695	S	S	*	*			trans	63.2	138	136.9	-64.1	178.9	0	0	0	126
955	I	29.7	Very low	28.9	Very low	146 Å²	146	127.1 Å²	127.1	75%	0.749	70%	0.7	S	S	*	*			trans	71.9	139.4	131.8	-72.7	169.9	0	0	0	120.8
956	S	26.1	Very low	29.2	Very low	90 Å²	90	129.8 Å²	129.8	63%	0.629	71%	0.706	S	S	*	*			cis	-171.1	162.6	-31.2	64.8	0	0	0	0	111.5
957	S	26.7	Very low	29.2	Very low	101 Å²	101	126.7 Å²	126.7	71%	0.706	70%	0.697	S	S	*	*			trans	72.7	149.6	138	64.6	0	0	0	0	125.1
958	S	30.1	Very low	29.2	Very low	97 Å²	97	123.7 Å²	123.7	68%	0.678	70%	0.696	S	S	*	*			trans	81.2	101.7	148.6	57.2	0	0	0	0	122.9
959	S	30.4	Very low	29.1	Very low	107 Å²	107	122.6 Å²	122.6	75%	0.748	70%	0.7	S	S	*	*				21.6	147.7	104.5	63.4	0	0	0	0	119.4
960	P	35.4	Very low	29	Very low	124 Å²	124	122.6 Å²	122.6	81%	0.805	71%	0.71	S	S	*	*				-148.3	-173	50.1	42.7	-22.1	0	0	0	118.4
961	S	28.3	Very low	28.9	Very low	94 Å²	94	119.1 Å²	119.1	66%	0.657	70%	0.702	S	S	*	*			trans	-83.8	173.4	179.9	54.2	0	0	0	0	114.7
962	N	31.1	Very low	29	Very low	133 Å²	133	121.3 Å²	121.3	71%	0.711	71%	0.706	S	S	*	*			trans	153.6	147.8	132.2	-79.4	2.5	0	0	0	109.2
963	E	28	Very low	28.8	Very low	139 Å²	139	122.4 Å²	122.4	65%	0.65	71%	0.712	S	S	*	*			cis	171.2	171.2	-18.2	-130.7	-174.9	-154.2	0	0	104.8
964	K	31.8	Very low	28.8	Very low	166 Å²	166	120.2 Å²	120.2	72%	0.722	71%	0.714	S	S	*	*			trans	75.1	102.7	168.4	-69.8	149.5	-168.7	160.7	0	116.5
965	E	27.4	Very low	28.6	Very low	166 Å²	166	119.3 Å²	119.3	78%	0.776	72%	0.717	S	S	*	*			cis	89.6	161	35	-161.7	-170.7	-116.3	0	0	113.2
966	I	29.4	Very low	28.6	Very low	141 Å²	141	120.2 Å²	120.2	72%	0.723	72%	0.722	S	S	*	*			trans	77.2	125.2	171.5	-52.5	177.8	0	0	0	113.9
967	S	27.5	Very low	28.5	Very low	94 Å²	94	120.6 Å²	120.6	66%	0.657	73%	0.725	S	S	*	*			cis	-166.9	165.3	-8.3	52.1	0	0	0	0	112.6
968	S	26.6	Very low	28.6	Very low	115 Å²	115	123.3 Å²	123.3	80%	0.804	73%	0.731	S	S	*	*			trans	14.3	142.5	149.2	60.9	0	0	0	0	121.7
969	G	29.6	Very low	28.5	Very low	62 Å²	62	123.8 Å²	123.8	64%	0.639	73%	0.734	S	S	*	*			cis	138.9	178.4	4.8	0	0	0	0	0	112.5
970	S	26.9	Very low	28.3	Very low	122 Å²	122	124.8 Å²	124.8	85%	0.853	74%	0.738	S	S	*	*			trans	66.9	156.1	171.2	83.5	0	0	0	0	116.9
971	S	25.6	Very low	28	Very low	79 Å²	79	124.1 Å²	124.1	55%	0.552	74%	0.736	S	S	*	*			cis	-176.2	174.2	-19.5	44.8	0	0	0	0	110.3
972	F	29.4	Very low	28	Very low	173 Å²	173	128 Å²	128	76%	0.759	74%	0.744	S	S	*	*			trans	75.8	116.9	168.5	-56.9	-59.7	0	0	0	115.9
973	N	26.7	Very low	27.9	Very low	148 Å²	148	130.6 Å²	130.6	79%	0.791	75%	0.751	S	S	*	*				80.4	142.1	83	-71.6	9.2	0	0	0	113.1
974	S	29.2	Very low	27.8	Very low	105 Å²	105	132.7 Å²	132.7	73%	0.734	76%	0.759	S	S	*	*			cis	-153	157.5	4.4	42.8	0	0	0	0	112.9
975	S	25.1	Very low	27.8	Very low	103 Å²	103	132.3 Å²	132.3	72%	0.72	76%	0.759	S	S	*	*			trans	-8.4	138	159	57.1	0	0	0	0	120.3
976	I	29.3	Very low	27.6	Very low	166 Å²	166	128.5 Å²	128.5	85%	0.851	75%	0.751	S	S	*	*				-161.7	157.5	104.9	-98.2	157.3	0	0	0	110.4
977	S	24.7	Very low	27.6	Very low	98 Å²	98	129.9 Å²	129.9	69%	0.685	75%	0.749	S	S	*	*			trans	-77.1	171.5	-177.8	49.7	0	0	0	0	112.8
978	L	28.4	Very low	27.5	Very low	158 Å²	158	129.7 Å²	129.7	83%	0.827	75%	0.752	S	S	*	*			cis	-151.5	157.2	41.4	-95.3	164.6	0	0	0	114.4
979	S	26.9	Very low	27.4	Very low	106 Å²	106	130.3 Å²	130.3	74%	0.741	75%	0.752	S	S	*	*			trans	0.8	151	162.7	48.7	0	0	0	0	123.7
980	P	27.9	Very low	27.2	Very low	129 Å²	129	130.7 Å²	130.7	84%	0.838	74%	0.742	S	S	*	*			trans	-106.9	175	-166.2	43	-37	0	0	0	116
981	S	28.3	Very low	27.3	Very low	110 Å²	110	127 Å²	127	77%	0.769	72%	0.716	S	S	*	*			trans	-137.2	131.2	166.9	53.6	0	0	0	0	114.8
982	Q	29.1	Very low	27.7	Very low	175 Å²	175	125.8 Å²	125.8	82%	0.818	71%	0.706	S	S	*	*			trans	57.3	100.9	148.6	-61.1	-178	-3.9	0	0	121.9
983	H	27.4	Very low	27.8	Very low	187 Å²	187	125.6 Å²	125.6	87%	0.866	71%	0.707	S	S	*	*			trans	45.1	111.6	130.8	-74.3	-74.6	0	0	0	121.5
984	F	27.4	Very low	27.8	Very low	183 Å²	183	127 Å²	127	80%	0.803	71%	0.706	S	S	*	*			trans	-139.5	146	153.7	-104	-92.4	0	0	0	111
985	Q	30.3	Very low	27.8	Very low	158 Å²	158	128.3 Å²	128.3	74%	0.738	71%	0.705	S	S	*	*			trans	53.5	132.9	157.8	-67.8	155.8	10.9	0	0	118.6
986	S	24.4	Very low	27.9	Very low	86 Å²	86	130 Å²	130	60%	0.601	71%	0.705	S	S	*	*			cis	83.5	123.8	27.2	90.9	0	0	0	0	116.4
987	Y	28.2	Very low	27.7	Very low	171 Å²	171	132.3 Å²	132.3	67%	0.671	70%	0.703	S	S	*	*			trans	75.9	130.6	172	-63.5	-85	0	0	0	117.8	K78	K78-Y987 HydrophobicContact CD-CE1 3.91Å; K78-Y987 HydrophobicContact CD-CE2 4.17Å; K78-Y987 HydrophobicContact CG-CE1 3.94Å
988	A	25.1	Very low	28	Very low	89 Å²	89	134.3 Å²	134.3	74%	0.736	70%	0.704	S	S	*	*			trans	-90.2	166.6	166.7	0	0	0	0	0	111
989	T	25	Very low	27.9	Very low	129 Å²	129	132 Å²	132	79%	0.791	70%	0.697	S	S	*	*				-177.5	125.1	125.5	31.9	0	0	0	0	113.4
990	T	25.2	Very low	28	Very low	70 Å²	70	133.2 Å²	133.2	43%	0.429	70%	0.695	S	S	.	*			trans	50.1	118.2	135.8	66.2	0	0	0	0	122.8	P51	P51-T990 WeakPolarHBondContact O-CG2 3.49Å
991	S	28.7	Very low	27.9	Very low	44 Å²	44	133.4 Å²	133.4	31%	0.308	69%	0.689	S	S	.	*				65.9	179	124.9	74.5	0	0	0	0	121.7	I52 I53	I52-S991 WeakPolarHBondContact CA-OG 3.45Å; I53-S991 PolarHBondContact N-OG 3.41Å; I53-S991 VanDerWaalsContact N-OG 3.08Å; I53-S991 PolarHBondContact O-OG 3.22Å
992	P	35.4	Very low	27.9	Very low	53 Å²	53	135.1 Å²	135.1	34%	0.344	69%	0.685	S	S	.	*			cis	-117	-174	-47.4	42.3	-34.7	0	0	0	111.3	I52	I52-P992 HydrophobicContact CG2-CB 3.54Å; I52-P992 HydrophobicContact CG2-CG 3.48Å; I52-P992 VanDerWaalsContact CG2-CG 3.48Å
993	E	30.3	Very low	27.8	Very low	169 Å²	169	134 Å²	134	79%	0.79	68%	0.68	S	S	*	*				-168.6	-172.9	104.6	-139.1	154.7	-145.7	0	0	112.4
994	K	28.1	Very low	27.6	Very low	178 Å²	178	128.1 Å²	128.1	77%	0.774	67%	0.67	S	S	*	*			trans	-101.3	159.1	-161.7	-57.4	166.6	-179.3	169.4	0	113.9
995	N	29.3	Very low	27.6	Very low	132 Å²	132	129 Å²	129	71%	0.706	67%	0.674	S	S	*	*				169.1	126.9	118.6	-85	-21	0	0	0	111.9
996	I	26.8	Very low	27.3	Very low	139 Å²	139	127.1 Å²	127.1	71%	0.713	67%	0.673	S	S	*	*				71.9	126.7	103.6	-64.8	173	0	0	0	112.8
997	R	25.6	Very low	27.2	Very low	214 Å²	214	130.6 Å²	130.6	81%	0.808	69%	0.685	S	S	*	*			cis	-166.8	-176.3	7.3	-131.5	-179	-172.3	163.4	-0.7	111.5
998	I	29.9	Very low	27.2	Very low	141 Å²	141	127.7 Å²	127.7	72%	0.723	69%	0.689	S	S	*	*			trans	74.9	113.1	165.4	-58.4	133.1	0	0	0	113.6
999	T	26.3	Very low	27.1	Very low	110 Å²	110	128.7 Å²	128.7	68%	0.675	69%	0.686	S	S	*	*			cis	102.5	153.6	20.7	75	0	0	0	0	115.5
1000	N	29.3	Very low	27.1	Very low	131 Å²	131	130.1 Å²	130.1	70%	0.701	69%	0.687	S	S	*	*			trans	83	112.4	-178.8	-54.5	53.2	0	0	0	112.7
1001	D	26.6	Very low	27.1	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	70%	0.697	S	S	*	*				75.5	138	57.2	-57.3	-40.8	0	0	0	111.1
1002	Q	26.5	Very low	26.9	Very low	145 Å²	145	135.4 Å²	135.4	68%	0.678	72%	0.723	S	S	*	*			cis	-158.4	166.6	11.9	-136.9	163.8	-57.8	0	0	110.2
1003	E	27.3	Very low	26.4	Very low	151 Å²	151	140.8 Å²	140.8	71%	0.706	74%	0.741	S	S	*	*			trans	57.3	145.9	157.6	-71.9	147.3	-146.2	0	0	120.6
1004	G	24.5	Very low	26.1	Very low	65 Å²	65	139 Å²	139	67%	0.67	73%	0.734	S	S	*	*			cis	117.4	76.2	-5.4	0	0	0	0	0	114.8
1005	F	27.5	Very low	26.3	Very low	200 Å²	200	140 Å²	140	88%	0.877	74%	0.739	S	S	*	*			trans	-145	159	168.4	-102.8	-76.7	0	0	0	113.7
1006	T	23	Very low	26.1	Very low	119 Å²	119	137.1 Å²	137.1	73%	0.73	73%	0.729	S	S	*	*			trans	-128.6	156.2	-166.2	53.5	0	0	0	0	114
1007	L	23.3	Very low	26.1	Very low	160 Å²	160	136.9 Å²	136.9	84%	0.838	73%	0.729	S	S	*	*			trans	44	101.3	146.6	-76.9	161.2	0	0	0	119.8
1008	S	26.5	Very low	26.1	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	72%	0.723	S	S	*	*				-172.3	136.5	124.6	45.3	0	0	0	0	108.2
1009	T	24.1	Very low	26	Very low	111 Å²	111	133.2 Å²	133.2	68%	0.681	72%	0.722	S	S	*	*				76.7	116.4	51.3	-47.7	0	0	0	0	112.6
1010	I	24.9	Very low	26.2	Very low	158 Å²	158	136.8 Å²	136.8	81%	0.81	73%	0.731	S	S	*	*			trans	66.9	129.1	-175.7	-51.2	128.2	0	0	0	112.4
1011	G	25.9	Very low	26.1	Very low	61 Å²	61	135.5 Å²	135.5	63%	0.629	72%	0.723	S	S	*	*			cis	132.7	167.6	7.5	0	0	0	0	0	110
1012	L	24.6	Very low	26.2	Very low	165 Å²	165	137.2 Å²	137.2	86%	0.864	73%	0.725	S	S	*	*			trans	67	156.4	177.2	-56.8	175.9	0	0	0	115.1
1013	K	23.8	Very low	26.1	Very low	165 Å²	165	135.3 Å²	135.3	72%	0.717	72%	0.719	S	S	*	*			cis	-166.9	145.2	-35.3	-153.4	-162.8	175.7	-172.7	0	107.4
1014	M	24.8	Very low	26.2	Very low	132 Å²	132	135.6 Å²	135.6	65%	0.65	72%	0.72	S	S	*	*			trans	57	116.1	163.4	-38	-163.6	74	0	0	118.8
1015	K	30.8	Very low	26.1	Very low	198 Å²	198	136.6 Å²	136.6	86%	0.861	72%	0.717	S	S	*	*				-148.8	125.2	108.2	-100.6	155.1	-177.2	-179.3	0	107
1016	S	26.4	Very low	25.9	Very low	72 Å²	72	135 Å²	135	50%	0.503	71%	0.712	S	S	.	*			cis	64.3	124.7	40.1	86.6	0	0	0	0	113.2
1017	D	26	Very low	26	Very low	135 Å²	135	136.7 Å²	136.7	72%	0.722	71%	0.712	S	S	*	*			cis	-164.2	-162.8	-8.2	-109.5	-35.6	0	0	0	107.8
1018	D	26.6	Very low	26	Very low	128 Å²	128	134.2 Å²	134.2	68%	0.684	71%	0.708	S	S	*	*			trans	74.1	102.7	151.1	-62.6	-29.1	0	0	0	120.1
1019	H	26.4	Very low	26	Very low	150 Å²	150	134.9 Å²	134.9	69%	0.694	71%	0.707	S	S	*	*				43.8	109.4	114.7	-60	-54.8	0	0	0	119.5	L1021	H1019-L1021 HydrophobicContact CB-CD1 4.14Å
1020	H	32.3	Very low	26	Very low	184 Å²	184	136 Å²	136	85%	0.852	71%	0.713	S	S	*	*				-156.6	148	127.1	-94.1	-77.2	0	0	0	110.3
1021	L	27.2	Very low	26.1	Very low	104 Å²	104	132.7 Å²	132.7	55%	0.545	71%	0.71	S	S	.	*			cis	-172	144	-39.9	-137.6	76.4	0	0	0	107.1	H1019	H1019-L1021 HydrophobicContact CB-CD1 4.14Å
1022	F	27.5	Very low	26.1	Very low	170 Å²	170	136.8 Å²	136.8	75%	0.746	72%	0.717	S	S	*	*			trans	62.7	171.8	161.6	-78.5	-147.8	0	0	0	115.6
1023	N	24.5	Very low	26.4	Very low	104 Å²	104	135.7 Å²	135.7	56%	0.556	71%	0.711	S	S	*	*			cis	-168.6	176.8	-43.2	-96.5	-3.9	0	0	0	104.7
1024	H	29.2	Very low	26.4	Very low	157 Å²	157	132.9 Å²	132.9	73%	0.727	71%	0.708	S	S	*	*			trans	68.9	109.8	164.9	-56.2	-62.9	0	0	0	115.3
1025	S	23.7	Very low	26.5	Very low	87 Å²	87	133 Å²	133	61%	0.608	71%	0.712	S	S	*	*				81.2	123.3	52.9	77.2	0	0	0	0	114.3
1026	E	22.9	Very low	26.3	Very low	165 Å²	165	128.7 Å²	128.7	77%	0.771	70%	0.701	S	S	*	*			trans	78.1	141	150.5	-72.2	177.1	-161.3	0	0	121.5
1027	H	25.4	Very low	26.3	Very low	156 Å²	156	132.5 Å²	132.5	72%	0.722	72%	0.715	S	S	*	*			trans	55.3	113.6	145.6	-71.5	-59	0	0	0	123.1
1028	S	23.1	Very low	26.4	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	71%	0.707	S	S	*	*			trans	66.6	170.6	141.7	63.9	0	0	0	0	116
1029	V	25.1	Very low	26.5	Very low	123 Å²	123	129.7 Å²	129.7	75%	0.745	71%	0.706	S	S	*	*			cis	-145.5	122.3	31.1	172.2	0	0	0	0	113
1030	V	24	Very low	26.5	Very low	134 Å²	134	129.3 Å²	129.3	81%	0.812	71%	0.708	S	S	*	*				29.9	115.2	129.9	-171	0	0	0	0	120.9
1031	A	27.1	Very low	26.2	Very low	89 Å²	89	124.2 Å²	124.2	74%	0.736	69%	0.69	S	S	*	*			trans	-174.7	142.8	136.6	0	0	0	0	0	108
1032	N	27.4	Very low	26.2	Very low	146 Å²	146	127.1 Å²	127.1	78%	0.781	70%	0.698	S	S	*	*	S	Bend	cis	-151.3	160.6	6.3	-118	-21.6	0	0	0	110.7
1033	L	29.6	Very low	26.2	Very low	142 Å²	142	127.5 Å²	127.5	74%	0.743	70%	0.7	S	S	*	*			trans	50.8	88.8	164.5	-68.9	152	0	0	0	116.4
1034	T	24.4	Very low	26.2	Very low	106 Å²	106	127.9 Å²	127.9	65%	0.65	70%	0.702	S	S	*	*				59.4	142.6	62.7	81.1	0	0	0	0	116.1
1035	N	27.1	Very low	26	Very low	136 Å²	136	126.7 Å²	126.7	73%	0.727	70%	0.699	S	S	*	*			trans	80.6	135.7	163.6	-57	-14.2	0	0	0	116.7
1036	T	26.6	Very low	26.1	Very low	106 Å²	106	127.4 Å²	127.4	65%	0.65	70%	0.7	S	S	*	*			cis	-168.7	161.5	-13.1	17	0	0	0	0	109.4
1037	I	26.8	Very low	26.2	Very low	153 Å²	153	125.6 Å²	125.6	79%	0.785	70%	0.696	S	S	*	*			trans	69	138.6	146.5	-73.8	159.5	0	0	0	117.3
1038	S	27.4	Very low	26.1	Very low	79 Å²	79	124.8 Å²	124.8	55%	0.552	70%	0.696	S	S	*	*			cis	-162.5	168.5	-29.8	68.2	0	0	0	0	108.5
1039	D	27.9	Very low	26.1	Very low	124 Å²	124	124.2 Å²	124.2	66%	0.663	69%	0.692	S	S	*	*			trans	62	159.4	148.7	-61.2	-43.5	0	0	0	120
1040	L	27.5	Very low	26	Very low	142 Å²	142	123.5 Å²	123.5	74%	0.743	69%	0.691	S	S	*	*			cis	-126.2	89	-4.8	-159	90.7	0	0	0	111
1041	T	26	Very low	26	Very low	77 Å²	77	120.8 Å²	120.8	47%	0.472	68%	0.679	S	S	.	*			trans	38.9	157.2	132.5	79.4	0	0	0	0	123
1042	K	26.8	Very low	25.9	Very low	165 Å²	165	121.5 Å²	121.5	72%	0.717	67%	0.674	S	S	*	*			trans	81	133.2	137.5	-84.1	161.5	-156	143.9	0	119
1043	K	26.9	Very low	25.7	Very low	178 Å²	178	117.9 Å²	117.9	77%	0.774	66%	0.657	S	S	*	*			trans	74.6	135.5	151.3	-64	170.9	175.6	-173.7	0	114.9
1044	N	25.3	Very low	25.5	Very low	113 Å²	113	120.4 Å²	120.4	60%	0.604	66%	0.662	S	S	*	*			cis	-155.2	153.7	-3.2	-117.7	4.2	0	0	0	108.8
1045	I	25.6	Very low	25.4	Very low	131 Å²	131	121.1 Å²	121.1	67%	0.672	66%	0.661	S	S	*	*				40.6	113.2	88.3	-66.9	175.7	0	0	0	110.2
1046	T	24.8	Very low	25.3	Very low	103 Å²	103	120.7 Å²	120.7	63%	0.632	67%	0.668	S	S	*	*			cis	-175.1	-169.7	12.1	21.2	0	0	0	0	106.5
1047	N	24.5	Very low	25.1	Very low	126 Å²	126	119.4 Å²	119.4	67%	0.674	66%	0.66	S	S	*	*			trans	81.4	133.6	133.4	-81.5	-4.9	0	0	0	119.8
1048	L	25	Very low	24.9	Very low	139 Å²	139	120.7 Å²	120.7	73%	0.728	66%	0.662	S	S	*	*			trans	58	97.9	130.5	-57.2	171.1	0	0	0	116.6
1049	S	22.8	Very low	24.7	Very low	97 Å²	97	121.6 Å²	121.6	68%	0.678	67%	0.669	S	S	*	*				79.3	134.9	69.4	73.9	0	0	0	0	115.2
1050	C	23	Very low	24.5	Very low	107 Å²	107	119.9 Å²	119.9	72%	0.723	67%	0.666	S	S	*	*			trans	59.7	126.7	144.1	-163.5	0	0	0	0	119.6
1051	S	23	Very low	24.2	Very low	78 Å²	78	118 Å²	118	55%	0.545	67%	0.665	S	S	.	*			trans	64.1	161.5	165.2	76.6	0	0	0	0	114.9
1052	T	24.6	Very low	24.1	Very low	103 Å²	103	118.2 Å²	118.2	63%	0.632	67%	0.67	S	S	*	*			cis	-134.6	135.2	17.1	44.9	0	0	0	0	109.1
1053	T	23.8	Very low	24	Very low	71 Å²	71	117.9 Å²	117.9	44%	0.436	68%	0.675	S	S	.	*				41.2	86.4	81.7	64.5	0	0	0	0	115.8	N520	N520-T1053 PolarHBondContact ND2-N 3.3Å
1054	K	24.7	Very low	23.8	Very low	195 Å²	195	116.1 Å²	116.1	85%	0.848	67%	0.669	S	S	*	*			trans	-148.4	118.6	142.7	-102.1	153.9	-174.9	177	0	107.4
1055	L	22.4	Very low	23.8	Very low	120 Å²	120	116.9 Å²	116.9	63%	0.628	67%	0.673	S	S	*	*				67.2	76	64.6	-76	86.1	0	0	0	113.3	T1057	L1055-T1057 WeakPolarHBondContact CA-OG1 3.34Å; L1055-T1057 HydrophobicContact CB-CG2 4.19Å; L1055-T1057 WeakPolarHBondContact CB-OG1 3.44Å; L1055-T1057 HydrophobicContact CD2-CG2 3.96Å; L1055-T1057 HydrophobicContact CG-CG2 3.69Å
1056	C	25.4	Very low	23.7	Very low	128 Å²	128	116.3 Å²	116.3	87%	0.865	68%	0.676	S	S	*	*				-121.7	112.3	109.3	-64.8	0	0	0	0	104.9
1057	T	22	Very low	23.8	Very low	78 Å²	78	117.5 Å²	117.5	48%	0.479	68%	0.675	S	S	.	*			cis	54	112.1	20.8	56.7	0	0	0	0	115.1	L1055	L1055-T1057 WeakPolarHBondContact CA-OG1 3.34Å; L1055-T1057 HydrophobicContact CB-CG2 4.19Å; L1055-T1057 WeakPolarHBondContact CB-OG1 3.44Å; L1055-T1057 HydrophobicContact CD2-CG2 3.96Å; L1055-T1057 HydrophobicContact CG-CG2 3.69Å
1058	H	23.1	Very low	23.8	Very low	180 Å²	180	119.4 Å²	119.4	83%	0.833	68%	0.675	S	S	*	*			trans	66.5	154.3	-179.2	-39.7	-70	0	0	0	113
1059	S	22.6	Very low	23.9	Very low	99 Å²	99	115.2 Å²	115.2	69%	0.692	65%	0.653	S	S	*	*			cis	-141.4	-177.1	7.7	57.5	0	0	0	0	111.7
1060	S	23.8	Very low	24.1	Very low	88 Å²	88	118.3 Å²	118.3	62%	0.615	65%	0.654	S	S	*	*			trans	46.2	108.5	146.8	55.7	0	0	0	0	118
1061	S	22.9	Very low	24.3	Very low	102 Å²	102	121.9 Å²	121.9	71%	0.713	66%	0.658	S	S	*	*				56.7	145.6	64.2	87.6	0	0	0	0	114.2
1062	S	22.6	Very low	24.5	Very low	82 Å²	82	120.8 Å²	120.8	57%	0.573	66%	0.659	S	S	*	*			trans	42.9	101.6	149.8	60.1	0	0	0	0	117.9
1063	L	24.3	Very low	24.8	Very low	158 Å²	158	123.7 Å²	123.7	83%	0.827	67%	0.67	S	S	*	*				-149.1	125.7	104.4	-85.1	127.5	0	0	0	107.1
1064	Q	24.4	Very low	25	Very low	141 Å²	141	125.1 Å²	125.1	66%	0.659	68%	0.683	S	S	*	*				67.8	133.5	76.1	-96.5	124.8	-29.7	0	0	112.5
1065	D	23.8	Very low	25.1	Very low	129 Å²	129	121.6 Å²	121.6	69%	0.69	68%	0.682	S	S	*	*			cis	-167.5	-176.3	-2.7	-143.8	-22.5	0	0	0	110.2
1066	V	24.9	Very low	25.4	Very low	118 Å²	118	120.1 Å²	120.1	72%	0.715	68%	0.682	S	S	*	*			trans	63.2	129.6	141.1	154.5	0	0	0	0	119.1
1067	M	25.5	Very low	25.5	Very low	128 Å²	128	120 Å²	120	63%	0.631	68%	0.677	S	S	*	*			cis	-159.7	132.3	2.2	-102.6	-96.3	-100.8	0	0	113	Y1304	M1067-Y1304 WeakPolarHBondContact O-CE2 3.42Å
1068	Y	25.9	Very low	25.8	Very low	167 Å²	167	121.7 Å²	121.7	66%	0.655	69%	0.688	S	S	*	*				47.7	117.1	125	-82.2	-113	0	0	0	123.3
1069	N	25.9	Very low	25.9	Very low	51 Å²	51	118.3 Å²	118.3	27%	0.273	68%	0.68	S	S	.	*				47.2	127.1	113	-77.6	-51	0	0	0	121.7	S1301	N1069-S1301 PolarHBondContact OD1-OG 2.91Å
1070	K	28.1	Very low	26.3	Very low	161 Å²	161	120 Å²	120	70%	0.7	69%	0.686	S	S	*	*				-152.5	157.3	124.6	-120.3	158	-172.5	175.5	0	116.6	N1303	K1070-N1303 PolarHBondContact N-ND2 2.86Å
1071	F	26.9	Very low	26.5	Very low	182 Å²	182	122.4 Å²	122.4	80%	0.798	69%	0.692	S	S	*	*			trans	-61.5	168.6	-177.4	-63.9	-107.8	0	0	0	113.8
1072	G	28	Very low	26.9	Very low	56 Å²	56	121.2 Å²	121.2	58%	0.577	68%	0.684	S	S	*	*			cis	150.9	163.1	-5.3	0	0	0	0	0	113.5
1073	N	29.1	Very low	27	Very low	163 Å²	163	127.9 Å²	127.9	87%	0.872	70%	0.696	S	S	*	*			trans	66.6	163.2	170.9	-54.6	-11.1	0	0	0	116
1074	S	28.8	Very low	27.3	Very low	101 Å²	101	129.2 Å²	129.2	71%	0.706	70%	0.7	S	S	*	*			cis	-150.7	144.2	11.1	58.4	0	0	0	0	114.9
1075	C	27.9	Very low	27.3	Very low	122 Å²	122	129.7 Å²	129.7	82%	0.824	71%	0.708	S	S	*	*			trans	65	153.6	141.5	-66.2	0	0	0	0	121.7
1076	S	28.5	Very low	27.7	Very low	88 Å²	88	128.2 Å²	128.2	62%	0.615	71%	0.705	S	S	*	*			cis	-176.3	140.6	-21	52.2	0	0	0	0	112.4
1077	T	26.5	Very low	27.8	Very low	126 Å²	126	130.6 Å²	130.6	77%	0.773	71%	0.71	S	S	*	*			trans	59.5	158.4	142.8	55.4	0	0	0	0	120.4
1078	T	28.3	Very low	27.9	Very low	114 Å²	114	130.4 Å²	130.4	70%	0.699	72%	0.717	S	S	*	*			cis	-152.9	136.9	9.6	-10.9	0	0	0	0	111.8
1079	T	26.2	Very low	27.8	Very low	108 Å²	108	127.4 Å²	127.4	66%	0.663	72%	0.72	S	S	*	*			trans	23.7	127.3	141.4	58.3	0	0	0	0	122.2
1080	T	29.9	Very low	27.9	Very low	135 Å²	135	130.5 Å²	130.5	83%	0.828	74%	0.744	S	S	*	*				169.5	-175.4	113.5	34.1	0	0	0	0	110.3
1081	D	28.4	Very low	27.7	Very low	139 Å²	139	130 Å²	130	74%	0.743	75%	0.749	S	S	*	*				-168	161.3	-79.4	-113.4	-72.8	0	0	0	108.7
1082	S	30.3	Very low	27.9	Very low	77 Å²	77	127.1 Å²	127.1	54%	0.538	75%	0.746	S	S	.	*			cis	-154.8	173	-0.9	79.2	0	0	0	0	110.5
1083	R	26.2	Very low	27.8	Very low	221 Å²	221	133.4 Å²	133.4	83%	0.834	76%	0.76	S	S	*	*			trans	36.6	126.5	144.7	-57.4	162.1	-174.3	178.3	1.2	118.4
1084	M	29.8	Very low	27.7	Very low	186 Å²	186	130.8 Å²	130.8	92%	0.916	76%	0.755	S	S	*	*				-152	153.4	55	-81.3	-166.7	171.6	0	0	115.5
1085	N	24.8	Very low	27.7	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	77%	0.767	S	S	*	*			trans	-112.6	-177.7	165.5	-124.9	-9.4	0	0	0	106.9
1086	P	32.5	Very low	27.7	Very low	99 Å²	99	134.5 Å²	134.5	64%	0.643	76%	0.76	S	S	*	*			cis	-134.9	-132	-17.2	35.4	-11.7	0	0	0	110.6
1087	M	25.9	Very low	27.7	Very low	167 Å²	167	136.8 Å²	136.8	82%	0.823	77%	0.77	S	S	*	*			trans	78.9	143.3	166.4	-61.3	177.6	72.4	0	0	117.1
1088	V	29	Very low	27.8	Very low	125 Å²	125	135.8 Å²	135.8	76%	0.758	77%	0.769	S	S	*	*			cis	-145.2	160.2	-2.8	109.5	0	0	0	0	111.4
1089	S	23	Very low	27.7	Very low	104 Å²	104	139 Å²	139	73%	0.727	78%	0.776	S	S	*	*			trans	-108	141.7	-178.8	49.7	0	0	0	0	114.2
1090	C	27.4	Very low	27.8	Very low	116 Å²	116	137.8 Å²	137.8	78%	0.784	78%	0.776	S	S	*	*			trans	-151.2	120.7	153.8	-81.1	0	0	0	0	105.8
1091	N	25.1	Very low	27.7	Very low	151 Å²	151	142 Å²	142	81%	0.807	78%	0.783	S	S	*	*				54.5	120.7	72.2	-73.2	2.4	0	0	0	113.7
1092	V	30.1	Very low	27.7	Very low	121 Å²	121	142.6 Å²	142.6	73%	0.733	78%	0.78	S	S	*	*				175.5	133	111.1	151.3	0	0	0	0	111.6
1093	E	26.2	Very low	27.6	Very low	187 Å²	187	147.8 Å²	147.8	87%	0.874	80%	0.795	S	S	*	*			trans	63.1	156.6	156.9	-77.9	156.9	-148.8	0	0	123.8
1094	S	26.7	Very low	27.8	Very low	108 Å²	108	145.1 Å²	145.1	76%	0.755	80%	0.796	S	S	*	*			trans	-118.9	143.4	-173.5	56.4	0	0	0	0	111
1095	Q	29.3	Very low	27.7	Very low	204 Å²	204	141.6 Å²	141.6	95%	0.953	78%	0.78	S	S	*	*			trans	-144.5	158.5	157.2	-114.1	170.4	52.3	0	0	111.2
1096	S	27.6	Very low	28.1	Very low	97 Å²	97	138.9 Å²	138.9	68%	0.678	77%	0.77	S	S	*	*			trans	-109.3	-174.8	-170.5	56	0	0	0	0	111.9
1097	T	27.8	Very low	27.9	Very low	137 Å²	137	140.1 Å²	140.1	84%	0.84	77%	0.772	S	S	*	*			trans	88.5	155.3	166.6	76.6	0	0	0	0	118.6
1098	S	28.5	Very low	28.1	Very low	105 Å²	105	142 Å²	142	73%	0.734	78%	0.776	S	S	*	*			trans	-77.3	130.5	174.2	168.3	0	0	0	0	110.7
1099	Q	28.1	Very low	28	Very low	182 Å²	182	142.7 Å²	142.7	85%	0.85	77%	0.774	S	S	*	*			trans	173.3	156.4	133.4	-96.4	169.8	26.3	0	0	112.5
1100	A	28.3	Very low	28.1	Very low	81 Å²	81	146.6 Å²	146.6	67%	0.669	78%	0.778	S	S	*	*			trans	56.4	99.2	156.1	0	0	0	0	0	120.1
1101	F	26.9	Very low	28	Very low	223 Å²	223	146 Å²	146	98%	0.978	78%	0.776	S	S	*	*			trans	-88.8	89.9	133.4	-120.3	-84.1	0	0	0	108.6
1102	K	28.9	Very low	28	Very low	153 Å²	153	148.2 Å²	148.2	67%	0.665	78%	0.778	S	S	*	*			trans	-150.8	145	172.8	-141.2	171.2	-170.7	171.4	0	108.1
1103	Q	28.4	Very low	27.7	Very low	185 Å²	185	146.8 Å²	146.8	86%	0.864	77%	0.774	S	S	*	*			trans	77.4	81.1	-171.7	-50.2	-178	6.5	0	0	116.2
1104	I	30.1	Very low	27.6	Very low	166 Å²	166	146.1 Å²	146.1	85%	0.851	77%	0.768	S	S	*	*				-123.8	91.3	129.2	-59.7	-176.1	0	0	0	107.9
1105	L	28	Very low	27.5	Very low	112 Å²	112	147.9 Å²	147.9	59%	0.586	76%	0.764	S	S	*	*			trans	-129.7	160	160	-112.2	80.7	0	0	0	105.9
1106	P	33.5	Very low	27.2	Very low	93 Å²	93	142.9 Å²	142.9	60%	0.604	75%	0.75	S	S	*	*			cis	-134.7	-153.6	-13.3	28.8	-4.3	0	0	0	111.3
1107	N	26.6	Very low	27.1	Very low	125 Å²	125	145.3 Å²	145.3	67%	0.668	75%	0.751	S	S	*	*			trans	75.1	93.3	153.7	-57.7	-21	0	0	0	119.9
1108	K	30.6	Very low	27	Very low	208 Å²	208	144 Å²	144	90%	0.904	74%	0.739	S	S	*	*				-163.8	90.8	126.2	-105	162.6	-172.8	175.8	0	109.1
1109	L	26.6	Very low	26.9	Very low	138 Å²	138	145.4 Å²	145.4	72%	0.723	73%	0.734	S	S	*	*				54.1	95	82.8	-73	165.4	0	0	0	114.7
1110	F	25.4	Very low	26.9	Very low	187 Å²	187	146.9 Å²	146.9	82%	0.82	73%	0.732	S	S	*	*				58.8	158.3	117.8	-93.5	-94.7	0	0	0	122.6
1111	S	26.3	Very low	26.7	Very low	104 Å²	104	150.5 Å²	150.5	73%	0.727	74%	0.74	S	S	*	*			trans	67.9	113.8	163.9	58.1	0	0	0	0	117.3
1112	F	24.1	Very low	26.9	Very low	196 Å²	196	144.1 Å²	144.1	86%	0.86	72%	0.721	S	S	*	*				83.9	100	67.1	-102.2	-94.9	0	0	0	114.8
1113	S	23.3	Very low	27	Very low	92 Å²	92	144.8 Å²	144.8	64%	0.643	72%	0.724	S	S	*	*			trans	67.7	143.9	132.3	75.9	0	0	0	0	122
1114	K	25.4	Very low	26.9	Very low	172 Å²	172	141.1 Å²	141.1	75%	0.748	71%	0.71	S	S	*	*			trans	73.8	115.1	146.2	-80.7	-177.4	162.7	-169.8	0	120.2
1115	Q	24.5	Very low	26.9	Very low	146 Å²	146	142.6 Å²	142.6	68%	0.682	71%	0.706	S	S	*	*				71.8	123.3	125.3	-68.4	180	-90.4	0	0	119.4
1116	C	23	Very low	27	Very low	98 Å²	98	144 Å²	144	66%	0.662	72%	0.715	S	S	*	*			trans	73.9	143.3	137.7	-65.2	0	0	0	0	116.6
1117	Q	24.5	Very low	26.6	Very low	149 Å²	149	146 Å²	146	70%	0.696	72%	0.719	S	S	*	*			cis	-165.2	168.6	-6.3	-128.9	174	6.4	0	0	110.5
1118	N	25.1	Very low	26.8	Very low	109 Å²	109	145 Å²	145	58%	0.583	72%	0.72	S	S	*	*			trans	71.8	132.1	142.2	-71.1	-17.7	0	0	0	121.6
1119	Q	26.5	Very low	26.6	Very low	134 Å²	134	141.1 Å²	141.1	63%	0.626	71%	0.709	S	S	*	*			trans	76.2	133.9	146.7	-63.3	166.8	53.3	0	0	117
1120	R	28.2	Very low	26.8	Very low	214 Å²	214	141 Å²	141	81%	0.808	71%	0.709	S	S	*	*			cis	-154.1	132.2	3.5	-114.6	156.5	-169.8	163.1	3	112.5
1121	N	25.1	Very low	26.9	Very low	157 Å²	157	138.6 Å²	138.6	84%	0.84	70%	0.703	S	S	*	*			trans	-70.1	177.9	151.5	-86.3	3.6	0	0	0	109.7
1122	P	31.7	Very low	27	Very low	89 Å²	89	142.9 Å²	142.9	58%	0.578	71%	0.709	S	S	*	*			cis	-130.9	-170.1	21.6	20.5	9.2	0	0	0	113.6
1123	F	29.4	Very low	27	Very low	167 Å²	167	141.7 Å²	141.7	73%	0.732	71%	0.708	S	S	*	*			cis	-156.7	136.6	48.7	-82.7	-87.1	0	0	0	111.4
1124	N	27.3	Very low	27.2	Very low	107 Å²	107	142.3 Å²	142.3	57%	0.572	71%	0.71	S	S	*	*				55.7	132.3	96.4	-61.3	5.1	0	0	0	114.3
1125	Y	30.5	Very low	27.2	Very low	197 Å²	197	143 Å²	143	77%	0.773	71%	0.713	S	S	*	*			cis	-133.3	-174.2	13.6	-61.7	-97.5	0	0	0	109.6
1126	N	30.5	Very low	27.5	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	72%	0.723	S	S	*	*			cis	-153.8	-179.1	7	-153.1	8.3	0	0	0	112.7
1127	L	24.2	Very low	27.7	Very low	133 Å²	133	146 Å²	146	70%	0.696	72%	0.723	S	S	*	*			trans	-133.5	-179.1	164.9	-130.9	78.4	0	0	0	108.1
1128	P	30.3	Very low	27.8	Very low	104 Å²	104	145.6 Å²	145.6	68%	0.675	73%	0.726	S	S	*	*			cis	-151.9	164	46.1	42.2	-20.3	0	0	0	120
1129	N	27.3	Very low	27.7	Very low	128 Å²	128	146.9 Å²	146.9	68%	0.684	74%	0.742	S	S	*	*			trans	55.2	127.8	143.8	-57.9	-11.4	0	0	0	120.3
1130	N	29.8	Very low	27.6	Very low	136 Å²	136	144.2 Å²	144.2	73%	0.727	75%	0.751	S	S	*	*				-156	141.5	69.6	-98.9	-34.5	0	0	0	115.1
1131	I	27.6	Very low	27.4	Very low	135 Å²	135	142.8 Å²	142.8	69%	0.692	75%	0.753	S	S	*	*	S	Bend	trans	55.9	114.1	139.5	-55.9	168.7	0	0	0	116.8
1132	K	28.3	Very low	27.4	Very low	194 Å²	194	145.9 Å²	145.9	84%	0.843	75%	0.754	S	S	*	*			cis	-154.5	134.6	7	-109.8	165.2	-174.1	173.7	0	111
1133	M	25.1	Very low	27.1	Very low	172 Å²	172	150 Å²	150	85%	0.847	77%	0.765	S	S	*	*			trans	-87.8	-179.9	163.1	-91.8	-96.2	175.7	0	0	110.1
1134	P	26.2	Very low	27.2	Very low	105 Å²	105	145.8 Å²	145.8	68%	0.682	76%	0.755	S	S	*	*			cis	-129.1	-169.3	8.7	32.4	-7.4	0	0	0	112.9
1135	K	26.8	Very low	27.1	Very low	187 Å²	187	148.2 Å²	148.2	81%	0.813	76%	0.757	S	S	*	*			cis	-153.3	134.8	25	-58.8	167.3	-178.5	174.7	0	113.1
1136	F	29.4	Very low	27	Very low	201 Å²	201	142.8 Å²	142.8	88%	0.882	74%	0.744	S	S	*	*			trans	-91.2	162.9	133	-81.7	-87.3	0	0	0	106.9
1137	P	27.6	Very low	26.8	Very low	104 Å²	104	140.8 Å²	140.8	68%	0.675	73%	0.734	S	S	*	*			cis	-152	-149.4	46.1	41.8	-17.1	0	0	0	115.2
1138	N	26.4	Very low	26.9	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	72%	0.722	S	S	*	*			trans	79.9	119.9	176.2	-51.8	-21.4	0	0	0	113.8
1139	C	23.1	Very low	26.9	Very low	136 Å²	136	140.7 Å²	140.7	92%	0.919	73%	0.727	S	S	*	*			cis	67.1	91.3	30.4	-52.4	0	0	0	0	114.6
1140	G	25.5	Very low	26.8	Very low	78 Å²	78	137.8 Å²	137.8	80%	0.804	72%	0.717	S	S	*	*			trans	-177.8	125.6	166.1	0	0	0	0	0	111.2
1141	H	23.7	Very low	26.6	Very low	184 Å²	184	136.4 Å²	136.4	85%	0.852	71%	0.708	S	S	*	*			trans	-74.7	146.9	163.8	-51.1	-45.6	0	0	0	109.1
1142	Y	25.2	Very low	26.4	Very low	222 Å²	222	139.1 Å²	139.1	87%	0.871	71%	0.71	S	S	*	*			trans	176.3	110.4	142.2	-97.2	-61.2	0	0	0	114.1
1143	H	23.9	Very low	26.4	Very low	175 Å²	175	137.9 Å²	137.9	81%	0.81	71%	0.705	S	S	*	*			trans	41.5	-138.3	156.5	-77.3	-87	0	0	0	120.1
1144	P	33.5	Very low	26.4	Very low	79 Å²	79	135.8 Å²	135.8	51%	0.513	70%	0.697	S	S	.	*				-120.3	-170.9	-113.1	39.6	-23.4	0	0	0	115	F245	F245-P1144 HydrophobicContact CE1-CB 4.49Å; F245-P1144 HydrophobicContact CE1-CG 3.75Å; F245-P1144 HydrophobicContact CZ-CG 4.07Å
1145	Y	25.3	Very low	26.6	Very low	158 Å²	158	137.2 Å²	137.2	62%	0.62	70%	0.699	S	S	*	*			trans	2.2	131.6	166.3	-86.8	-87.1	0	0	0	119.4	T244	T244-Y1145 HydrophobicContact CG2-CD1 4.22Å; T244-Y1145 HydrophobicContact CG2-CD2 4.34Å; T244-Y1145 HydrophobicContact CG2-CG 3.78Å
1146	T	26.5	Very low	26.5	Very low	83 Å²	83	132.6 Å²	132.6	51%	0.509	69%	0.69	S	S	.	*			trans	61.2	131.8	156.9	53.5	0	0	0	0	116.5	T244	T244-T1146 PolarHBondContact OG1-OG1 2.85Å
1147	N	26.7	Very low	26.5	Very low	101 Å²	101	130.1 Å²	130.1	54%	0.54	69%	0.686	S	S	.	*				-167.6	176.7	66.5	-144.2	-15.1	0	0	0	115.4	S241 S242	S241-N1147 WeakPolarHBondContact CB-OD1 3.44Å; S242-N1147 WeakPolarHBondContact CB-OD1 3.42Å; S242-N1147 PolarHBondContact OG-ND2 3.46Å; S242-N1147 PolarHBondContact OG-OD1 2.59Å
1148	C	27.7	Very low	26.6	Very low	67 Å²	67	128.5 Å²	128.5	45%	0.453	68%	0.678	S	S	.	*			trans	-81.3	163.5	173.2	-47.4	0	0	0	0	113.3
1149	H	29.1	Very low	26.7	Very low	168 Å²	168	129.5 Å²	129.5	78%	0.778	68%	0.675	S	S	*	*			trans	-167.7	149.8	142.8	-94.2	-5.1	0	0	0	109.6
1150	S	25.1	Very low	26.9	Very low	68 Å²	68	132 Å²	132	48%	0.476	67%	0.665	S	S	.	*			cis	-176	155.4	-12.8	53	0	0	0	0	110.6
1151	I	26.1	Very low	27	Very low	106 Å²	106	136.1 Å²	136.1	54%	0.544	66%	0.661	S	S	.	*				-152.1	144.8	128.3	-97.8	150.3	0	0	0	109.4	T238 T239	T238-I1151 WeakPolarHBondContact OG1-CB 3.33Å; T238-I1151 WeakPolarHBondContact OG1-CG2 3.34Å; T238-I1151 PolarHBondContact OG1-O 3.04Å; T239-I1151 PolarHBondContact OG1-N 3.19Å; T239-I1151 PolarHBondContact OG1-O 2.9Å
1152	R	23.8	Very low	27.2	Very low	193 Å²	193	133.2 Å²	133.2	73%	0.728	65%	0.652	S	S	*	*			trans	-76.6	168.1	-161.6	-61.1	170.3	-178.1	157.4	-1.2	112.5
1153	F	27.8	Very low	27.4	Very low	168 Å²	168	130.5 Å²	130.5	74%	0.737	65%	0.647	S	S	*	*			cis	-162.1	151.7	43.6	-86.6	-90.5	0	0	0	114.6
1154	N	25.8	Very low	27.4	Very low	127 Å²	127	129.9 Å²	129.9	68%	0.679	64%	0.642	S	S	*	*			trans	35.7	149.4	134.2	-59.7	22.4	0	0	0	121.5
1155	N	29.3	Very low	27.3	Very low	135 Å²	135	130.5 Å²	130.5	72%	0.722	65%	0.646	S	S	*	*			cis	-166.4	145.5	21.8	-128.6	13	0	0	0	115
1156	S	25.6	Very low	27.4	Very low	90 Å²	90	131.5 Å²	131.5	63%	0.629	66%	0.656	S	S	*	*			trans	55.8	134.6	139.4	62.1	0	0	0	0	127.6
1157	D	29.4	Very low	27.4	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	67%	0.667	S	S	*	*			trans	74.1	150.9	143.3	-70	-36.4	0	0	0	123.9
1158	S	28.7	Very low	27.4	Very low	71 Å²	71	138.3 Å²	138.3	50%	0.497	68%	0.682	S	S	.	*			cis	-172.1	155.5	-27.1	70.7	0	0	0	0	115.1
1159	K	29.3	Very low	27.2	Very low	162 Å²	162	140.5 Å²	140.5	70%	0.704	70%	0.698	S	S	*	*			trans	72.5	157.6	153.4	-64	159.1	-162.7	123.9	0	118.6
1160	R	27.6	Very low	27.1	Very low	189 Å²	189	138.1 Å²	138.1	71%	0.713	70%	0.7	S	S	*	*			cis	-171.8	147	-4.3	-113.5	171.8	178.5	178.6	-1.8	114
1161	F	27.8	Very low	27	Very low	163 Å²	163	142.7 Å²	142.7	72%	0.715	72%	0.719	S	S	*	*			trans	59.9	160.2	142.4	-62.6	-28.6	0	0	0	122.8
1162	L	27.3	Very low	27.1	Very low	124 Å²	124	144.5 Å²	144.5	65%	0.649	74%	0.735	S	S	*	*			cis	-167.7	154.2	-14.9	-105.4	167.4	0	0	0	113.2
1163	Q	28.6	Very low	27.1	Very low	165 Å²	165	140.9 Å²	140.9	77%	0.771	74%	0.74	S	S	*	*			trans	45.3	139.1	155.5	-74.3	159.8	-36	0	0	122.7
1164	K	25	Very low	27.1	Very low	162 Å²	162	141.6 Å²	141.6	70%	0.704	75%	0.747	S	S	*	*			cis	75	152.6	44.8	-99.5	-173.5	-179.7	-179.2	0	115.5
1165	P	31.5	Very low	27	Very low	92 Å²	92	142.2 Å²	142.2	60%	0.597	75%	0.751	S	S	*	*			cis	-147	-177.7	-6.1	45	-26.3	0	0	0	118.9
1166	H	26.3	Very low	26.9	Very low	179 Å²	179	143.6 Å²	143.6	83%	0.829	76%	0.756	S	S	*	*			trans	60.1	174.6	155.8	-57.1	-61.3	0	0	0	119.3
1167	I	27.2	Very low	26.9	Very low	145 Å²	145	146.1 Å²	146.1	74%	0.744	76%	0.756	S	S	*	*			cis	-142.8	160.9	10.4	-44.2	163.7	0	0	0	111.2
1168	E	27.1	Very low	26.9	Very low	182 Å²	182	147 Å²	147	85%	0.85	76%	0.761	S	S	*	*			trans	86.8	159.3	147.6	-111.5	150.2	-113.2	0	0	123.3
1169	S	23.4	Very low	26.9	Very low	113 Å²	113	152.4 Å²	152.4	79%	0.79	77%	0.772	S	S	*	*			trans	-156.8	144	-162	60.8	0	0	0	0	112.6
1170	S	27.2	Very low	26.8	Very low	118 Å²	118	149.9 Å²	149.9	83%	0.825	78%	0.775	S	S	*	*			trans	-156.8	137.8	164.8	59.8	0	0	0	0	113.3
1171	N	22.9	Very low	26.9	Very low	164 Å²	164	146 Å²	146	88%	0.877	77%	0.774	S	S	*	*			trans	-80.3	142	173.7	-58.9	-53.1	0	0	0	111.7
1172	T	28.5	Very low	27.1	Very low	144 Å²	144	148.5 Å²	148.5	88%	0.883	78%	0.784	S	S	*	*			trans	-144.3	122.9	151.1	43.2	0	0	0	0	110.7
1173	S	22.4	Very low	27.1	Very low	117 Å²	117	146.3 Å²	146.3	82%	0.818	79%	0.792	S	S	*	*			trans	-99.6	137.3	171.9	55.9	0	0	0	0	110.8
1174	M	27.7	Very low	27	Very low	183 Å²	183	149.8 Å²	149.8	90%	0.901	80%	0.8	S	S	*	*			trans	-145.8	122	160.8	-135.8	174.1	-169.9	0	0	111.2
1175	N	24.4	Very low	27	Very low	139 Å²	139	151.9 Å²	151.9	74%	0.743	81%	0.809	S	S	*	*			trans	-86.1	152.9	167.6	-64.8	-43	0	0	0	109.4
1176	I	27.9	Very low	26.8	Very low	165 Å²	165	152.1 Å²	152.1	85%	0.846	81%	0.812	S	S	*	*			trans	-153.2	142.2	135.9	-98.6	141.5	0	0	0	107.1
1177	F	24.8	Very low	26.7	Very low	142 Å²	142	150.3 Å²	150.3	62%	0.623	81%	0.814	S	S	*	*			trans	-95.2	157	-177.2	-78.6	-101.6	0	0	0	111	Y1179	F1177-Y1179 HydrophobicContact CD1-CD2 4.02Å; F1177-Y1179 AromaticContact CD1-CE2 3.69Å; F1177-Y1179 HydrophobicContact CD1-CE2 3.69Å; F1177-Y1179 AromaticContact CE1-CE2 3.78Å; F1177-Y1179 HydrophobicContact CE1-CE2 3.78Å
1178	D	28.4	Very low	26.7	Very low	168 Å²	168	152.7 Å²	152.7	90%	0.898	82%	0.819	S	S	*	*				-150.5	153	120.9	-115.2	-34.1	0	0	0	112.2
1179	Y	29	Very low	26.7	Very low	185 Å²	185	150.3 Å²	150.3	73%	0.725	81%	0.812	S	S	*	*			trans	-101	162.7	-173.7	-96.9	-82.5	0	0	0	111.6	F1177	F1177-Y1179 HydrophobicContact CD1-CD2 4.02Å; F1177-Y1179 AromaticContact CD1-CE2 3.69Å; F1177-Y1179 HydrophobicContact CD1-CE2 3.69Å; F1177-Y1179 AromaticContact CE1-CE2 3.78Å; F1177-Y1179 HydrophobicContact CE1-CE2 3.78Å
1180	S	27.8	Very low	26.7	Very low	109 Å²	109	151.1 Å²	151.1	76%	0.762	81%	0.814	S	S	*	*				174.1	-179.4	82.6	69.9	0	0	0	0	111
1181	P	29.9	Very low	26.7	Very low	107 Å²	107	153.4 Å²	153.4	70%	0.695	81%	0.812	S	S	*	*				-134.8	140.9	-101.4	33.7	-12.6	0	0	0	116.1
1182	K	31	Very low	26.8	Very low	216 Å²	216	149.9 Å²	149.9	94%	0.939	81%	0.805	S	S	*	*			trans	-141.2	110.3	165.3	-76.1	-168.5	177.9	174	0	115.3
1183	G	27.6	Very low	26.7	Very low	78 Å²	78	151.9 Å²	151.9	80%	0.804	80%	0.804	S	S	*	*			trans	70.5	94.5	136.9	0	0	0	0	0	118.6
1184	Y	26.3	Very low	27	Very low	238 Å²	238	153.8 Å²	153.8	93%	0.933	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-59.6	138	167.1	-91.2	-108.1	0	0	0	112.6
1185	K	26.1	Very low	26.9	Very low	206 Å²	206	149.8 Å²	149.8	90%	0.896	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-84.8	117.1	152.5	-74.1	-179.1	176.8	177.4	0	108
1186	S	26.5	Very low	27.2	Very low	97 Å²	97	148.5 Å²	148.5	68%	0.678	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-77.7	130.3	171.4	46.3	0	0	0	0	110.9
1187	T	25	Very low	27.1	Very low	140 Å²	140	146.3 Å²	146.3	86%	0.859	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-61.8	131.4	167.6	23.3	0	0	0	0	110.3
1188	F	27.3	Very low	27.2	Very low	196 Å²	196	146.3 Å²	146.3	86%	0.86	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-82.5	146.5	170.8	-102.5	-93.8	0	0	0	111.5
1189	L	26.6	Very low	27.2	Very low	132 Å²	132	145.2 Å²	145.2	69%	0.691	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-78.8	152.1	-167.9	-68.4	150.2	0	0	0	112.7	Q1191	L1189-Q1191 HydrophobicContact CB-CG 4.44Å; L1189-Q1191 PolarHBondContact O-N 3.37Å
1190	P	23.8	Very low	27	Very low	129 Å²	129	144 Å²	144	84%	0.838	79%	0.786	S	S	*	*			trans	-69.8	111	164.7	30.2	-32.1	0	0	0	109.2
1191	Q	26.9	Very low	27	Very low	166 Å²	166	144.4 Å²	144.4	78%	0.776	78%	0.784	S	S	*	*			trans	-109.1	143.6	177.3	-73.4	-172.2	-27.6	0	0	111.8	L1189	L1189-Q1191 HydrophobicContact CB-CG 4.44Å; L1189-Q1191 PolarHBondContact O-N 3.37Å
1192	A	25.7	Very low	27	Very low	90 Å²	90	145.3 Å²	145.3	74%	0.744	79%	0.787	S	S	*	*			trans	-65.4	143.2	-159.5	0	0	0	0	0	114.8	I1194	A1192-I1194 PolarHBondContact O-N 2.99Å
1193	H	26.3	Very low	26.9	Very low	186 Å²	186	141.7 Å²	141.7	86%	0.861	77%	0.773	S	S	*	*			trans	-64.8	117.4	159.3	-79.1	-94.5	0	0	0	109.6
1194	I	27.4	Very low	27.1	Very low	157 Å²	157	146.6 Å²	146.6	81%	0.805	77%	0.772	S	S	*	*			trans	-99.4	111.1	165.2	-60.5	176	0	0	0	106.7	A1192	A1192-I1194 PolarHBondContact O-N 2.99Å
1195	C	26.5	Very low	27.4	Very low	99 Å²	99	142.2 Å²	142.2	67%	0.669	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-85.1	124.8	174.7	-65.5	0	0	0	0	109.9
1196	P	29.4	Very low	27.6	Very low	112 Å²	112	137.4 Å²	137.4	73%	0.727	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-71	131.5	164.3	30.2	-32	0	0	0	109.3
1197	V	26.1	Very low	27.8	Very low	119 Å²	119	139.8 Å²	139.8	72%	0.721	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-100.3	128	173.1	177.3	0	0	0	0	108.1
1198	F	27.9	Very low	28.2	Very low	143 Å²	143	139.2 Å²	139.2	63%	0.627	75%	0.747	S	S	*	*			trans	-142.1	121.9	168.8	-80.9	-70.6	0	0	0	110.3	N106	N106-F1198 VanDerWaalsContact ND2-CE1 3.26Å; N106-F1198 WeakPolarHBondContact ND2-CE1 3.46Å; N106-F1198 WeakPolarHBondContact ND2-CZ 3.34Å
1199	N	29.1	Very low	28.2	Very low	144 Å²	144	135.7 Å²	135.7	77%	0.77	74%	0.741	S	S	*	*			trans	66.5	122.5	168.2	-56.4	-1.4	0	0	0	117.8	V1201	N1199-V1201 PolarHBondContact O-N 2.99Å
1200	D	24.7	Very low	28.3	Very low	161 Å²	161	137.2 Å²	137.2	86%	0.861	74%	0.739	S	S	*	*			trans	-82.3	73	-167.5	-61.6	-76.7	0	0	0	115.2
1201	V	27.7	Very low	28.5	Very low	117 Å²	117	139 Å²	139	71%	0.709	74%	0.74	S	S	*	*			trans	-132.8	104.7	164.8	-173.9	0	0	0	0	111.2	N1199	N1199-V1201 PolarHBondContact O-N 2.99Å
1202	V	29.8	Very low	28.7	Very low	125 Å²	125	137.4 Å²	137.4	76%	0.758	74%	0.742	S	S	*	*			trans	-104.3	99.6	171.6	-178	0	0	0	0	109.4	K1204	V1202-K1204 HydrophobicContact CG1-CG 4.24Å
1203	H	28.6	Very low	28.9	Very low	140 Å²	140	138 Å²	138	65%	0.648	74%	0.739	S	S	*	*			trans	-74.1	136.5	163.8	-95	-75	0	0	0	110
1204	K	31.8	Very low	28.8	Very low	181 Å²	181	135 Å²	135	79%	0.787	74%	0.735	S	S	*	*			trans	-130.9	133.3	173.3	-75.5	-173.2	175.9	-175.7	0	109.2	V1202	V1202-K1204 HydrophobicContact CG1-CG 4.24Å
1205	E	31.5	Very low	29	Very low	146 Å²	146	137.7 Å²	137.7	68%	0.682	74%	0.741	S	S	*	*			trans	-126.1	161.1	157.2	-77.5	-166	-166.3	0	0	109
1206	P	31.4	Very low	29.1	Very low	105 Å²	105	142.1 Å²	142.1	68%	0.682	75%	0.749	S	S	*	*			trans	-105.5	-170.4	-133	40.7	-39.8	0	0	0	116.3
1207	D	30.8	Very low	28.9	Very low	148 Å²	148	141.2 Å²	141.2	79%	0.791	74%	0.743	S	S	*	*			trans	76.6	64.9	163.1	-56.8	-13.2	0	0	0	118.8
1208	D	32.4	Very low	29	Very low	128 Å²	128	147.5 Å²	147.5	68%	0.684	75%	0.754	S	S	*	*				-162.8	148.4	116.5	-118	-23.9	0	0	0	111.9
1209	V	27.8	Very low	29	Very low	121 Å²	121	147.4 Å²	147.4	73%	0.733	76%	0.76	S	S	*	*			trans	-122.2	117.4	-169.2	179.6	0	0	0	0	113.3
1210	Y	28.1	Very low	28.9	Very low	164 Å²	164	150.6 Å²	150.6	64%	0.643	76%	0.762	S	S	*	*			trans	-118.7	128	164.2	-83.7	-77.5	0	0	0	112.3	S253 V1212	S253-Y1210 WeakPolarHBondContact CB-OH 3.11Å; S253-Y1210 PolarHBondContact OG-OH 3.39Å; Y1210-V1212 PolarHBondContact O-N 3.02Å
1211	L	28.3	Very low	29.1	Very low	166 Å²	166	148 Å²	148	87%	0.869	75%	0.754	S	S	*	*			trans	-78.9	103.1	-180	-72.7	167.1	0	0	0	111.7
1212	V	31	Very low	29.1	Very low	133 Å²	133	148 Å²	148	81%	0.806	76%	0.757	S	S	*	*			trans	-81.5	124.4	161.8	-179.3	0	0	0	0	108.5	Y1210	Y1210-V1212 PolarHBondContact O-N 3.02Å
1213	P	29.1	Very low	28.9	Very low	104 Å²	104	149.4 Å²	149.4	68%	0.675	76%	0.758	S	S	*	*			trans	-67.6	143.6	-175.4	26	-34.4	0	0	0	112.4	K1215	P1213-K1215 PolarHBondContact O-N 3.28Å; P1213-K1215 VanDerWaalsContact O-N 3.12Å
1214	P	25.4	Very low	28.9	Very low	122 Å²	122	149.8 Å²	149.8	79%	0.792	77%	0.765	S	S	*	*			trans	-75	105.7	-167.7	29	-35.8	0	0	0	112.7	K1216	P1214-K1216 PolarHBondContact O-N 2.75Å
1215	K	31.9	Very low	28.6	Very low	213 Å²	213	148 Å²	148	93%	0.926	76%	0.764	S	S	*	*			trans	-76.7	103.9	160.2	-82.6	-172.9	174	177.7	0	109.4	P1213	P1213-K1215 PolarHBondContact O-N 3.28Å; P1213-K1215 VanDerWaalsContact O-N 3.12Å
1216	K	27.4	Very low	28.5	Very low	192 Å²	192	150 Å²	150	84%	0.835	77%	0.77	S	S	*	*			trans	-52.2	150.9	178.6	-71.4	-177.4	176.5	-178	0	112.7	P1214	P1214-K1216 PolarHBondContact O-N 2.75Å
1217	P	25.6	Very low	28.3	Very low	94 Å²	94	152.2 Å²	152.2	61%	0.61	78%	0.777	S	S	*	*			trans	-68.5	154.2	-176.8	29.3	-36.8	0	0	0	112.9	L1219	P1217-L1219 HydrophobicContact CG-CG 4.39Å
1218	R	28.7	Very low	28.3	Very low	250 Å²	250	150.9 Å²	150.9	94%	0.943	77%	0.774	S	S	*	*			trans	-101.1	86.1	146	-69.4	-178.9	175.3	-176.6	-3.5	105.3
1219	L	28.4	Very low	28.1	Very low	142 Å²	142	151.6 Å²	151.6	74%	0.743	78%	0.778	S	S	*	*				53.9	120.6	78.7	-70.1	169	0	0	0	112.1	P1217	P1217-L1219 HydrophobicContact CG-CG 4.39Å
1220	Y	26.8	Very low	28.2	Very low	211 Å²	211	153.5 Å²	153.5	83%	0.827	78%	0.779	S	S	*	*			trans	-51.1	163.2	172.6	-72.8	-102.1	0	0	0	113
1221	P	27.7	Very low	28.2	Very low	105 Å²	105	154.2 Å²	154.2	68%	0.682	79%	0.786	S	S	*	*	S	Bend	trans	-52.2	137.2	156.5	26.8	-35.3	0	0	0	109.3	I1223	P1221-I1223 PolarHBondContact O-N 3.05Å
1222	P	27.6	Very low	28.1	Very low	119 Å²	119	153.3 Å²	153.3	77%	0.773	78%	0.782	S	S	*	*			trans	-74.7	103.6	-168.8	29	-34.9	0	0	0	111.5	N1224	P1222-N1224 PolarHBondContact O-N 3.09Å
1223	I	26.7	Very low	28.1	Very low	153 Å²	153	152 Å²	152	79%	0.785	78%	0.775	S	S	*	*			trans	-73.1	76	159.5	-54.8	179.1	0	0	0	107.5	P1221 N1225	P1221-I1223 PolarHBondContact O-N 3.05Å; I1223-N1225 VanDerWaalsContact C-N 3.3Å; I1223-N1225 PolarHBondContact O-N 3.2Å
1224	N	28.1	Very low	28	Very low	148 Å²	148	154.5 Å²	154.5	79%	0.791	78%	0.782	S	S	*	*			trans	-93.6	66.5	175.9	-137	36.5	0	0	0	108.9	P1222 K1226	P1222-N1224 PolarHBondContact O-N 3.09Å; N1224-K1226 VanDerWaalsContact C-N 3.3Å; N1224-K1226 PolarHBondContact O-N 3.13Å
1225	N	25.5	Very low	28.2	Very low	145 Å²	145	152.8 Å²	152.8	78%	0.775	77%	0.773	S	S	*	*			trans	-64.8	95.6	164	-84.4	15.4	0	0	0	108.1	I1223	I1223-N1225 VanDerWaalsContact C-N 3.3Å; I1223-N1225 PolarHBondContact O-N 3.2Å
1226	K	29.8	Very low	28.1	Very low	186 Å²	186	149.4 Å²	149.4	81%	0.809	77%	0.765	S	S	*	*			trans	-156.3	102.4	153	-117.3	169.8	-172.2	-179.1	0	111.1	N1224 T1228	N1224-K1226 VanDerWaalsContact C-N 3.3Å; N1224-K1226 PolarHBondContact O-N 3.13Å; K1226-T1228 PolarHBondContact O-N 3.49Å
1227	D	26.6	Very low	28.2	Very low	153 Å²	153	145.8 Å²	145.8	82%	0.818	76%	0.755	S	S	*	*			trans	-55.5	125	159.6	-45.7	-92.9	0	0	0	109.5
1228	T	30.4	Very low	28.2	Very low	120 Å²	120	147.5 Å²	147.5	74%	0.736	76%	0.757	S	S	*	*			trans	-164.3	113.8	134.8	27.2	0	0	0	0	107.6	K1226	K1226-T1228 PolarHBondContact O-N 3.49Å
1229	N	28.3	Very low	28.2	Very low	142 Å²	142	141.3 Å²	141.3	76%	0.759	74%	0.743	S	S	*	*			trans	24.7	125.1	132.4	-38.7	-21.9	0	0	0	115.6
1230	E	30	Very low	28.1	Very low	162 Å²	162	142.1 Å²	142.1	76%	0.757	74%	0.743	S	S	*	*				-170.6	157.2	74.6	-98	-176	177	0	0	114.9
1231	F	29.4	Very low	28.1	Very low	179 Å²	179	136 Å²	136	79%	0.785	73%	0.731	S	S	*	*			trans	46.7	81.5	156.7	-65.8	-67.8	0	0	0	121.3
1232	N	25.9	Very low	28	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	73%	0.731	S	S	*	*				-7	152.4	109.6	-104.4	-16.2	0	0	0	116.2
1233	P	30.7	Very low	27.9	Very low	104 Å²	104	139.3 Å²	139.3	68%	0.675	72%	0.724	S	S	*	*				-159.4	-176.4	61.5	44.5	-23.6	0	0	0	118.9
1234	I	27.7	Very low	27.9	Very low	158 Å²	158	137 Å²	137	81%	0.81	72%	0.722	S	S	*	*			trans	73.9	125.4	163.3	-56.3	179.1	0	0	0	114.6
1235	S	28.8	Very low	27.8	Very low	86 Å²	86	134.4 Å²	134.4	60%	0.601	71%	0.714	S	S	*	*			cis	-153.5	146	5.5	47.4	0	0	0	0	113.1
1236	N	29.2	Very low	27.9	Very low	141 Å²	141	133.4 Å²	133.4	75%	0.754	71%	0.709	S	S	*	*			trans	60.2	135.9	141.2	-57.5	6.9	0	0	0	118.4
1237	N	29.5	Very low	27.8	Very low	117 Å²	117	131.2 Å²	131.2	63%	0.626	70%	0.701	S	S	*	*			cis	-157.3	142.5	7.3	-116.4	6.9	0	0	0	109.2
1238	I	26.7	Very low	27.8	Very low	129 Å²	129	130.7 Å²	130.7	66%	0.662	70%	0.696	S	S	*	*				57.3	114.6	107.6	-64.8	-179	0	0	0	112.2
1239	N	28.4	Very low	27.6	Very low	121 Å²	121	131 Å²	131	65%	0.647	69%	0.691	S	S	*	*			cis	-160.1	165.3	24.1	-125.5	2.9	0	0	0	116.2
1240	H	26.6	Very low	27.6	Very low	159 Å²	159	130.5 Å²	130.5	74%	0.736	69%	0.689	S	S	*	*			trans	18.9	146.3	135.1	-65.9	-25.4	0	0	0	121.7
1241	S	26.1	Very low	27.5	Very low	83 Å²	83	130.8 Å²	130.8	58%	0.58	69%	0.69	S	S	*	*			cis	176	166.6	-0.1	50.2	0	0	0	0	112.2
1242	K	25.8	Very low	27.3	Very low	158 Å²	158	129.3 Å²	129.3	69%	0.687	69%	0.69	S	S	*	*			trans	67.4	160.2	146.5	-76.8	159.1	157.8	-88.2	0	115.4
1243	E	26.6	Very low	27.4	Very low	134 Å²	134	131 Å²	131	63%	0.626	69%	0.693	S	S	*	*			cis	-154	141.6	-7.4	-131.1	149.6	179.2	0	0	111.2
1244	S	26.3	Very low	27.1	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	70%	0.698	S	S	*	*			trans	65	163.8	138.6	86	0	0	0	0	118.8
1245	C	24.9	Very low	26.9	Very low	93 Å²	93	132.2 Å²	132.2	63%	0.628	69%	0.691	S	S	*	*			cis	-160	156.8	-14.1	-130.5	0	0	0	0	108.9
1246	N	27.3	Very low	26.8	Very low	123 Å²	123	135.1 Å²	135.1	66%	0.658	70%	0.7	S	S	*	*			trans	64.6	156.7	150	-62.2	-12.7	0	0	0	117.4
1247	H	29.6	Very low	26.7	Very low	140 Å²	140	135.9 Å²	135.9	65%	0.648	70%	0.697	S	S	*	*			cis	-135.4	133.9	-3.6	-106.6	-40.5	0	0	0	106.9
1248	M	26	Very low	26.5	Very low	143 Å²	143	137 Å²	137	70%	0.704	70%	0.701	S	S	*	*				64.9	145.8	104.2	-77.5	-175.6	57.8	0	0	116.8
1249	I	26.2	Very low	26.4	Very low	126 Å²	126	136.8 Å²	136.8	65%	0.646	70%	0.702	S	S	*	*			cis	-167.4	169.1	-24.8	-134.6	174.8	0	0	0	106.9
1250	N	28.3	Very low	26.3	Very low	132 Å²	132	136.7 Å²	136.7	71%	0.706	70%	0.701	S	S	*	*			trans	69.7	147.9	178.6	-63.3	-13.3	0	0	0	115.8
1251	E	27.4	Very low	26.2	Very low	168 Å²	168	137.9 Å²	137.9	79%	0.785	70%	0.699	S	S	*	*			cis	-141.8	147.1	-2.4	-137.8	161.1	-143.6	0	0	113.5
1252	L	24.7	Very low	26.3	Very low	148 Å²	148	142 Å²	142	78%	0.775	70%	0.703	S	S	*	*			trans	-110.4	111	177.4	-85.4	155	0	0	0	110
1253	Q	28.1	Very low	26.2	Very low	182 Å²	182	143.5 Å²	143.5	85%	0.85	71%	0.71	S	S	*	*			trans	-146.7	118.9	150	-65.6	-160.9	12.6	0	0	106.2
1254	F	24	Very low	26	Very low	178 Å²	178	141.6 Å²	141.6	78%	0.781	71%	0.712	S	S	*	*			cis	65.7	128.7	37	-105.1	-75	0	0	0	114.7
1255	T	24.2	Very low	26	Very low	109 Å²	109	142.5 Å²	142.5	67%	0.669	71%	0.713	S	S	*	*			trans	54	104.4	171	49.3	0	0	0	0	119.7
1256	N	27.4	Very low	25.9	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	72%	0.718	S	S	*	*				-152.3	123.3	118.7	-93	-43	0	0	0	108.9
1257	F	26.4	Very low	25.9	Very low	157 Å²	157	145.4 Å²	145.4	69%	0.689	73%	0.726	S	S	*	*				54.5	107.3	93.6	-78.2	-86.6	0	0	0	112.1
1258	I	24.6	Very low	25.6	Very low	140 Å²	140	145.4 Å²	145.4	72%	0.718	73%	0.731	S	S	*	*				60.2	131.6	68.4	-58.2	177	0	0	0	111.7
1259	N	26.1	Very low	25.8	Very low	125 Å²	125	145.6 Å²	145.6	67%	0.668	74%	0.735	S	S	*	*			trans	85.6	139	-169.3	-52	-45.4	0	0	0	112.7
1260	N	26.7	Very low	25.8	Very low	119 Å²	119	147 Å²	147	64%	0.636	74%	0.739	S	S	*	*			cis	-129.3	162.7	-1.1	-82.8	-55.2	0	0	0	109
1261	R	24.5	Very low	25.8	Very low	183 Å²	183	147.5 Å²	147.5	69%	0.691	74%	0.737	S	S	*	*				45.1	145.3	66	-38.8	-176.3	-173.5	170.6	4.4	112.8
1262	Y	26.9	Very low	25.9	Very low	169 Å²	169	146.8 Å²	146.8	66%	0.663	73%	0.733	S	S	*	*			cis	-133.6	166.9	8.5	-74.2	-90.7	0	0	0	108
1263	F	23.1	Very low	26	Very low	190 Å²	190	145.1 Å²	145.1	83%	0.833	72%	0.724	S	S	*	*				53.8	120.4	62.7	-104.6	-80.7	0	0	0	115.6
1264	S	23.4	Very low	26.1	Very low	95 Å²	95	145.4 Å²	145.4	66%	0.664	72%	0.719	S	S	*	*			trans	61.4	133.9	147.6	55.5	0	0	0	0	123.4
1265	T	25.4	Very low	26.3	Very low	124 Å²	124	143.5 Å²	143.5	76%	0.761	71%	0.71	S	S	*	*			trans	68.8	109.7	138.9	51.8	0	0	0	0	122.5
1266	V	23.7	Very low	26.6	Very low	123 Å²	123	145.1 Å²	145.1	75%	0.745	71%	0.71	S	S	*	*				43.8	110.5	115.1	-177.5	0	0	0	0	118.6
1267	N	28	Very low	26.6	Very low	154 Å²	154	141.8 Å²	141.8	82%	0.824	70%	0.695	S	S	*	*				-175.4	174.5	119.6	-102.8	-43.4	0	0	0	113.8
1268	N	23.2	Very low	26.9	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	70%	0.701	S	S	*	*			trans	-84.3	168.2	-179.2	-61.3	-54.3	0	0	0	114.1
1269	D	29.6	Very low	26.9	Very low	148 Å²	148	143.7 Å²	143.7	79%	0.791	70%	0.699	S	S	*	*			trans	154.4	111.1	137.5	-76.8	-13.6	0	0	0	109.1
1270	Q	25.5	Very low	27.2	Very low	155 Å²	155	148.4 Å²	148.4	72%	0.724	71%	0.709	S	S	*	*				85.1	143.3	70.4	-76.2	-149.7	13.7	0	0	115.7
1271	H	29.7	Very low	27.2	Very low	143 Å²	143	147.9 Å²	147.9	66%	0.662	71%	0.711	S	S	*	*			trans	69.9	153.5	176.5	-55.1	-70.4	0	0	0	117
1272	H	29.4	Very low	27.5	Very low	153 Å²	153	144.9 Å²	144.9	71%	0.708	71%	0.708	S	S	*	*			cis	-176.9	163.9	-18.3	-102.7	-1.2	0	0	0	108.8
1273	L	27	Very low	27.6	Very low	112 Å²	112	142.3 Å²	142.3	59%	0.586	71%	0.706	S	S	*	*			cis	-168.3	179.6	-21.9	-127.9	-179.4	0	0	0	109.3
1274	Y	30	Very low	28	Very low	188 Å²	188	140.5 Å²	140.5	74%	0.737	70%	0.7	S	S	*	*			trans	79	148.5	163.2	-65.9	-79.4	0	0	0	121.3
1275	K	28.4	Very low	28.2	Very low	138 Å²	138	142.4 Å²	142.4	60%	0.6	70%	0.701	S	S	*	*			cis	177.4	162	-37.7	-178.1	-179.4	167.6	-148.5	0	110.4
1276	H	30.2	Very low	28.4	Very low	144 Å²	144	141.9 Å²	141.9	67%	0.667	69%	0.694	S	S	*	*			trans	111.4	144.9	151.1	-77.6	-91.1	0	0	0	117.2
1277	V	27.5	Very low	28.7	Very low	78 Å²	78	141.5 Å²	141.5	47%	0.473	69%	0.687	S	S	.	*			cis	177.5	172.9	-36	130.4	0	0	0	0	109
1278	Y	31.6	Very low	28.9	Very low	210 Å²	210	140.4 Å²	140.4	82%	0.824	68%	0.681	S	S	*	*			trans	95.5	100.3	-178.2	-60.4	-68.1	0	0	0	112.4
1279	D	25.5	Very low	29.2	Very low	126 Å²	126	138.8 Å²	138.8	67%	0.674	67%	0.673	S	S	*	*			cis	66.7	115.6	37.2	-51.2	-54.8	0	0	0	115
1280	Y	31.5	Very low	29.2	Very low	225 Å²	225	140.6 Å²	140.6	88%	0.882	67%	0.67	S	S	*	*			trans	-152.1	138.9	132.2	-119	-77.5	0	0	0	110.3
1281	T	26.7	Very low	29.4	Very low	108 Å²	108	138.7 Å²	138.7	66%	0.663	67%	0.665	S	S	*	*			trans	-99.7	169.3	-179.7	48.5	0	0	0	0	111.6
1282	D	30.9	Very low	29.3	Very low	120 Å²	120	137.6 Å²	137.6	64%	0.642	66%	0.664	S	S	*	*				175	129.9	114.1	-90.3	5.8	0	0	0	114.3
1283	N	28.8	Very low	29.3	Very low	115 Å²	115	137.6 Å²	137.6	62%	0.615	66%	0.664	S	S	*	*				48.8	137.6	126.3	-46.8	-36.2	0	0	0	119.8
1284	H	31.2	Very low	29.2	Very low	151 Å²	151	138.2 Å²	138.2	70%	0.699	67%	0.668	S	S	*	*			cis	-150.1	151.8	25.7	-93.9	-59.1	0	0	0	110.1
1285	I	28.5	Very low	29.1	Very low	135 Å²	135	138.1 Å²	138.1	69%	0.692	67%	0.668	S	S	*	*				60.9	127.1	76.5	-81.9	177.2	0	0	0	111.6
1286	D	30.6	Very low	28.9	Very low	114 Å²	114	138.1 Å²	138.1	61%	0.61	67%	0.674	S	S	*	*			cis	-169.1	158.6	15.5	-129.8	13.5	0	0	0	114.2
1287	N	30	Very low	28.7	Very low	115 Å²	115	139.4 Å²	139.4	62%	0.615	68%	0.678	S	S	*	*			trans	49.9	164.2	136	-72.7	-28.5	0	0	0	122.2
1288	N	30.7	Very low	28.5	Very low	130 Å²	130	141.6 Å²	141.6	70%	0.695	69%	0.687	S	S	*	*			cis	-169	168.4	-8.6	-108.9	-25.4	0	0	0	107.1
1289	N	29.3	Very low	28.2	Very low	107 Å²	107	137.4 Å²	137.4	57%	0.572	68%	0.679	S	S	*	*			cis	-168	-174.9	-18.6	-168.1	18.6	0	0	0	108
1290	Y	29.8	Very low	28.1	Very low	186 Å²	186	141.4 Å²	141.4	73%	0.729	69%	0.686	S	S	*	*			trans	76.2	147.5	162.8	-49.1	-57.9	0	0	0	117.4
1291	D	29.9	Very low	27.8	Very low	115 Å²	115	133.5 Å²	133.5	62%	0.615	66%	0.664	S	S	*	*			cis	-159.3	167	-15.7	-109.8	-18.1	0	0	0	110.6
1292	N	27.6	Very low	27.8	Very low	119 Å²	119	134.7 Å²	134.7	64%	0.636	66%	0.66	S	S	*	*			trans	13.6	157.2	142.5	-42.1	-29.8	0	0	0	120.2
1293	E	28.8	Very low	27.5	Very low	153 Å²	153	132.4 Å²	132.4	72%	0.715	65%	0.647	S	S	*	*			cis	-166.7	143.8	28.2	-147	150.7	-96	0	0	111.2
1294	D	26	Very low	27.3	Very low	126 Å²	126	134.8 Å²	134.8	67%	0.674	65%	0.649	S	S	*	*			trans	30.4	171.6	145.4	-64.3	-9	0	0	0	125.9
1295	Y	27.3	Very low	27.1	Very low	186 Å²	186	132 Å²	132	73%	0.729	64%	0.639	S	S	*	*			trans	85.5	95.7	161.4	-56.8	-69.3	0	0	0	120.9
1296	D	24.3	Very low	26.9	Very low	138 Å²	138	134.1 Å²	134.1	74%	0.738	64%	0.643	S	S	*	*				40.5	166.3	108.1	-75.5	-36.6	0	0	0	123.3
1297	F	25.7	Very low	26.7	Very low	171 Å²	171	135.5 Å²	135.5	75%	0.75	65%	0.646	S	S	*	*			trans	81.3	92.9	164.8	-72.2	-86.2	0	0	0	119.9
1298	N	24.5	Very low	26.4	Very low	124 Å²	124	136.1 Å²	136.1	66%	0.663	65%	0.649	S	S	*	*				56.1	128.9	111	-79.2	-43.6	0	0	0	122
1299	N	24.4	Very low	26.1	Very low	122 Å²	122	134 Å²	134	65%	0.652	65%	0.645	S	S	*	*			trans	83	123.6	132.5	-74.7	-28.8	0	0	0	122.7
1300	Y	24.1	Very low	25.9	Very low	210 Å²	210	136.7 Å²	136.7	82%	0.824	66%	0.659	S	S	*	*			trans	71.3	155.1	140.9	-77.1	-127.9	0	0	0	118.7
1301	S	24.1	Very low	25.6	Very low	58 Å²	58	139.2 Å²	139.2	41%	0.406	67%	0.667	S	S	.	*			cis	-174.3	149.6	-25.2	58.7	0	0	0	0	114.4	N1069	N1069-S1301 PolarHBondContact OD1-OG 2.91Å
1302	K	26.5	Very low	25.3	Very low	134 Å²	134	139.1 Å²	139.1	58%	0.583	67%	0.674	S	S	*	*			trans	72.9	141.9	133	-90	-172.2	170.1	-170.4	0	125.2
1303	N	25.6	Very low	25.1	Very low	72 Å²	72	141.6 Å²	141.6	39%	0.385	68%	0.682	S	S	.	*			trans	76.7	149.7	154	-61	5.3	0	0	0	116.5	K1070 I1305	K1070-N1303 PolarHBondContact N-ND2 2.86Å; N1303-I1305 HydrophobicContact CB-CD1 4.36Å
1304	Y	25.1	Very low	24.7	Very low	164 Å²	164	139.9 Å²	139.9	64%	0.643	69%	0.686	S	S	*	*			cis	-108.5	152.8	14.8	-84	-117.4	0	0	0	112.5	M1067	M1067-Y1304 WeakPolarHBondContact O-CE2 3.42Å
1305	I	25.9	Very low	24.6	Very low	94 Å²	94	140.1 Å²	140.1	48%	0.482	70%	0.696	S	S	.	*				73	128.2	51.9	-57.9	166.4	0	0	0	110.6	N1303	N1303-I1305 HydrophobicContact CB-CD1 4.36Å
1306	F	25.5	Very low	24.6	Very low	179 Å²	179	138.6 Å²	138.6	79%	0.785	70%	0.7	S	S	*	*			cis	-102.7	154.9	32.3	-77	-108.3	0	0	0	114.7
1307	Q	24.8	Very low	24.6	Very low	143 Å²	143	139.8 Å²	139.8	67%	0.668	71%	0.707	S	S	*	*				68.9	128.3	52.4	-80.4	-178.5	-15.1	0	0	113
1308	N	25.3	Very low	24.7	Very low	127 Å²	127	139.6 Å²	139.6	68%	0.679	70%	0.702	S	S	*	*			cis	-137	142.5	13.6	-80.3	-34.9	0	0	0	110
1309	S	23.5	Very low	24.7	Very low	87 Å²	87	142.6 Å²	142.6	61%	0.608	71%	0.712	S	S	*	*				44.5	124.9	81	73.5	0	0	0	0	114.8
1310	N	25.7	Very low	24.7	Very low	162 Å²	162	144.3 Å²	144.3	87%	0.866	72%	0.72	S	S	*	*				-148.9	172.1	52.1	-87.9	-43.8	0	0	0	115.8
1311	R	22.8	Very low	24.9	Very low	239 Å²	239	142.1 Å²	142.1	90%	0.902	72%	0.722	S	S	*	*			trans	-91.8	149.7	166.1	-65.7	171.3	169.8	167.4	-5.6	111.3
1312	C	23.5	Very low	25	Very low	114 Å²	114	146.2 Å²	146.2	77%	0.77	74%	0.739	S	S	*	*				169.6	128.8	128.7	-89.3	0	0	0	0	108.6
1313	Q	22.8	Very low	24.9	Very low	171 Å²	171	146.8 Å²	146.8	80%	0.799	75%	0.748	S	S	*	*				72.1	101.4	73.3	-111.6	179.4	-24.8	0	0	115
1314	C	22.2	Very low	24.9	Very low	117 Å²	117	149.5 Å²	149.5	79%	0.791	76%	0.763	S	S	*	*			trans	49.5	116.9	148.7	-56.1	0	0	0	0	121
1315	C	23.5	Very low	24.9	Very low	131 Å²	131	147.2 Å²	147.2	89%	0.885	77%	0.767	S	S	*	*				177.6	168.7	111	-96.6	0	0	0	0	112.9
1316	N	26.1	Very low	24.9	Very low	153 Å²	153	150 Å²	150	82%	0.818	78%	0.779	S	S	*	*			trans	-81.3	162.6	177.4	-55.6	-20	0	0	0	112.1
1317	N	24.6	Very low	25	Very low	164 Å²	164	152.4 Å²	152.4	88%	0.877	78%	0.784	S	S	*	*				-174.4	153.2	125.7	-95.4	-5.1	0	0	0	113.2
1318	Y	27.3	Very low	25	Very low	167 Å²	167	155.1 Å²	155.1	66%	0.655	79%	0.79	S	S	*	*			trans	-90.6	148	165.1	-87.7	-101.1	0	0	0	110.2
1319	E	25.1	Very low	24.9	Very low	186 Å²	186	157 Å²	157	87%	0.869	79%	0.794	S	S	*	*			trans	171	118.8	140.5	-96.3	163.8	-170	0	0	107.9
1320	L	25.7	Very low	25	Very low	159 Å²	159	161.3 Å²	161.3	83%	0.832	81%	0.805	S	S	*	*				64.6	92.1	68.9	-90.5	172.2	0	0	0	116
1321	L	27.3	Very low	25.1	Very low	164 Å²	164	158.9 Å²	158.9	86%	0.859	79%	0.791	S	S	*	*			trans	-174.7	111.2	155.5	-97.3	160.9	0	0	0	104.7
1322	N	25.4	Very low	25.2	Very low	143 Å²	143	153.5 Å²	153.5	77%	0.765	79%	0.79	S	S	*	*			cis	78	138.1	38.1	-148.9	13.7	0	0	0	113.4
1323	L	25.5	Very low	25.5	Very low	147 Å²	147	155.8 Å²	155.8	77%	0.77	79%	0.79	S	S	*	*			trans	78.3	141.5	-160.4	-54.1	155.3	0	0	0	113.5
1324	D	26	Very low	25.7	Very low	129 Å²	129	157.1 Å²	157.1	69%	0.69	79%	0.789	S	S	*	*			cis	-140.6	136.7	10.5	-145	-0.5	0	0	0	112.4
1325	P	24.7	Very low	26	Very low	115 Å²	115	159.3 Å²	159.3	75%	0.747	79%	0.787	S	S	*	*			trans	-102	80.9	-173.9	37.3	-31.3	0	0	0	113.3
1326	Q	25.4	Very low	26.4	Very low	153 Å²	153	159.6 Å²	159.6	72%	0.715	78%	0.779	S	S	*	*			trans	-152.2	106.8	175	-110	163.6	95.3	0	0	113
1327	Y	28.2	Very low	26.6	Very low	229 Å²	229	158 Å²	158	90%	0.898	77%	0.77	S	S	*	*				-177.4	106.2	121.6	-109.8	-77.6	0	0	0	110.1
1328	Y	23.6	Very low	26.8	Very low	201 Å²	201	158.6 Å²	158.6	79%	0.788	76%	0.762	S	S	*	*			trans	-88.2	160.5	-178.6	-119.7	-100.6	0	0	0	111.6
1329	H	24.8	Very low	27.1	Very low	165 Å²	165	157.6 Å²	157.6	76%	0.764	76%	0.763	S	S	*	*			trans	56.5	111.4	165.2	-67.1	-63.1	0	0	0	118.9
1330	Q	25	Very low	27.4	Very low	179 Å²	179	156.9 Å²	156.9	84%	0.836	76%	0.76	S	S	*	*				-160.6	158.2	113.9	-111.8	168.9	11.5	0	0	113.5
1331	N	27	Very low	27.5	Very low	110 Å²	110	158 Å²	158	59%	0.588	76%	0.761	S	S	*	*			trans	68.2	46.8	158.1	-55.7	-9	0	0	0	119.1	Q1333	N1331-Q1333 PolarHBondContact O-N 3.34Å
1332	S	25.5	Very low	27.5	Very low	126 Å²	126	160 Å²	160	88%	0.881	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	74.2	148.9	55.4	0	0	0	0	111.1
1333	Q	29.9	Very low	27.6	Very low	163 Å²	163	160.9 Å²	160.9	76%	0.762	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.7	-10	-177.3	-133.5	164.1	-1.7	0	0	117.6	N1331	N1331-Q1333 PolarHBondContact O-N 3.34Å
1334	Y	27.6	Very low	27.7	Very low	199 Å²	199	161.6 Å²	161.6	78%	0.78	77%	0.766	S	S	*	*			trans	-95.8	19.5	-176.6	-87.1	-80.8	0	0	0	115.5
1335	H	28.8	Very low	27.8	Very low	162 Å²	162	163.4 Å²	163.4	75%	0.75	77%	0.77	S	S	*	*	S	Bend	trans	-98	15.1	-170.6	-150	-54.1	0	0	0	114.9
1336	L	31	Very low	28	Very low	138 Å²	138	166.3 Å²	166.3	72%	0.723	77%	0.771	S	S	*	*	S	Bend	trans	-112.8	-46.4	176.5	-95.1	76.8	0	0	0	113.9	Y1338 Q1339	L1336-Y1338 PolarHBondContact O-N 2.69Å; L1336-Q1339 PolarHBondContact O-N 3.41Å
1337	D	30.1	Very low	28.2	Very low	118 Å²	118	167.1 Å²	167.1	63%	0.631	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-73.7	-21.8	-165.7	-60.3	-30	0	0	0	114.8	Q1339 Q1340	D1337-Q1339 VanDerWaalsContact C-N 3.28Å; D1337-Q1339 PolarHBondContact O-N 3.19Å; D1337-Q1340 PolarHBondContact O-N 2.7Å
1338	Y	28.7	Very low	28.2	Very low	177 Å²	177	163 Å²	163	69%	0.694	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-78.7	-7.1	-178.4	-134.5	-95.2	0	0	0	114.2	L1336	L1336-Y1338 PolarHBondContact O-N 2.69Å
1339	Q	34.9	Very low	28.5	Very low	147 Å²	147	160.3 Å²	160.3	69%	0.687	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-95.1	11.2	173.1	-73.6	-168.8	-36.1	0	0	113.6	L1336 D1337	L1336-Q1339 PolarHBondContact O-N 3.41Å; D1337-Q1339 VanDerWaalsContact C-N 3.28Å; D1337-Q1339 PolarHBondContact O-N 3.19Å
1340	Q	30	Very low	28.8	Very low	170 Å²	170	159.9 Å²	159.9	79%	0.794	77%	0.765	S	S	*	*	S	Bend	trans	-120.1	8.1	174.5	-66.7	-168.5	-9.1	0	0	114	D1337	D1337-Q1340 PolarHBondContact O-N 2.7Å
1341	Q	27.4	Very low	29.1	Very low	183 Å²	183	158.3 Å²	158.3	86%	0.855	76%	0.759	S	S	*	*			trans	-135.4	14.5	178.9	-64.9	-167.3	-3.6	0	0	114.9
1342	Q	28.8	Very low	29.3	Very low	207 Å²	207	162.7 Å²	162.7	97%	0.967	78%	0.775	S	S	*	*			trans	-136.2	0	166.3	-68.1	-166.4	2.8	0	0	110

Retrieved 1,342 of 1,342 residues in 2118.8 ms (Link to these results)

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