A0A5K4F2P5_SCHMA Loading...

Nuclear receptor domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F2P5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,848 aa.

						>A0A5K4F2P5_SCHMA|A0A5K4F2P5
MIELDASPKKGRWEEVTSLLPSSKCTIGNKPFEVDRSGGMLCIDIENLGSFGGNQQPNYFSPLQPHYSIAFKDYPSEYGALPQADCAAPNVEFLTYPHSMADSQGNRDELSTPITITGFDNSSGISADSYLSNQFSDISQQLPGHNPFYVFEQSNLPIPNPVHPHSHSSHHYQHQHYGMDQSTDQLHNSVNDNVIPNEIPINTIPHSDYILSQQQQKNELYSSIFSESNYFLSNNTVNTLPNVQQNLPESYQSVIWLNQDHSQIQLQDQLHYTSDGIMTTQNHNNYSVIISNVNNNNIKANNIEMNTIVPVPVETMSTPIANGTTIHVQDSDNDVIMMRPLVEQSNHFETSECLSGNSVISNDLIDHIYCSNNNSGTTNNSSETAVTAANNNHHHHHYDTNTIPLQIYPTIFQPNYSPATSSSLSSSSSSCSSSSFSSLSSLSSSMILCTETLSITPATAKSSLVTTTITNISPSSSYYTNQDYKLTGMNYHQQHLKSNNHTDCNNTLLTTTTTTNNNNNNNNSNHSNEKKCKVCGDRAVNHNFGQLTCESCKAFFRRNAHKGLSTLMVTRMLRTNDTSSLIYESNRTAHIKSRGLELTCTAKSGEHVITPTTRRECPSCRLKQCFRVGMRPDLIQVRKKDGSKPRWLDKVPRAAIVHEQHLQSSESLQWSTNINNTTFHNNNDSDNSHSNSTFINSNRMKYRLNSDKFSKNKAKELKPHLTEHQPIDINNNSNHNSNNKDNNISCMEKSINLRRFNINSNDSVKIHSDPSYPSILQPHQQNHYQHPPSISPRSLHHQQCPQYEEKVTCDDQLNDYIMCVTSSPSLNTSNILNNVHYSMESNNLDKDLIINSVATGLTTDNNTSSSSTSPRIITTMSNNYFPTDTVFPFNSLIIPDSSQNNKYGDVNLTNWKTSSEYGDNNETIINNINCITSSPLLSSSSSVIIPSTTTLTEATVAMVKVTSGSTVATTKRTMIENKRINNNDDDKQPSSNLIFTEHHHQNVNFSTLNDINQLDDLILLTDSSQLIEQQESTDQLKPISKSISPSPSLPTTTTSLTSSSSVSSSLSSTTILRNNLSRNTLMCNLVSDGSIVSPCITSSLIFSTDTSIIPNGLTESCKHSNLPSLWSSSSIDNQLTIPIITSQQNECSLSTYLNTSMNQSLECISMNNHDLPLKTTMNSLSSELSPLLPSSSVSLFSSSSSSSSSSSSSSSSVSIRCNELQLDVNSINNTNYIIPVDLNNTLSLNESKLLDEYPVISLLDSNNNNNNNNSDSSTLSWPNLNHQMELQTKYGQIFTDLNHNDNEIDVMSGILQNKSQLYNKNSITIPINLNKINKAWSNMWQTGFIPNPEQIELNLDITQRPALKWCLTLANIWSDLLLRRISVFAMSLLGDLIQDDDYKTGYLSNCHSNNNHHQNKNANQKINESNMNEYFNELNQVHGIFQNDPMKDEENNIDHAFNDTNDLYLTWDDMLWIAKNRFTDCVPVLLISCSSFVNKTITPSSPLPSLSTSLNQETMSDFKNSNGHHKSTDDLDKLSFQCSINHHHHHQYSISSSSSSIITTTPTKKSCTKLISFQTEPNCVHFIDLTKLSNALGDIGKEYSLNNTTTTTTTNTTNNSSNDHNNQSTYPILQYLDAYISQLGNFLAYHPILLSAYMALKLTDPIIVGNEEYHDHFMDDHQHHHHHHHQYEWNPFIIHRNQRLQRLHKYFLNIFNEAIDYVAIETTQLKINNQSINNHNNNNQYISQEQIVANSRRTMLTEFLEWGREFDQTWSHFQQDIWNESMKHHLEYKISKGLNILYNKQLRFDDNIENDLLNILWDAKNECLSSTTSSSASAAAGYTPLEVTDVSQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	22.5	Very low	25	Very low	206 Å²	206	135 Å²	135	100%	1.015	75%	0.748	S	S	*	*				0	167.6	0	-73.5	127.1	63.2	0	0	109.8
2	I	19.4	Very low	25.2	Very low	98 Å²	98	141.4 Å²	141.4	50%	0.503	75%	0.752	S	S	.	*			trans	-113	106.5	154.6	-62.1	172.4	0	0	0	105.5	L4 I1558 T1559	I2-L4 HydrophobicContact CG2-CG 4.36Å; I2-L4 PolarHBondContact O-N 3.22Å; I2-I1558 WeakPolarHBondContact CD1-O 3.41Å; I2-T1559 HydrophobicContact CD1-CG2 4.25Å; I2-T1559 HydrophobicContact CG2-CG2 4.29Å
3	E	22.5	Very low	25	Very low	132 Å²	132	148.9 Å²	148.9	62%	0.617	76%	0.764	S	S	*	*			trans	-88.4	92.9	-177.3	-164.3	151.8	-113.9	0	0	109.3	D5	E3-D5 VanDerWaalsContact C-N 3.32Å; E3-D5 PolarHBondContact O-N 3.07Å
4	L	21.9	Very low	24.9	Very low	146 Å²	146	148.1 Å²	148.1	76%	0.764	76%	0.756	S	S	*	*			trans	-86.9	74.5	169.1	-81.6	170.7	0	0	0	109.1	I2 A6	I2-L4 HydrophobicContact CG2-CG 4.36Å; I2-L4 PolarHBondContact O-N 3.22Å; L4-A6 PolarHBondContact O-N 3.27Å
5	D	26	Very low	24.9	Very low	125 Å²	125	148.9 Å²	148.9	67%	0.668	76%	0.755	S	S	*	*			trans	-66.9	133.9	168.5	-168.3	13.4	0	0	0	109.9	E3	E3-D5 VanDerWaalsContact C-N 3.32Å; E3-D5 PolarHBondContact O-N 3.07Å
6	A	25.7	Very low	25	Very low	81 Å²	81	148.3 Å²	148.3	67%	0.669	76%	0.76	S	S	*	*			trans	-148.3	99.4	-168.7	0	0	0	0	0	110.4	L4	L4-A6 PolarHBondContact O-N 3.27Å
7	S	23.5	Very low	24.8	Very low	113 Å²	113	147.1 Å²	147.1	79%	0.79	76%	0.762	S	S	*	*			trans	-125.5	144.6	169.2	-87.1	0	0	0	0	113.2
8	P	32.1	Very low	24.8	Very low	111 Å²	111	143.3 Å²	143.3	72%	0.721	75%	0.75	S	S	*	*			trans	-139	171.8	-131.7	38.1	-19.1	0	0	0	116
9	K	28.5	Very low	24.8	Very low	201 Å²	201	139 Å²	139	87%	0.874	73%	0.728	S	S	*	*			trans	-148.7	139.4	146.8	-109.8	148.4	-170.4	172.5	0	112.4
10	K	28.1	Very low	24.8	Very low	201 Å²	201	137.2 Å²	137.2	87%	0.874	72%	0.718	S	S	*	*			trans	-81.1	158.5	180	-58.3	160.2	-176.9	166.8	0	109.2
11	G	25.1	Very low	24.8	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	71%	0.707	S	S	*	*			cis	-151.1	-175.9	-1.5	0	0	0	0	0	109.5
12	R	27.8	Very low	24.8	Very low	212 Å²	212	130.1 Å²	130.1	80%	0.8	70%	0.699	S	S	*	*			cis	-142.3	134.5	48.4	-177.1	176.9	-178.7	168.5	2.6	111	E14	R12-E14 HydrophobicContact CG-CG 4.36Å; R12-E14 IonicContact CZ-OE2 3.25Å; R12-E14 IonicContact NE-OE2 2.66Å; R12-E14 PolarHBondContact NE-OE2 2.58Å; R12-E14 IonicContact NH2-OE2 3Å; R12-E14 PolarHBondContact NH2-OE2 2.93Å
13	W	22.1	Very low	25.1	Very low	239 Å²	239	130.6 Å²	130.6	91%	0.905	71%	0.711	S	S	*	*			trans	-116.4	81.3	-172.4	-99.7	69.5	0	0	0	110.8
14	E	23.4	Very low	25.3	Very low	138 Å²	138	133.8 Å²	133.8	65%	0.645	72%	0.723	S	S	*	*			trans	-144	43.2	-174	-65.6	-170.8	127.8	0	0	114.8	R12	R12-E14 HydrophobicContact CG-CG 4.36Å; R12-E14 IonicContact CZ-OE2 3.25Å; R12-E14 IonicContact NE-OE2 2.66Å; R12-E14 PolarHBondContact NE-OE2 2.58Å; R12-E14 IonicContact NH2-OE2 3Å; R12-E14 PolarHBondContact NH2-OE2 2.93Å
15	E	25.7	Very low	25.4	Very low	160 Å²	160	133.1 Å²	133.1	75%	0.748	73%	0.729	S	S	*	*	S	Bend	trans	-153.3	-6.2	167.6	-130.7	-177.1	179.3	0	0	118.8	R594	E15-R594 PolarHBondContact O-NH1 3.45Å; E15-R594 VanDerWaalsContact O-NH1 3.11Å
16	V	25.4	Very low	25.4	Very low	138 Å²	138	133.8 Å²	133.8	84%	0.836	74%	0.737	S	S	*	*	S	Bend	trans	-118.6	48.3	-173.5	-159.1	0	0	0	0	112.9
17	T	22.9	Very low	25.5	Very low	129 Å²	129	138.5 Å²	138.5	79%	0.791	75%	0.75	S	S	*	*	S	Bend	trans	-135.2	27.3	175.1	-29.8	0	0	0	0	112.7
18	S	24.7	Very low	25.6	Very low	78 Å²	78	136.3 Å²	136.3	55%	0.545	75%	0.745	S	S	.	*	S	Bend	trans	-136.2	20.2	-177.6	53.1	0	0	0	0	115	R594	S18-R594 PolarHBondContact OG-NH1 3.48Å; S18-R594 PolarHBondContact OG-NH2 3.43Å
19	L	24.1	Very low	25.3	Very low	62 Å²	62	138.9 Å²	138.9	33%	0.325	75%	0.752	S	S	.	*	S	Bend	trans	-146.4	78.7	171.8	-77	-175.1	0	0	0	113.6	K592 R594	L19-K592 HydrophobicContact CB-CB 4.24Å; L19-K592 HydrophobicContact CB-CD 4.02Å; L19-K592 HydrophobicContact CD1-CB 4.48Å; L19-K592 HydrophobicContact CD2-CD 3.76Å; L19-K592 HydrophobicContact CG-CD 4.37Å; L19-R594 HydrophobicContact CD1-CB 3.69Å; L19-R594 HydrophobicContact CD1-CG 3.53Å
20	L	24.3	Very low	25.2	Very low	103 Å²	103	137.5 Å²	137.5	54%	0.539	75%	0.746	S	S	.	*	S	Bend		-174.6	150.1	128.8	-92.2	154	0	0	0	108.2	H590 K592	L20-H590 HydrophobicContact CD2-CB 3.51Å; L20-K592 HydrophobicContact CD2-CB 4.26Å; L20-K592 HydrophobicContact CD2-CD 3.95Å; L20-K592 HydrophobicContact CD2-CG 4.19Å; L20-K592 HydrophobicContact CG-CB 4.11Å; L20-K592 HydrophobicContact CG-CD 4Å; L20-K592 HydrophobicContact CG-CG 4.41Å
21	P	24.7	Very low	24.9	Very low	74 Å²	74	132.6 Å²	132.6	48%	0.481	74%	0.735	S	S	.	*			trans	-87.6	155.9	-168	-6.8	26.5	0	0	0	114.1	H590	P21-H590 VanDerWaalsContact CD-NE2 3.26Å; P21-H590 WeakPolarHBondContact CD-NE2 3.18Å; P21-H590 WeakPolarHBondContact CG-NE2 3.28Å
22	S	23.5	Very low	24.8	Very low	121 Å²	121	138.3 Å²	138.3	85%	0.846	74%	0.74	S	S	*	*			trans	-84.2	107.8	175	39	0	0	0	0	112.6
23	S	24.4	Very low	24.6	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	73%	0.73	S	S	*	*			trans	-173.7	155.8	146.5	44.1	0	0	0	0	111.5
24	K	26.7	Very low	24.7	Very low	199 Å²	199	129.7 Å²	129.7	87%	0.865	73%	0.729	S	S	*	*	S	Bend	trans	67	69	177	-56.8	-170.8	179.7	-174.4	0	117
25	C	24.4	Very low	24.8	Very low	132 Å²	132	129.8 Å²	129.8	89%	0.892	73%	0.733	S	S	*	*				-154.2	117.3	119.2	-111.6	0	0	0	0	109.3
26	T	26.4	Very low	24.8	Very low	138 Å²	138	132.8 Å²	132.8	85%	0.847	74%	0.738	S	S	*	*			trans	-150.3	121.1	177.8	47	0	0	0	0	110
27	I	27.1	Very low	24.7	Very low	181 Å²	181	131.9 Å²	131.9	93%	0.928	74%	0.737	S	S	*	*			trans	-127.1	134	156.7	-65.1	177.6	0	0	0	104.7
28	G	26.8	Very low	24.7	Very low	67 Å²	67	129.7 Å²	129.7	69%	0.691	74%	0.741	S	S	*	*	S	Bend	trans	95	37.2	170.1	0	0	0	0	0	119.1	K30	G28-K30 PolarHBondContact O-N 3.39Å
29	N	25	Very low	24.7	Very low	165 Å²	165	129.6 Å²	129.6	88%	0.882	75%	0.752	S	S	*	*	S	Bend	trans	33.1	50.8	149.4	-68.9	-3.6	0	0	0	121.3
30	K	25.7	Very low	24.7	Very low	171 Å²	171	133.2 Å²	133.2	74%	0.743	77%	0.769	S	S	*	*			trans	-169.9	159.4	132.6	-106.6	170	-176.4	-175.2	0	112.7	G28	G28-K30 PolarHBondContact O-N 3.39Å
31	P	22.8	Very low	24.6	Very low	99 Å²	99	135.3 Å²	135.3	64%	0.643	78%	0.78	S	S	*	*			trans	-110.5	173.1	-175.2	38.7	-28.3	0	0	0	114.4
32	F	24	Very low	24.5	Very low	191 Å²	191	136.9 Å²	136.9	84%	0.838	79%	0.791	S	S	*	*			trans	69.1	162.8	179	-65.6	-86.5	0	0	0	113.9
33	E	23.5	Very low	24.5	Very low	126 Å²	126	137 Å²	137	59%	0.589	78%	0.781	S	S	*	*			cis	-143	148.1	13.9	-150	155.6	-155.5	0	0	110	S1190	E33-S1190 PolarHBondContact OE1-N 3.43Å
34	V	24.2	Very low	24.3	Very low	144 Å²	144	139.5 Å²	139.5	87%	0.873	79%	0.786	S	S	*	*			trans	-104.7	104.4	176.7	178	0	0	0	0	109.1
35	D	25.2	Very low	24.3	Very low	139 Å²	139	137.4 Å²	137.4	74%	0.743	78%	0.783	S	S	*	*			trans	-115.3	164	171.1	-144.8	-22.5	0	0	0	112
36	R	24.4	Very low	24.3	Very low	224 Å²	224	138.4 Å²	138.4	85%	0.845	77%	0.774	S	S	*	*			trans	-117.7	89.1	-157.1	-71.1	172.6	163.1	172.2	-2.4	114.2
37	S	23.7	Very low	24.3	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	77%	0.768	S	S	*	*			trans	-142.1	148	159.5	49.5	0	0	0	0	110.8
38	G	23.8	Very low	24.1	Very low	84 Å²	84	138.4 Å²	138.4	87%	0.866	77%	0.77	S	S	*	*			trans	-79.3	159.7	175.4	0	0	0	0	0	112.1
39	G	25.2	Very low	24	Very low	75 Å²	75	138.1 Å²	138.1	77%	0.773	77%	0.767	S	S	*	*			trans	146	112.5	-179.5	0	0	0	0	0	110
40	M	22.9	Very low	24.1	Very low	139 Å²	139	135.8 Å²	135.8	69%	0.685	76%	0.764	S	S	*	*			trans	-72.5	129	170	-177.4	154.5	61.4	0	0	108.4
41	L	22.7	Very low	24.2	Very low	147 Å²	147	138.4 Å²	138.4	77%	0.77	78%	0.776	S	S	*	*			trans	-124.9	95.9	-176.7	-172.6	77.3	0	0	0	109.9	I43	L41-I43 HydrophobicContact CD2-CD1 4.17Å; L41-I43 HydrophobicContact CG-CD1 4.36Å; L41-I43 HydrophobicContact CG-CG1 4.28Å
42	C	21.7	Very low	24.4	Very low	106 Å²	106	137 Å²	137	72%	0.716	78%	0.779	S	S	*	*			trans	-82.3	130.8	167.2	-55.7	0	0	0	0	109.2
43	I	23.6	Very low	24.6	Very low	123 Å²	123	131.2 Å²	131.2	63%	0.631	77%	0.773	S	S	*	*			trans	-140.5	106.2	163.9	-60	-179.5	0	0	0	107.7	L41 I45	L41-I43 HydrophobicContact CD2-CD1 4.17Å; L41-I43 HydrophobicContact CG-CD1 4.36Å; L41-I43 HydrophobicContact CG-CG1 4.28Å; I43-I45 HydrophobicContact CG2-CD1 4.21Å; I43-I45 HydrophobicContact CG2-CG1 3.87Å
44	D	21.3	Very low	24.8	Very low	161 Å²	161	132.3 Å²	132.3	86%	0.861	78%	0.783	S	S	*	*			trans	-85.9	137.8	152.8	-81.7	-50.5	0	0	0	108.9
45	I	25.6	Very low	24.9	Very low	156 Å²	156	133.5 Å²	133.5	80%	0.8	78%	0.779	S	S	*	*			trans	-140.7	109.4	156.4	-59.9	-177.8	0	0	0	106.3	I43	I43-I45 HydrophobicContact CG2-CD1 4.21Å; I43-I45 HydrophobicContact CG2-CG1 3.87Å
46	E	24.3	Very low	25	Very low	153 Å²	153	135.1 Å²	135.1	72%	0.715	78%	0.782	S	S	*	*			trans	-73.7	166.8	169.3	-67.3	-161.8	135	0	0	112.3
47	N	25.9	Very low	25.4	Very low	132 Å²	132	128.9 Å²	128.9	71%	0.706	77%	0.771	S	S	*	*			trans	64.5	96.2	153.2	-69.5	-49.1	0	0	0	118.4
48	L	24.6	Very low	25.6	Very low	186 Å²	186	129.5 Å²	129.5	97%	0.974	77%	0.765	S	S	*	*				-130.4	88.3	129.3	-103.2	177.6	0	0	0	110.4
49	G	25	Very low	25.8	Very low	61 Å²	61	134.6 Å²	134.6	63%	0.629	76%	0.759	S	S	*	*			trans	-117	113.4	165.5	0	0	0	0	0	110.4
50	S	26.6	Very low	25.9	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	76%	0.763	S	S	*	*			trans	166.2	118.5	150.5	-83.3	0	0	0	0	112.6
51	F	27.4	Very low	25.8	Very low	226 Å²	226	138.8 Å²	138.8	99%	0.991	77%	0.766	S	S	*	*			trans	-173.2	130.4	136.2	-100.3	-67.9	0	0	0	107.6
52	G	26.6	Very low	26.2	Very low	70 Å²	70	137 Å²	137	72%	0.722	76%	0.764	S	S	*	*			cis	149.1	125	-9	0	0	0	0	0	112.4
53	G	27.7	Very low	26.4	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	77%	0.768	S	S	*	*			trans	90.7	140.3	180	0	0	0	0	0	113.4
54	N	27.7	Very low	26.4	Very low	149 Å²	149	141 Å²	141	80%	0.797	77%	0.773	S	S	*	*			cis	-125.7	143.7	3.7	-63.1	-32.8	0	0	0	108.4
55	Q	27.9	Very low	26.5	Very low	169 Å²	169	138.8 Å²	138.8	79%	0.79	77%	0.768	S	S	*	*				53.3	127.1	65.9	-64.1	-168.5	-3.1	0	0	114.2
56	Q	26.5	Very low	26.4	Very low	174 Å²	174	137.9 Å²	137.9	81%	0.813	76%	0.76	S	S	*	*			cis	-157.6	-175.3	-13.8	-120.2	-154.5	-35.8	0	0	109
57	P	32.6	Very low	26.4	Very low	93 Å²	93	141.9 Å²	141.9	60%	0.604	77%	0.77	S	S	*	*			trans	-105.8	-172.1	-149.6	44.2	-39.6	0	0	0	115
58	N	28.2	Very low	26.2	Very low	131 Å²	131	140.1 Å²	140.1	70%	0.701	77%	0.768	S	S	*	*				-175.5	132.9	127	-93.2	-18.1	0	0	0	114.2
59	Y	27.5	Very low	26.1	Very low	190 Å²	190	139 Å²	139	75%	0.745	76%	0.761	S	S	*	*			trans	30.1	145.4	152.5	-54.7	-85.5	0	0	0	122
60	F	26.7	Very low	26	Very low	194 Å²	194	140.2 Å²	140.2	85%	0.851	77%	0.766	S	S	*	*			cis	-142.4	159.1	26.9	-92.8	-85.7	0	0	0	114.3
61	S	21.9	Very low	25.7	Very low	109 Å²	109	144 Å²	144	76%	0.762	77%	0.768	S	S	*	*			trans	-109.4	-169.5	163.7	-30.6	0	0	0	0	109
62	P	30.5	Very low	25.5	Very low	110 Å²	110	142.8 Å²	142.8	71%	0.714	76%	0.762	S	S	*	*			cis	-149	-165.6	29.1	39.8	-14.7	0	0	0	117.5
63	L	27.2	Very low	25.4	Very low	155 Å²	155	145.8 Å²	145.8	81%	0.812	76%	0.761	S	S	*	*			trans	69.6	128.6	165.9	-56.4	170.5	0	0	0	116.7
64	Q	22.2	Very low	25.2	Very low	157 Å²	157	151.6 Å²	151.6	73%	0.734	76%	0.764	S	S	*	*			cis	75.7	115.8	8.5	-138.5	-177	24.6	0	0	117.1
65	P	24.9	Very low	25.1	Very low	115 Å²	115	149.9 Å²	149.9	75%	0.747	76%	0.761	S	S	*	*				-111.6	135	114.5	33	-33.5	0	0	0	110.6
66	H	22.8	Very low	24.9	Very low	137 Å²	137	144.7 Å²	144.7	63%	0.634	74%	0.743	S	S	*	*				54.7	84.8	84.4	-71.6	-72.9	0	0	0	114.5
67	Y	23.9	Very low	24.8	Very low	237 Å²	237	144.2 Å²	144.2	93%	0.929	74%	0.741	S	S	*	*				-131.4	137.1	112.7	-106.3	-81.9	0	0	0	109.5
68	S	21.2	Very low	24.4	Very low	95 Å²	95	147.8 Å²	147.8	66%	0.664	74%	0.743	S	S	*	*			trans	-106.2	129.4	-176.1	-52.8	0	0	0	0	109.8
69	I	22.6	Very low	24.3	Very low	161 Å²	161	145.1 Å²	145.1	83%	0.826	75%	0.747	S	S	*	*			trans	-116.8	115.4	152.1	-65	-179.4	0	0	0	105.8	F71	I69-F71 PolarHBondContact O-N 3.32Å
70	A	23	Very low	24.3	Very low	88 Å²	88	141 Å²	141	73%	0.727	75%	0.753	S	S	*	*			trans	-84.2	110.9	-178.9	0	0	0	0	0	109.8
71	F	20.9	Very low	24.1	Very low	197 Å²	197	139.6 Å²	139.6	86%	0.864	75%	0.753	S	S	*	*			trans	-71.7	133.1	137.1	-77.4	-85.2	0	0	0	106.9	I69	I69-F71 PolarHBondContact O-N 3.32Å
72	K	23.8	Very low	24.5	Very low	199 Å²	199	139.1 Å²	139.1	87%	0.865	75%	0.747	S	S	*	*			trans	-122.8	111.2	174.6	-168.5	-178.5	-177.9	-172.3	0	107.3
73	D	23.6	Very low	24.1	Very low	133 Å²	133	142.5 Å²	142.5	71%	0.711	75%	0.753	S	S	*	*			trans	-69.8	162.1	-176.9	-61.1	-73.9	0	0	0	113.2
74	Y	23.5	Very low	24.1	Very low	191 Å²	191	139.2 Å²	139.2	75%	0.749	75%	0.749	S	S	*	*			trans	-0.2	149.4	135.6	-77.3	-81.6	0	0	0	117.6
75	P	25.3	Very low	24.3	Very low	113 Å²	113	138.4 Å²	138.4	73%	0.734	75%	0.749	S	S	*	*				-152.1	-170	56.3	43.1	-21.6	0	0	0	118.6
76	S	23.4	Very low	24.4	Very low	60 Å²	60	137.9 Å²	137.9	42%	0.42	75%	0.748	S	S	.	*			trans	-59.5	176.7	166.9	50	0	0	0	0	113.4
77	E	25.1	Very low	24.9	Very low	163 Å²	163	135.7 Å²	135.7	76%	0.762	75%	0.753	S	S	*	*				-162	135.7	69.2	-74.6	-153.5	135.7	0	0	117
78	Y	24.6	Very low	25.2	Very low	168 Å²	168	128.7 Å²	128.7	66%	0.659	74%	0.744	S	S	*	*			trans	50	138.2	130.7	-75.5	-85.6	0	0	0	125.8	N1611	Y78-N1611 PolarHBondContact OH-ND2 2.83Å
79	G	26.3	Very low	25.8	Very low	76 Å²	76	129.2 Å²	129.2	78%	0.784	75%	0.745	S	S	*	*			trans	128	134.3	149.4	0	0	0	0	0	114.4
80	A	26.1	Very low	26.1	Very low	104 Å²	104	128.4 Å²	128.4	86%	0.86	74%	0.743	S	S	*	*			cis	-157.3	170	-11.6	0	0	0	0	0	112
81	L	22.5	Very low	26.6	Very low	164 Å²	164	129.3 Å²	129.3	86%	0.859	74%	0.739	S	S	*	*			trans	-62.8	172.5	167.8	-78	163.2	0	0	0	112.5
82	P	30.9	Very low	26.7	Very low	99 Å²	99	127.9 Å²	127.9	64%	0.643	74%	0.735	S	S	*	*			cis	-141.8	-172.4	19	41.9	-21.2	0	0	0	117.2
83	Q	23.4	Very low	26.9	Very low	180 Å²	180	126.1 Å²	126.1	84%	0.841	73%	0.728	S	S	*	*			trans	7.2	142.8	138.9	-56.3	161.4	-26.3	0	0	117.4
84	A	25.2	Very low	26.9	Very low	86 Å²	86	127.7 Å²	127.7	71%	0.711	74%	0.735	S	S	*	*			cis	-155.2	-165.5	29.8	0	0	0	0	0	110.5
85	D	28.1	Very low	27	Very low	140 Å²	140	123 Å²	123	75%	0.749	73%	0.726	S	S	*	*			cis	-160.9	168.7	13	-144.6	-16.9	0	0	0	114.4
86	C	26.7	Very low	26.9	Very low	105 Å²	105	127.5 Å²	127.5	71%	0.709	73%	0.73	S	S	*	*			trans	43.2	138.8	145.5	-82.8	0	0	0	0	124.4
87	A	32.4	Very low	27.3	Very low	90 Å²	90	128.6 Å²	128.6	74%	0.744	74%	0.736	S	S	*	*			trans	69.4	119.5	148.9	0	0	0	0	0	118
88	A	30	Very low	27.3	Very low	91 Å²	91	128.3 Å²	128.3	75%	0.752	73%	0.734	S	S	*	*				68.7	140.5	52.7	0	0	0	0	0	111.9
89	P	35.1	Very low	27.2	Very low	106 Å²	106	125.1 Å²	125.1	69%	0.688	74%	0.736	S	S	*	*			cis	-140.4	155.1	39.7	35	-14.2	0	0	0	118.9
90	N	27.8	Very low	27	Very low	144 Å²	144	127.9 Å²	127.9	77%	0.77	73%	0.731	S	S	*	*			trans	59	171	135.8	-56.6	-8.9	0	0	0	121.3
91	V	33.5	Very low	26.9	Very low	107 Å²	107	124.1 Å²	124.1	65%	0.648	70%	0.699	S	S	*	*			trans	62.3	78.8	170.9	-160.1	0	0	0	0	112.7	F93	V91-F93 HydrophobicContact CG1-CD2 4.37Å
92	E	24.1	Very low	27.1	Very low	166 Å²	166	119.1 Å²	119.1	78%	0.776	67%	0.673	S	S	*	*				66.1	162.1	68.1	-54.2	176.9	105.9	0	0	113.7
93	F	26.8	Very low	26.8	Very low	162 Å²	162	117.9 Å²	117.9	71%	0.711	67%	0.668	S	S	*	*			trans	66.6	103.4	-163	-55.3	-77.5	0	0	0	113.3	V91 T95	V91-F93 HydrophobicContact CG1-CD2 4.37Å; F93-T95 HydrophobicContact CD1-CG2 3.87Å
94	L	23.6	Very low	27.1	Very low	167 Å²	167	117.4 Å²	117.4	87%	0.874	67%	0.665	S	S	*	*			cis	62.4	32.4	6	-104.9	-178.1	0	0	0	117.1
95	T	26.4	Very low	27.7	Very low	92 Å²	92	115.1 Å²	115.1	56%	0.564	65%	0.65	S	S	*	*			trans	-122.7	121.3	161.9	26	0	0	0	0	109.7	F93	F93-T95 HydrophobicContact CD1-CG2 3.87Å
96	Y	23.6	Very low	28	Very low	207 Å²	207	111.7 Å²	111.7	81%	0.812	63%	0.632	S	S	*	*				66.4	135.4	94.6	-89	-112.1	0	0	0	113.5
97	P	30.3	Very low	28.4	Very low	83 Å²	83	113.3 Å²	113.3	54%	0.539	62%	0.623	S	S	.	*			cis	-149.2	-167.2	-13.3	42.6	-22	0	0	0	116.5
98	H	25.8	Very low	28.2	Very low	157 Å²	157	114.9 Å²	114.9	73%	0.727	62%	0.619	S	S	*	*	S	Bend	trans	-2.1	161.6	136.5	-59.3	-73.1	0	0	0	121.3	M100	H98-M100 PolarHBondContact O-N 3.32Å
99	S	21.8	Very low	28.1	Very low	101 Å²	101	118.6 Å²	118.6	71%	0.706	62%	0.62	S	S	*	*			trans	-27.8	111	148.3	53.1	0	0	0	0	115.7
100	M	23.7	Very low	27.9	Very low	135 Å²	135	119.8 Å²	119.8	67%	0.665	62%	0.62	S	S	*	*			trans	-135.4	124.7	150	-76	-172.7	169.4	0	0	105.1	H98	H98-M100 PolarHBondContact O-N 3.32Å
101	A	24	Very low	27.8	Very low	24 Å²	24	117.7 Å²	117.7	20%	0.198	62%	0.617	C	S	.	*				-30.6	121.8	74.5	0	0	0	0	0	116.7	K1533 L1534	A101-K1533 HydrophobicContact CB-CB 4.26Å; A101-K1533 PolarHBondContact O-NZ 3.43Å; A101-L1534 HydrophobicContact CB-CB 4.23Å; A101-L1534 VanDerWaalsContact CB-N 3.34Å; A101-L1534 WeakPolarHBondContact CB-O 3.36Å
102	D	25.1	Very low	27.5	Very low	59 Å²	59	118.8 Å²	118.8	32%	0.316	62%	0.624	S	S	.	*				-169.6	114.3	122.1	-99.6	16.3	0	0	0	111	D1530 L1531 D1532 K1533	D102-D1530 WeakPolarHBondContact CA-OD2 3.42Å; D102-L1531 HydrophobicContact CB-CD1 3.53Å; D102-L1531 HydrophobicContact CB-CG 4.48Å; D102-L1531 VanDerWaalsContact OD1-CD1 3.25Å; D102-L1531 WeakPolarHBondContact OD1-CD1 3.43Å; D102-D1532 VanDerWaalsContact OD1-CB 3.24Å; D102-D1532 WeakPolarHBondContact OD1-CB 3.45Å; D102-K1533 IonicContact OD1-NZ 3.23Å; D102-K1533 PolarHBondContact OD1-NZ 3.03Å; D102-K1533 IonicContact OD2-NZ 2.69Å; D102-K1533 PolarHBondContact OD2-NZ 3.03Å
103	S	25.5	Very low	27.9	Very low	74 Å²	74	116.1 Å²	116.1	52%	0.517	62%	0.621	S	S	.	*			trans	64.7	158.3	157.3	77	0	0	0	0	117.4	D1530	S103-D1530 PolarHBondContact N-OD2 3.46Å
104	Q	30.7	Very low	27.9	Very low	170 Å²	170	115 Å²	115	79%	0.794	62%	0.621	S	S	*	*			cis	-126.5	153.6	10	-67.4	178.6	-25.7	0	0	112.6	T1528	Q104-T1528 WeakPolarHBondContact O-CG2 3.36Å
105	G	36	Very low	27.9	Very low	38 Å²	38	112 Å²	112	39%	0.392	61%	0.61	S	S	.	*			trans	10.2	149.1	157	0	0	0	0	0	122.3	S432 T1528	G105-S432 CarbonylContact C-O 3.6Å; G105-T1528 WeakPolarHBondContact CA-OG1 3.36Å; G105-T1528 PolarHBondContact N-OG1 2.88Å
106	N	34.6	Very low	27.8	Very low	67 Å²	67	111.2 Å²	111.2	36%	0.358	60%	0.601	S	S	.	*			cis	-173.7	120.2	-7.5	-136.8	-97.7	0	0	0	108.8	S432 S433 T1528	N106-S432 CarbonylContact C-O 3.49Å; N106-S432 PolarHBondContact N-O 3.03Å; N106-S432 CarbonylContact O-C 3.47Å; N106-S432 VanDerWaalsContact O-CB 3.3Å; N106-S432 WeakPolarHBondContact O-CB 3.29Å; N106-S433 WeakPolarHBondContact O-CB 3.49Å; N106-S433 PolarHBondContact O-N 3.12Å; N106-S433 PolarHBondContact O-OG 2.8Å; N106-T1528 WeakPolarHBondContact CA-OG1 3.46Å
107	R	35.4	Very low	28.1	Very low	140 Å²	140	107.5 Å²	107.5	53%	0.528	60%	0.601	S	S	.	*			trans	114.9	124.8	146.6	-62.7	148.1	-173.6	-168.3	-8.4	115.8	S432	R107-S432 VanDerWaalsContact O-CB 3.27Å; R107-S432 WeakPolarHBondContact O-CB 3.33Å; R107-S432 PolarHBondContact O-OG 3.21Å
108	D	27.8	Very low	28	Very low	123 Å²	123	106.5 Å²	106.5	66%	0.658	61%	0.605	S	S	*	*				61.1	130.6	60.6	-91.6	-24.2	0	0	0	113.1
109	E	29.8	Very low	28.1	Very low	168 Å²	168	107.9 Å²	107.9	79%	0.785	61%	0.609	S	S	*	*			trans	65	141.6	160.1	-62.9	-163.2	154.6	0	0	117.8
110	L	29.6	Very low	28.4	Very low	132 Å²	132	109 Å²	109	69%	0.691	61%	0.608	S	S	*	*			cis	-158	168.9	1.7	-120.9	166.2	0	0	0	111.1
111	S	25.9	Very low	28.7	Very low	99 Å²	99	108.1 Å²	108.1	69%	0.692	61%	0.606	S	S	*	*			trans	62.7	101.2	153.1	-59	0	0	0	0	121
112	T	27.6	Very low	28.9	Very low	130 Å²	130	110.8 Å²	110.8	80%	0.798	62%	0.623	S	S	*	*			trans	-68.3	162.4	130.8	55.1	0	0	0	0	110.7
113	P	32	Very low	29.1	Very low	110 Å²	110	112.3 Å²	112.3	71%	0.714	64%	0.638	S	S	*	*			cis	-127	-173.6	-42.3	39.9	-25.6	0	0	0	110.8
114	I	25.9	Very low	29.3	Very low	138 Å²	138	111.6 Å²	111.6	71%	0.708	64%	0.643	S	S	*	*			trans	150.9	105.6	153.9	-82.7	157.8	0	0	0	107.3	I116	I114-I116 HydrophobicContact CG2-CD1 4.33Å
115	T	24.3	Very low	29.2	Very low	106 Å²	106	111.7 Å²	111.7	65%	0.65	65%	0.647	S	S	*	*				69.4	144.3	89.9	-35.5	0	0	0	0	114.8
116	I	25.3	Very low	28.7	Very low	74 Å²	74	115.4 Å²	115.4	38%	0.379	67%	0.667	S	S	.	*			trans	117.5	103.6	155.2	-62.3	147.2	0	0	0	116.1	I114 H501 T502	I114-I116 HydrophobicContact CG2-CD1 4.33Å; I116-H501 VanDerWaalsContact CD1-CE1 3.44Å; I116-H501 WeakPolarHBondContact CD1-CE1 3.49Å; I116-H501 WeakPolarHBondContact CG2-NE2 3.49Å; I116-T502 HydrophobicContact CD1-CG2 4.29Å
117	T	28.9	Very low	28.4	Very low	130 Å²	130	115.8 Å²	115.8	80%	0.798	68%	0.679	S	S	*	*			trans	56.7	153.9	158.1	55.6	0	0	0	0	120
118	G	27.4	Very low	27.9	Very low	62 Å²	62	116.1 Å²	116.1	64%	0.639	69%	0.691	S	S	*	*			cis	132	144	-2.6	0	0	0	0	0	112.9
119	F	29.9	Very low	27.9	Very low	185 Å²	185	114.4 Å²	114.4	81%	0.811	69%	0.689	S	S	*	*			trans	79.7	104.5	-179.8	-64.8	-80.2	0	0	0	118.4
120	D	27.7	Very low	27.8	Very low	125 Å²	125	116.4 Å²	116.4	67%	0.668	69%	0.691	S	S	*	*				52.5	144.4	100	-58.8	21.5	0	0	0	119.8
121	N	28.5	Very low	27.7	Very low	117 Å²	117	116.5 Å²	116.5	63%	0.626	69%	0.691	S	S	*	*			cis	-164.6	-179.6	-11.4	-111.2	-37.5	0	0	0	110.2
122	S	28.1	Very low	28.1	Very low	79 Å²	79	116.6 Å²	116.6	55%	0.552	69%	0.692	S	S	*	*			trans	-34.9	154.1	167.2	55.1	0	0	0	0	116.4	H395 H396	S122-H395 CarbonylContact C-O 3.3Å; S122-H396 CarbonylContact O-C 3.59Å
123	S	30	Very low	28.1	Very low	92 Å²	92	116.7 Å²	116.7	64%	0.643	69%	0.688	S	S	*	*			cis	-156.1	-165.6	37.3	-37.4	0	0	0	0	111.8	H395	S123-H395 PolarHBondContact N-O 2.74Å
124	G	29.1	Very low	28.1	Very low	59 Å²	59	118.1 Å²	118.1	61%	0.608	69%	0.685	S	S	*	*			cis	160.4	171.4	-3.5	0	0	0	0	0	112.8
125	I	29.7	Very low	28.4	Very low	171 Å²	171	119.4 Å²	119.4	88%	0.877	69%	0.686	S	S	*	*			trans	71.3	130.7	177.4	-46.3	169.7	0	0	0	113.3
126	S	25.6	Very low	28.8	Very low	116 Å²	116	118.9 Å²	118.9	81%	0.811	69%	0.686	S	S	*	*			cis	107.8	154.7	15.3	-161.4	0	0	0	0	115.2
127	A	27.2	Very low	29	Very low	76 Å²	76	121.3 Å²	121.3	63%	0.628	70%	0.7	S	S	*	*			trans	83.9	105.3	170.9	0	0	0	0	0	121.3
128	D	26.8	Very low	29.1	Very low	146 Å²	146	122.9 Å²	122.9	78%	0.781	70%	0.702	S	S	*	*				83.2	91.9	113.7	-58.7	-9.1	0	0	0	125
129	S	26.7	Very low	29	Very low	88 Å²	88	124.6 Å²	124.6	62%	0.615	70%	0.704	S	S	*	*				91.7	151.2	101.2	80.1	0	0	0	0	123.7
130	Y	26.8	Very low	29	Very low	210 Å²	210	123.8 Å²	123.8	82%	0.824	70%	0.703	S	S	*	*			trans	66.8	155.7	153.8	-69.5	-55	0	0	0	118.9
131	L	28.8	Very low	29.1	Very low	133 Å²	133	126.1 Å²	126.1	70%	0.696	71%	0.71	S	S	*	*			cis	-156	172.5	8.7	-133	166.2	0	0	0	111.7
132	S	33.2	Very low	29.1	Very low	101 Å²	101	128.3 Å²	128.3	71%	0.706	72%	0.721	S	S	*	*			trans	84.6	122.7	164	-53.5	0	0	0	0	117
133	N	28.8	Very low	29.2	Very low	133 Å²	133	130.3 Å²	130.3	71%	0.711	73%	0.732	S	S	*	*			cis	70.1	148.1	28.2	-62.8	-16.5	0	0	0	114.3
134	Q	30.8	Very low	29	Very low	139 Å²	139	129 Å²	129	65%	0.65	73%	0.734	S	S	*	*			cis	-165.1	-164.6	13.2	-139.2	162.3	-2.4	0	0	112.7
135	F	33.1	Very low	28.9	Very low	165 Å²	165	135.2 Å²	135.2	72%	0.724	75%	0.746	S	S	*	*			trans	89.6	141.3	154.8	-57	-54.8	0	0	0	117.5
136	S	32	Very low	29.3	Very low	95 Å²	95	134.7 Å²	134.7	66%	0.664	75%	0.745	S	S	*	*			cis	-170.4	163	0.8	-102.8	0	0	0	0	109.1
137	D	30.1	Very low	29.6	Very low	126 Å²	126	134.4 Å²	134.4	67%	0.674	74%	0.74	S	S	*	*			cis	-173.4	-173.5	-20.1	-117.4	-55.6	0	0	0	110.9
138	I	30.1	Very low	29.4	Very low	162 Å²	162	139.3 Å²	139.3	83%	0.831	75%	0.748	S	S	*	*			trans	96.1	113.7	157.7	-48.1	-171.8	0	0	0	117.3
139	S	25.5	Very low	29.3	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	75%	0.748	S	S	*	*			trans	-110.1	170.4	175.1	37.9	0	0	0	0	111.5
140	Q	31.3	Very low	29.1	Very low	167 Å²	167	143.1 Å²	143.1	78%	0.78	75%	0.752	S	S	*	*				173.5	130.1	126.6	-94.4	171.3	30.6	0	0	116
141	Q	29	Very low	29.1	Very low	175 Å²	175	142.1 Å²	142.1	82%	0.818	75%	0.752	S	S	*	*			trans	53.9	136.3	134.3	-62.7	-178.1	-13.9	0	0	124.7
142	L	28.4	Very low	29.1	Very low	162 Å²	162	141.9 Å²	141.9	85%	0.848	75%	0.748	S	S	*	*			trans	-32.1	158	152.9	-70.4	156.9	0	0	0	115.5
143	P	31.4	Very low	28.9	Very low	121 Å²	121	144.7 Å²	144.7	79%	0.786	75%	0.75	S	S	*	*			cis	-153.7	173.6	42.3	43.3	-23	0	0	0	119.9
144	G	24.7	Very low	28.9	Very low	66 Å²	66	142.8 Å²	142.8	68%	0.68	75%	0.747	S	S	*	*			trans	82.1	115.1	131.9	0	0	0	0	0	121.5
145	H	27.5	Very low	28.7	Very low	188 Å²	188	142.9 Å²	142.9	87%	0.87	75%	0.752	S	S	*	*			trans	50.4	125.3	154.3	-78.9	-86.8	0	0	0	121.3	P147	H145-P147 WeakPolarHBondContact O-CD 3.1Å
146	N	37.4	Very low	28.4	Very low	160 Å²	160	142.2 Å²	142.2	86%	0.856	76%	0.755	S	S	*	*			trans	-53.5	139.4	158.7	-82	-17.7	0	0	0	112
147	P	31.5	Very low	28.3	Very low	110 Å²	110	142.9 Å²	142.9	71%	0.714	76%	0.757	S	S	*	*				-141.5	128.7	118.1	35.3	-21.5	0	0	0	115.3	H145	H145-P147 WeakPolarHBondContact O-CD 3.1Å
148	F	23.5	Very low	28.4	Very low	180 Å²	180	143.4 Å²	143.4	79%	0.789	76%	0.758	S	S	*	*				36.5	143.8	123.8	-87.1	-85.7	0	0	0	123.4
149	Y	24.8	Very low	28.4	Very low	196 Å²	196	141.3 Å²	141.3	77%	0.769	76%	0.755	S	S	*	*			trans	73.5	111.8	173.4	-64.8	-84.3	0	0	0	115.5
150	V	22.3	Very low	28.4	Very low	117 Å²	117	140.6 Å²	140.6	71%	0.709	74%	0.744	S	S	*	*			cis	91.2	109.1	49.2	169.2	0	0	0	0	112.9
151	F	27.3	Very low	29	Very low	189 Å²	189	135.3 Å²	135.3	83%	0.829	72%	0.724	S	S	*	*			trans	-152.4	129.7	148.1	-98.5	-91.2	0	0	0	104.8
152	E	27.6	Very low	28.9	Very low	128 Å²	128	131.7 Å²	131.7	60%	0.598	71%	0.714	S	S	*	*			cis	-152.2	161.7	-9.3	-123.9	-174.9	138.1	0	0	108.7
153	Q	29.7	Very low	29	Very low	161 Å²	161	128.8 Å²	128.8	75%	0.752	70%	0.695	S	S	*	*			trans	30	132.2	153.9	-52.7	173.4	36.9	0	0	120.5
154	S	28.4	Very low	29.4	Very low	93 Å²	93	126.2 Å²	126.2	65%	0.65	68%	0.679	S	S	*	*			cis	-178	146.1	-5.9	50	0	0	0	0	110.3
155	N	28.2	Very low	29.7	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	67%	0.674	S	S	*	*			trans	60.3	116.2	153.3	-57.8	-15.5	0	0	0	120.6
156	L	25.3	Very low	29.9	Very low	152 Å²	152	123.7 Å²	123.7	80%	0.796	66%	0.657	S	S	*	*				36.9	151	105	-71	162.7	0	0	0	120.4
157	P	29.7	Very low	29.5	Very low	108 Å²	108	122.8 Å²	122.8	70%	0.701	65%	0.648	S	S	*	*			cis	-136.2	171.7	9.3	41.5	-24.1	0	0	0	117.6
158	I	33.1	Very low	29.4	Very low	137 Å²	137	122.2 Å²	122.2	70%	0.703	65%	0.646	S	S	*	*			trans	-63.4	141.1	156.8	-67.4	151.2	0	0	0	109.4
159	P	30.3	Very low	29.7	Very low	118 Å²	118	118.6 Å²	118.6	77%	0.766	64%	0.643	S	S	*	*				-148.9	176.3	106.1	39.5	-21.5	0	0	0	116.8
160	N	25.7	Very low	29.9	Very low	85 Å²	85	117.1 Å²	117.1	46%	0.455	64%	0.643	S	S	.	*			trans	-143.4	170.6	-179.2	-141.5	32.2	0	0	0	104.3	M338	N160-M338 HydrophobicContact CB-CE 3.76Å; N160-M338 HydrophobicContact CB-CG 3.8Å; N160-M338 HydrophobicContact CB-SD 3.61Å; N160-M338 WeakPolarHBondContact ND2-CG 3.33Å
161	P	42.3	Very low	30.1	Very low	56 Å²	56	118.8 Å²	118.8	36%	0.364	64%	0.643	S	S	.	*			cis	-142.1	-133.7	-41.9	36.7	-13	0	0	0	110.5	I336 M337	P161-I336 WeakPolarHBondContact CG-O 3.48Å; P161-M337 HydrophobicContact CB-CB 4.28Å; P161-M337 VanDerWaalsContact CD-C 3.46Å; P161-M337 WeakPolarHBondContact CD-O 3.42Å; P161-M337 VanDerWaalsContact CG-CA 3.47Å; P161-M337 HydrophobicContact CG-CB 3.24Å; P161-M337 WeakPolarHBondContact CG-O 3.41Å
162	V	27.8	Very low	30	Very low	99 Å²	99	118.4 Å²	118.4	60%	0.6	64%	0.637	S	S	*	*			trans	72.6	133.5	173.2	164	0	0	0	0	114.6	M337	V162-M337 VanDerWaalsContact CG2-O 3.23Å; V162-M337 WeakPolarHBondContact CG2-O 3.42Å
163	H	29.8	Very low	29.8	Very low	101 Å²	101	119.2 Å²	119.2	47%	0.468	64%	0.641	S	S	.	*			cis	-155.4	-140.9	-12.1	-150.5	-53	0	0	0	110.1	D334 V335 I336	H163-D334 VanDerWaalsContact ND1-C 3.3Å; H163-V335 WeakPolarHBondContact CE1-CA 3.41Å; H163-V335 PolarHBondContact CE1-N 3.11Å; H163-V335 PolarHBondContact ND1-N 2.66Å; H163-V335 VanDerWaalsContact ND1-N 3.16Å; H163-I336 PolarHBondContact CD2-N 2.88Å; H163-I336 PolarHBondContact NE2-N 3.16Å
164	P	40	Very low	29.7	Very low	67 Å²	67	117.7 Å²	117.7	44%	0.435	63%	0.634	S	S	.	*			trans	-90.5	154.9	-138.6	40.9	-35.6	0	0	0	119.6	N333 D334	P164-N333 VanDerWaalsContact CB-O 3.28Å; P164-N333 WeakPolarHBondContact CB-O 3.31Å; P164-D334 WeakPolarHBondContact CA-O 3.35Å; P164-D334 WeakPolarHBondContact CB-O 3.27Å
165	H	30.8	Very low	29.6	Very low	126 Å²	126	120 Å²	120	58%	0.583	63%	0.634	S	S	*	*			trans	13.8	159.1	142.7	-71.1	-158	0	0	0	122.1	D332 N333	H165-D332 WeakPolarHBondContact CB-O 3.42Å; H165-N333 PolarHBondContact CD2-O 3.33Å; H165-N333 PolarHBondContact CE1-O 3.37Å; H165-N333 PolarHBondContact ND1-N 2.64Å; H165-N333 PolarHBondContact ND1-O 2.97Å; H165-N333 PolarHBondContact NE2-O 3.34Å
166	S	32.1	Very low	29.8	Very low	74 Å²	74	119.9 Å²	119.9	52%	0.517	63%	0.629	S	S	.	*			cis	-144	167.9	1.7	50.2	0	0	0	0	108.3
167	H	29.8	Very low	29.9	Very low	141 Å²	141	123 Å²	123	65%	0.653	63%	0.631	S	S	*	*			cis	-166.2	166	45.9	-104.6	-76.1	0	0	0	112.4
168	S	28.7	Very low	29.8	Very low	98 Å²	98	120.9 Å²	120.9	69%	0.685	63%	0.629	S	S	*	*			trans	61.3	108.5	146.2	67.6	0	0	0	0	123.5
169	S	29.2	Very low	29.6	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	64%	0.64	S	S	*	*				66.7	130.1	126.6	67.9	0	0	0	0	124.5
170	H	29.9	Very low	30.1	Very low	165 Å²	165	124.6 Å²	124.6	76%	0.764	64%	0.64	S	S	*	*			trans	72.2	105	145.8	-83.1	-59	0	0	0	123.1
171	H	26.3	Very low	30.4	Very low	153 Å²	153	129.1 Å²	129.1	71%	0.708	66%	0.659	S	S	*	*				71.1	138.5	124	-100.1	-25.8	0	0	0	123.3
172	Y	25.1	Very low	30	Very low	181 Å²	181	132.2 Å²	132.2	71%	0.71	68%	0.682	S	S	*	*			trans	70.8	98.3	155.7	-86.6	-90.2	0	0	0	121.1
173	Q	23.6	Very low	30.4	Very low	144 Å²	144	134.1 Å²	134.1	67%	0.673	69%	0.694	S	S	*	*				55.5	133.4	125	-78.5	-168.3	-83.9	0	0	123
174	H	27.4	Very low	30.7	Very low	130 Å²	130	136 Å²	136	60%	0.602	71%	0.707	S	S	*	*			trans	82.9	102.1	142.8	-84.1	-120.1	0	0	0	121.8
175	Q	27.4	Very low	30.5	Very low	140 Å²	140	139.2 Å²	139.2	65%	0.654	72%	0.717	S	S	*	*			trans	69.5	160.2	132.2	-57.2	172.2	-49.5	0	0	117.3
176	H	31	Very low	30.5	Very low	139 Å²	139	136.6 Å²	136.6	64%	0.644	71%	0.707	S	S	*	*			cis	-142.9	136.1	13	-110.5	-81.4	0	0	0	111.7
177	Y	27.3	Very low	30.8	Very low	216 Å²	216	140.7 Å²	140.7	85%	0.847	72%	0.717	S	S	*	*			trans	41.9	117.7	140	-74	-120	0	0	0	122
178	G	27.4	Very low	30.8	Very low	64 Å²	64	140.6 Å²	140.6	66%	0.66	72%	0.721	S	S	*	*				128.1	98.5	116.8	0	0	0	0	0	121.7
179	M	29.9	Very low	31.1	Very low	189 Å²	189	141.3 Å²	141.3	93%	0.931	73%	0.726	S	S	*	*			trans	69.7	82.9	149.5	-49.5	-119.1	-68.8	0	0	119.6
180	D	40.1	Very low	31.3	Very low	144 Å²	144	142.4 Å²	142.4	77%	0.77	73%	0.728	S	S	*	*			trans	-144.6	-169	177.1	-95.2	-53.2	0	0	0	116.8
181	Q	32	Very low	31.3	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	73%	0.726	S	S	*	*			trans	-125.6	164.9	-139.4	-56.3	160.4	54.9	0	0	117.3
182	S	34.8	Very low	31.4	Very low	121 Å²	121	139.5 Å²	139.5	85%	0.846	72%	0.724	S	S	*	*			trans	-162.7	171.3	175.8	62.5	0	0	0	0	116.6
183	T	37.1	Very low	31.5	Very low	139 Å²	139	138.1 Å²	138.1	85%	0.853	73%	0.729	S	S	*	*			trans	-156.6	-179.6	-176.9	50.6	0	0	0	0	115.1
184	D	34.3	Very low	31.7	Very low	140 Å²	140	138 Å²	138	75%	0.749	74%	0.738	S	S	*	*			trans	-129.3	164.7	-172.7	-49.8	-91.8	0	0	0	118.2
185	Q	36	Very low	31.9	Very low	135 Å²	135	138.9 Å²	138.9	63%	0.631	75%	0.745	S	S	*	*			trans	98.1	119.6	135.2	-91	170.8	75.2	0	0	127.1
186	L	32.3	Very low	31.8	Very low	71 Å²	71	137.3 Å²	137.3	37%	0.372	75%	0.747	S	S	.	*				83.3	129.3	127.2	-98.9	163.4	0	0	0	127.6	P200 I201	L186-P200 WeakPolarHBondContact CD2-O 3.09Å; L186-I201 HydrophobicContact CD1-CD1 4.24Å; L186-I201 HydrophobicContact CD2-CB 4.26Å
187	H	36.9	Very low	31.6	Very low	159 Å²	159	136.5 Å²	136.5	74%	0.736	75%	0.748	S	S	*	*			trans	92.6	156.3	147.6	-108.9	54.7	0	0	0	124.2
188	N	30.8	Very low	31.6	Very low	139 Å²	139	132.7 Å²	132.7	74%	0.743	74%	0.737	S	S	*	*			trans	-100.2	138.2	-158.6	-75.7	-36.1	0	0	0	118.5
189	S	33.5	Very low	31.9	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	74%	0.742	S	S	*	*			trans	-179.4	129.8	136.7	60	0	0	0	0	116.1
190	V	33.8	Very low	32	Very low	127 Å²	127	130.6 Å²	130.6	77%	0.77	72%	0.717	S	S	*	*			trans	42.9	119.1	144.8	-178.5	0	0	0	0	121
191	N	29.5	Very low	31.6	Very low	132 Å²	132	128 Å²	128	71%	0.706	70%	0.702	S	S	*	*			trans	38.4	130.8	147.9	-67.4	61.1	0	0	0	120.2
192	D	28.5	Very low	31.5	Very low	126 Å²	126	125.8 Å²	125.8	67%	0.674	70%	0.696	S	S	*	*			cis	-156.9	163.5	15	-83.4	-39.1	0	0	0	111.2
193	N	27.3	Very low	31.3	Very low	151 Å²	151	125.4 Å²	125.4	81%	0.807	69%	0.689	S	S	*	*			trans	70.3	128	162	-64.9	-32.1	0	0	0	120.3
194	V	28.5	Very low	31	Very low	143 Å²	143	125.6 Å²	125.6	87%	0.867	68%	0.683	S	S	*	*			trans	68.6	98.5	165.4	-169.6	0	0	0	0	117.2
195	I	32	Very low	31.1	Very low	148 Å²	148	124 Å²	124	76%	0.759	68%	0.68	S	S	*	*			trans	-36.5	143.1	159.7	-72.1	164.1	0	0	0	112.7
196	P	25.9	Very low	31	Very low	107 Å²	107	125.4 Å²	125.4	70%	0.695	69%	0.687	S	S	*	*			cis	-138.9	177.2	36.9	29.7	-6.1	0	0	0	119.3
197	N	25.3	Very low	30.8	Very low	122 Å²	122	125.8 Å²	125.8	65%	0.652	70%	0.695	S	S	*	*			trans	81.5	138	152.4	-82.6	25.3	0	0	0	123.5
198	E	27.4	Very low	30.5	Very low	135 Å²	135	124.9 Å²	124.9	63%	0.631	70%	0.696	S	S	*	*			trans	77.8	110.3	146.9	-72.7	164.8	-120.6	0	0	122.7
199	I	34	Very low	30.4	Very low	147 Å²	147	127.1 Å²	127.1	75%	0.754	70%	0.695	S	S	*	*			trans	-122.9	133.9	161.8	-66	168.7	0	0	0	107
200	P	31.6	Very low	30.2	Very low	63 Å²	63	127 Å²	127	41%	0.409	68%	0.684	S	S	.	*				-154.1	-179.7	129.2	37.4	-18.4	0	0	0	116.5	L186	L186-P200 WeakPolarHBondContact CD2-O 3.09Å
201	I	31.8	Very low	29.8	Very low	90 Å²	90	128.3 Å²	128.3	46%	0.462	69%	0.686	S	S	.	*			trans	80	98.3	164.5	-52.8	173.8	0	0	0	115	L186	L186-I201 HydrophobicContact CD1-CD1 4.24Å; L186-I201 HydrophobicContact CD2-CB 4.26Å
202	N	29.8	Very low	29.7	Very low	133 Å²	133	127 Å²	127	71%	0.711	69%	0.687	S	S	*	*				85.4	145.6	65.5	-71	-18.9	0	0	0	113.5
203	T	30.5	Very low	29.4	Very low	114 Å²	114	128 Å²	128	70%	0.699	69%	0.688	S	S	*	*			cis	-155.6	138.1	16.8	8.5	0	0	0	0	108.9
204	I	32.3	Very low	29.2	Very low	143 Å²	143	127.3 Å²	127.3	73%	0.733	68%	0.68	S	S	*	*				65	142.3	85.9	-62.8	179	0	0	0	113.8
205	P	35.8	Very low	29	Very low	105 Å²	105	127.6 Å²	127.6	68%	0.682	67%	0.672	S	S	*	*			cis	-119.6	-170.8	2.8	26.8	-2.8	0	0	0	113.1
206	H	32.5	Very low	28.6	Very low	166 Å²	166	126.2 Å²	126.2	77%	0.769	66%	0.662	S	S	*	*			cis	-149.9	145.1	18.8	-126.3	-67.8	0	0	0	112.5
207	S	30	Very low	28.6	Very low	78 Å²	78	126 Å²	126	55%	0.545	65%	0.65	S	S	.	*			trans	-1.6	152.8	151.9	57.2	0	0	0	0	121.3
208	D	30.2	Very low	28.6	Very low	141 Å²	141	127 Å²	127	75%	0.754	66%	0.656	S	S	*	*			cis	-179	171.7	-11.8	-90.4	-42.2	0	0	0	105.7
209	Y	29	Very low	28.8	Very low	185 Å²	185	129.6 Å²	129.6	73%	0.725	67%	0.668	S	S	*	*			cis	-149.1	150.1	-0.5	-139.4	-130.4	0	0	0	105.2
210	I	28.3	Very low	28.3	Very low	111 Å²	111	130.1 Å²	130.1	57%	0.569	67%	0.671	S	S	*	*				60.6	102.9	62.1	-66.3	175.3	0	0	0	111.9
211	L	26.2	Very low	27.9	Very low	155 Å²	155	135.1 Å²	135.1	81%	0.812	68%	0.683	S	S	*	*				68.7	151.7	82.9	-87.9	86.9	0	0	0	113.2
212	S	26.3	Very low	27.4	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	70%	0.699	S	S	*	*			cis	-148.8	164.1	23.7	-171.5	0	0	0	0	114.9
213	Q	23.1	Very low	27.2	Very low	147 Å²	147	133.3 Å²	133.3	69%	0.687	69%	0.689	S	S	*	*			trans	-52.7	150.5	156.8	-72	-125	61.6	0	0	115.9
214	Q	22.6	Very low	26.8	Very low	137 Å²	137	130.4 Å²	130.4	64%	0.64	67%	0.669	S	S	*	*			trans	64	143.9	133.6	-77	-178	-3.6	0	0	124.4
215	Q	24.5	Very low	26.3	Very low	149 Å²	149	131.2 Å²	131.2	70%	0.696	67%	0.667	S	S	*	*			trans	72.1	149.3	141.2	-77	175.2	20.4	0	0	119.7
216	Q	24.3	Very low	25.7	Very low	120 Å²	120	131.5 Å²	131.5	56%	0.561	67%	0.671	S	S	*	*			cis	-161.9	154.5	-24.8	-133.9	-177.3	50.2	0	0	111.4	N1618	Q216-N1618 PolarHBondContact OE1-ND2 2.97Å
217	K	24.7	Very low	25.2	Very low	102 Å²	102	131.8 Å²	131.8	44%	0.443	67%	0.673	S	S	.	*			trans	59.8	110.8	138.8	-171.1	177.3	-178	170.3	0	121.7	N1618	K217-N1618 PolarHBondContact NZ-OD1 3.13Å
218	N	26.2	Very low	24.9	Very low	144 Å²	144	132.9 Å²	132.9	77%	0.77	68%	0.681	S	S	*	*			trans	177.2	158.9	132.7	-86.4	-23.5	0	0	0	107.3
219	E	31.2	Very low	24.5	Very low	188 Å²	188	132.6 Å²	132.6	88%	0.879	68%	0.679	S	S	*	*			cis	-129.7	-151.5	18.4	-63.4	-175.4	118.8	0	0	113.7
220	L	24.2	Very low	24.2	Very low	158 Å²	158	133.1 Å²	133.1	83%	0.827	68%	0.681	S	S	*	*			trans	-98.2	156.5	-164	-81.7	81.2	0	0	0	116.4
221	Y	21.6	Very low	24	Very low	168 Å²	168	136.3 Å²	136.3	66%	0.659	69%	0.691	S	S	*	*			trans	-0.6	112.2	146.4	-89.3	-94.1	0	0	0	119.1	I1550 S1551	Y221-I1550 VanDerWaalsContact CE1-O 3.25Å; Y221-I1550 WeakPolarHBondContact CE1-O 3.49Å; Y221-S1551 PolarHBondContact OH-O 2.83Å
222	S	23.1	Very low	23.9	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	69%	0.691	S	S	*	*			trans	-167.4	124	134.6	-81.9	0	0	0	0	109.7
223	S	24	Very low	23.8	Very low	71 Å²	71	136.5 Å²	136.5	50%	0.497	69%	0.693	S	S	.	*			trans	140.1	0	-179.8	-74	0	0	0	0	112.8	Y1548	S223-Y1548 WeakPolarHBondContact O-CD1 3.39Å; S223-Y1548 WeakPolarHBondContact O-CD2 3.46Å; S223-Y1548 WeakPolarHBondContact O-CE1 3.23Å; S223-Y1548 WeakPolarHBondContact O-CE2 3.18Å
224	I	22.4	Very low	24.1	Very low	54 Å²	54	136.3 Å²	136.3	28%	0.277	70%	0.696	S	S	.	*				0	122.5	0	-75.8	-179.2	0	0	0	126.1	Q1547 Y1548 S1549	I224-Q1547 HydrophobicContact CB-CG 4.05Å; I224-Q1547 HydrophobicContact CG2-CB 4.47Å; I224-Q1547 HydrophobicContact CG2-CG 3.81Å; I224-Q1547 WeakPolarHBondContact O-CG 3.46Å; I224-Q1547 PolarHBondContact O-NE2 3.11Å; I224-Y1548 VanDerWaalsContact C-CZ 3.5Å; I224-Y1548 HydrophobicContact CB-CD1 4.14Å; I224-Y1548 HydrophobicContact CB-CD2 3.4Å; I224-Y1548 HydrophobicContact CB-CE2 4.02Å; I224-Y1548 HydrophobicContact CB-CG 3.5Å; I224-Y1548 VanDerWaalsContact CB-CG 3.5Å; I224-Y1548 HydrophobicContact CG1-CD1 4.1Å; I224-Y1548 HydrophobicContact CG1-CG 3.98Å; I224-Y1548 HydrophobicContact CG2-CD2 4.43Å; I224-Y1548 PolarHBondContact N-OH 3.37Å; I224-Y1548 WeakPolarHBondContact O-CD2 3.32Å; I224-Y1548 WeakPolarHBondContact O-CE2 3.37Å; I224-S1549 VanDerWaalsContact CD1-OG 3.25Å; I224-S1549 WeakPolarHBondContact CD1-OG 3.26Å; I224-S1549 WeakPolarHBondContact CG1-OG 3.32Å
225	F	23	Very low	24.5	Very low	160 Å²	160	136.2 Å²	136.2	70%	0.702	70%	0.7	S	S	*	*			trans	67.5	141.5	-166.7	-54.4	-72.9	0	0	0	112	Q1547 Y1548	F225-Q1547 HydrophobicContact CD2-CG 4.38Å; F225-Y1548 PolarHBondContact O-OH 3.38Å
226	S	22.8	Very low	24.6	Very low	110 Å²	110	135 Å²	135	77%	0.769	70%	0.703	S	S	*	*			cis	-126.8	175.3	7.4	59.5	0	0	0	0	113.3
227	E	22.4	Very low	24.8	Very low	173 Å²	173	135.8 Å²	135.8	81%	0.808	72%	0.716	S	S	*	*			trans	-66.4	171.4	162.3	-60.5	162.2	136.3	0	0	111.3
228	S	22.6	Very low	24.8	Very low	101 Å²	101	138 Å²	138	71%	0.706	73%	0.733	S	S	*	*			trans	97	139.8	160.4	-41.6	0	0	0	0	118.8
229	N	22.6	Very low	25	Very low	134 Å²	134	137.6 Å²	137.6	72%	0.717	74%	0.736	S	S	*	*			trans	76.5	102	150	-62.5	-22.1	0	0	0	120.7
230	Y	22.4	Very low	24.7	Very low	197 Å²	197	135.8 Å²	135.8	77%	0.773	73%	0.731	S	S	*	*				73.1	143.9	118.6	-88.4	-77.5	0	0	0	122.3
231	F	24.4	Very low	25.1	Very low	177 Å²	177	132.6 Å²	132.6	78%	0.776	72%	0.72	S	S	*	*			trans	63.6	126.3	158.6	-83.7	-71.9	0	0	0	119.4	S233	F231-S233 PolarHBondContact O-N 3.24Å
232	L	23.8	Very low	25.3	Very low	155 Å²	155	131.6 Å²	131.6	81%	0.812	73%	0.726	S	S	*	*			trans	-56	133.2	148.5	-74.5	85.5	0	0	0	108.3
233	S	24.2	Very low	25.7	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	72%	0.719	S	S	*	*			trans	-138.5	139.5	169.2	58	0	0	0	0	110.3	F231	F231-S233 PolarHBondContact O-N 3.24Å
234	N	28.6	Very low	25.7	Very low	143 Å²	143	135.1 Å²	135.1	77%	0.765	73%	0.729	S	S	*	*			trans	-156.9	127.9	174	-84.3	-38.8	0	0	0	104.3
235	N	30.6	Very low	26.1	Very low	136 Å²	136	139.8 Å²	139.8	73%	0.727	75%	0.749	S	S	*	*			cis	-148	165.1	-0.2	-96	-46.7	0	0	0	112.3
236	T	26.7	Very low	26.5	Very low	122 Å²	122	138 Å²	138	75%	0.748	75%	0.748	S	S	*	*			trans	-34.2	160.7	167.4	56.4	0	0	0	0	117
237	V	29.4	Very low	26.5	Very low	137 Å²	137	139.9 Å²	139.9	83%	0.83	75%	0.748	S	S	*	*			cis	-151.2	159.2	45.1	177	0	0	0	0	112.2
238	N	25.3	Very low	26.8	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	74%	0.74	S	S	*	*			trans	-108	149.8	-175.2	-77.8	-45.4	0	0	0	116.4
239	T	28.9	Very low	26.8	Very low	135 Å²	135	137.4 Å²	137.4	83%	0.828	73%	0.734	S	S	*	*			trans	-179.6	154.8	144.7	29.2	0	0	0	0	108.5
240	L	25.9	Very low	26.9	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	72%	0.716	S	S	*	*			cis	178.6	174.1	-29.4	-134.3	79	0	0	0	106.4
241	P	32.2	Very low	27	Very low	91 Å²	91	132.1 Å²	132.1	59%	0.591	71%	0.711	S	S	*	*			cis	-120.1	-173.1	-39.9	39.6	-25.2	0	0	0	113.3
242	N	26.8	Very low	26.9	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	71%	0.71	S	S	*	*			trans	72.7	148.3	153.3	-67.6	-17.7	0	0	0	119.4
243	V	30.2	Very low	26.8	Very low	107 Å²	107	128.8 Å²	128.8	65%	0.648	71%	0.705	S	S	*	*			cis	-149.8	160.7	1	102.8	0	0	0	0	112.9
244	Q	25.1	Very low	26.7	Very low	152 Å²	152	129.5 Å²	129.5	71%	0.71	70%	0.704	S	S	*	*			trans	-4	142.5	165.2	-62.3	151.6	-56.9	0	0	118.8
245	Q	29.1	Very low	26.5	Very low	151 Å²	151	129.6 Å²	129.6	71%	0.706	70%	0.703	S	S	*	*			cis	-160.8	-167.4	25	-128.4	167.3	102.7	0	0	108.3
246	N	31.9	Very low	26.2	Very low	124 Å²	124	133.6 Å²	133.6	66%	0.663	71%	0.708	S	S	*	*			cis	-157.8	-171	11.6	-143.2	-27	0	0	0	113
247	L	23.4	Very low	26.1	Very low	149 Å²	149	133.8 Å²	133.8	78%	0.78	70%	0.704	S	S	*	*			trans	-124	-178.8	176.7	-83.7	84.3	0	0	0	111.5
248	P	28	Very low	25.8	Very low	99 Å²	99	135.5 Å²	135.5	64%	0.643	71%	0.709	S	S	*	*			cis	-132	174.7	-7.1	21.7	3.7	0	0	0	116.6
249	E	23.8	Very low	25.9	Very low	122 Å²	122	136.4 Å²	136.4	57%	0.57	71%	0.708	S	S	*	*			trans	32.8	143.4	140.3	-54.6	174.8	118.8	0	0	121.4	T420 S421 S422	E249-T420 WeakPolarHBondContact CB-O 3.35Å; E249-S421 VanDerWaalsContact CD-O 3.3Å; E249-S421 VanDerWaalsContact OE2-C 3.26Å; E249-S422 PolarHBondContact OE1-N 3.45Å; E249-S422 PolarHBondContact OE2-N 3.5Å
250	S	23.9	Very low	25.7	Very low	48 Å²	48	136.7 Å²	136.7	34%	0.336	70%	0.704	S	S	.	*			cis	-164.1	161.3	31.3	75.6	0	0	0	0	116.6	A419 T420	S250-A419 PolarHBondContact OG-O 3.31Å; S250-T420 WeakPolarHBondContact CB-O 3.19Å; S250-T420 WeakPolarHBondContact OG-CB 3.44Å; S250-T420 PolarHBondContact OG-N 3.27Å; S250-T420 VanDerWaalsContact OG-N 3.15Å; S250-T420 PolarHBondContact OG-OG1 3.14Å; S250-T420 VanDerWaalsContact OG-OG1 3.09Å
251	Y	23.8	Very low	25.7	Very low	173 Å²	173	138.1 Å²	138.1	68%	0.678	71%	0.707	S	S	*	*			trans	59.2	94.3	156.7	-72.3	-75.8	0	0	0	123.5
252	Q	23.4	Very low	25.4	Very low	163 Å²	163	139.5 Å²	139.5	76%	0.762	72%	0.718	S	S	*	*				98.9	132.8	107.6	-146.7	163.7	22.2	0	0	122.6
253	S	21.8	Very low	25.3	Very low	99 Å²	99	140.6 Å²	140.6	69%	0.692	72%	0.719	S	S	*	*			trans	78.1	119	150.3	43.3	0	0	0	0	123
254	V	22.6	Very low	25.1	Very low	122 Å²	122	142 Å²	142	74%	0.739	72%	0.722	S	S	*	*			trans	80.4	98.7	133.6	177.6	0	0	0	0	118.5
255	I	23	Very low	25.1	Very low	145 Å²	145	142.5 Å²	142.5	74%	0.744	72%	0.724	S	S	*	*			trans	56.8	117.6	144.7	-43.3	166.4	0	0	0	116.8
256	W	24.4	Very low	25	Very low	220 Å²	220	141.5 Å²	141.5	83%	0.833	72%	0.723	S	S	*	*				-168.6	146	116	-110	53.3	0	0	0	111.3
257	L	25.6	Very low	24.6	Very low	125 Å²	125	143.1 Å²	143.1	65%	0.654	73%	0.726	S	S	*	*			trans	17	106.9	161.9	-55.3	176.1	0	0	0	118.3	Q259	L257-Q259 PolarHBondContact O-N 2.99Å
258	N	23.1	Very low	24.7	Very low	174 Å²	174	141.2 Å²	141.2	93%	0.93	72%	0.717	S	S	*	*			trans	-70	112.3	143.1	-88.9	4	0	0	0	107.5
259	Q	25.9	Very low	24.6	Very low	168 Å²	168	143.3 Å²	143.3	79%	0.785	72%	0.718	S	S	*	*			trans	-73.5	170.8	153.9	-70.5	-173.8	-96.7	0	0	109.8	L257	L257-Q259 PolarHBondContact O-N 2.99Å
260	D	25.5	Very low	24.7	Very low	141 Å²	141	144 Å²	144	75%	0.754	73%	0.725	S	S	*	*	S	Bend	trans	-58.9	146.7	-172.2	-58.9	-86.4	0	0	0	115.7
261	H	26.2	Very low	25	Very low	180 Å²	180	149.4 Å²	149.4	83%	0.833	75%	0.745	S	S	*	*			trans	31.4	109	145.4	-70.2	-87.8	0	0	0	119.1
262	S	25.1	Very low	25.1	Very low	120 Å²	120	151.3 Å²	151.3	84%	0.839	75%	0.752	S	S	*	*			trans	-149.6	123.6	130.5	51	0	0	0	0	113
263	Q	25.4	Very low	25.2	Very low	170 Å²	170	149.2 Å²	149.2	79%	0.794	75%	0.75	S	S	*	*			trans	-139.3	134.6	141.6	-91.9	-156.4	-17.9	0	0	108.7
264	I	27.2	Very low	25.3	Very low	138 Å²	138	150.3 Å²	150.3	71%	0.708	76%	0.758	S	S	*	*			trans	49.6	87.6	141.5	-50.6	169.4	0	0	0	113.9
265	Q	24.4	Very low	25.5	Very low	161 Å²	161	152.1 Å²	152.1	75%	0.752	76%	0.764	S	S	*	*				68.4	131.3	55.1	-149	-154.7	-8.3	0	0	113.9
266	L	26.7	Very low	25.7	Very low	131 Å²	131	147.9 Å²	147.9	69%	0.686	76%	0.756	S	S	*	*			trans	80.6	116.5	168.2	-56.7	177.4	0	0	0	118.5
267	Q	23.7	Very low	25.7	Very low	157 Å²	157	144.9 Å²	144.9	73%	0.734	75%	0.754	S	S	*	*				41.3	140.1	114	-102.7	76.1	9.5	0	0	120.1
268	D	26.4	Very low	25.7	Very low	110 Å²	110	147.4 Å²	147.4	59%	0.588	77%	0.765	S	S	*	*			cis	-161.9	167.1	15.3	-151.4	-4.3	0	0	0	114.2
269	Q	25.2	Very low	25.7	Very low	143 Å²	143	144 Å²	144	67%	0.668	75%	0.751	S	S	*	*			trans	61.1	121.9	142.2	-96	176.5	84.6	0	0	122.9
270	L	26.5	Very low	25.9	Very low	135 Å²	135	142.1 Å²	142.1	71%	0.707	75%	0.751	S	S	*	*				121.9	142	128	-73.3	156.5	0	0	0	120.5
271	H	28.9	Very low	25.9	Very low	163 Å²	163	143.4 Å²	143.4	76%	0.755	75%	0.752	S	S	*	*			trans	63.7	73.2	162.8	-70.7	-65.2	0	0	0	121.5
272	Y	25.7	Very low	26	Very low	213 Å²	213	142.4 Å²	142.4	84%	0.835	75%	0.753	S	S	*	*				30.5	142.6	117.8	-90.2	-79.8	0	0	0	123
273	T	26.5	Very low	26.2	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	75%	0.745	S	S	*	*			trans	66.4	110.4	155.6	50	0	0	0	0	119.7
274	S	23.2	Very low	26.3	Very low	122 Å²	122	142.5 Å²	142.5	85%	0.853	74%	0.744	S	S	*	*			trans	-100	126.2	135.3	60.1	0	0	0	0	108.5
275	D	27.2	Very low	26.5	Very low	161 Å²	161	141.9 Å²	141.9	86%	0.861	74%	0.743	S	S	*	*			trans	-129.9	152.2	175	-141.3	-19.5	0	0	0	110
276	G	27.3	Very low	26.6	Very low	56 Å²	56	144.3 Å²	144.3	58%	0.577	75%	0.746	S	S	*	*			trans	-126.6	155.6	-155.9	0	0	0	0	0	117.4
277	I	24.4	Very low	26.7	Very low	156 Å²	156	142.4 Å²	142.4	80%	0.8	74%	0.744	S	S	*	*			trans	60.8	118.9	148.5	-53.2	171.9	0	0	0	117.6	T279	I277-T279 HydrophobicContact CG2-CG2 4.39Å
278	M	24.6	Very low	26.9	Very low	179 Å²	179	140.3 Å²	140.3	88%	0.882	74%	0.742	S	S	*	*			trans	-141.4	167	135.8	-109.5	-57.9	162.4	0	0	111.6
279	T	24.7	Very low	26.7	Very low	102 Å²	102	143.2 Å²	143.2	63%	0.626	76%	0.755	S	S	*	*			trans	-117.4	154.5	-156.7	59.8	0	0	0	0	113.8	I277	I277-T279 HydrophobicContact CG2-CG2 4.39Å
280	T	28.9	Very low	26.8	Very low	129 Å²	129	143 Å²	143	79%	0.791	76%	0.758	S	S	*	*				-179.8	126.3	119.9	25	0	0	0	0	115.2
281	Q	26.5	Very low	26.8	Very low	167 Å²	167	141 Å²	141	78%	0.78	76%	0.755	S	S	*	*			trans	18.5	128.9	147.2	-60.8	177.7	-20.3	0	0	122.3
282	N	28.3	Very low	26.8	Very low	159 Å²	159	140.4 Å²	140.4	85%	0.85	76%	0.757	S	S	*	*				-157	168	111.9	-121.9	-52.6	0	0	0	114.1
283	H	27.7	Very low	26.9	Very low	147 Å²	147	132.6 Å²	132.6	68%	0.681	73%	0.732	S	S	*	*			trans	-93.7	150.5	-168.6	-64.4	-101	0	0	0	114.9
284	N	29.1	Very low	27	Very low	145 Å²	145	131.7 Å²	131.7	78%	0.775	72%	0.723	S	S	*	*				174.7	160.5	100.8	-92.5	-51.3	0	0	0	116.3
285	N	30.3	Very low	27.2	Very low	126 Å²	126	128 Å²	128	67%	0.674	69%	0.693	S	S	*	*			trans	81.7	109.8	156.8	-64.2	-14.3	0	0	0	122.9
286	Y	27.6	Very low	27.3	Very low	211 Å²	211	123 Å²	123	83%	0.827	67%	0.667	S	S	*	*			trans	41.6	143	131.1	-62.2	-89.1	0	0	0	122.9
287	S	28.1	Very low	27.3	Very low	91 Å²	91	125 Å²	125	64%	0.636	66%	0.664	S	S	*	*			cis	-174.1	131.9	-17.5	49	0	0	0	0	115
288	V	27.6	Very low	27.5	Very low	113 Å²	113	124.8 Å²	124.8	69%	0.685	66%	0.663	S	S	*	*				52.2	129.1	124	-175.9	0	0	0	0	121.1	I290	V288-I290 HydrophobicContact CG1-CB 4.04Å; V288-I290 HydrophobicContact CG1-CD1 4.15Å; V288-I290 HydrophobicContact CG1-CG1 3.89Å
289	I	22.8	Very low	27.4	Very low	171 Å²	171	125.7 Å²	125.7	88%	0.877	66%	0.662	S	S	*	*				-115.4	131.7	128.4	-67.1	-178.2	0	0	0	108.8
290	I	27.7	Very low	27.5	Very low	139 Å²	139	125.1 Å²	125.1	71%	0.713	67%	0.667	S	S	*	*			trans	-131	138.6	165	-78.8	169.2	0	0	0	106.4	V288	V288-I290 HydrophobicContact CG1-CB 4.04Å; V288-I290 HydrophobicContact CG1-CD1 4.15Å; V288-I290 HydrophobicContact CG1-CG1 3.89Å
291	S	25.5	Very low	27.3	Very low	93 Å²	93	125.6 Å²	125.6	65%	0.65	67%	0.665	S	S	*	*			trans	-73.9	122.8	173.4	56.3	0	0	0	0	111.7
292	N	29.9	Very low	27.2	Very low	150 Å²	150	124.1 Å²	124.1	80%	0.802	66%	0.662	S	S	*	*			trans	-150.3	156.3	145.9	-148.9	-5.1	0	0	0	110.4
293	V	26.6	Very low	27.3	Very low	50 Å²	50	122.9 Å²	122.9	30%	0.303	66%	0.655	S	S	.	*			trans	-118.2	137.3	-157.9	-155.7	0	0	0	0	112.1	N1267 N1268	V293-N1267 WeakPolarHBondContact CG1-OD1 3.33Å; V293-N1267 PolarHBondContact O-ND2 2.7Å; V293-N1268 WeakPolarHBondContact CB-OD1 3.33Å; V293-N1268 WeakPolarHBondContact CG2-OD1 3.28Å
294	N	28.1	Very low	27.1	Very low	99 Å²	99	122.1 Å²	122.1	53%	0.529	65%	0.651	S	S	.	*			trans	-167.9	127	151.1	-108.1	29.1	0	0	0	108.2	N1266 N1267	N294-N1266 VanDerWaalsContact OD1-CG 3.32Å; N294-N1266 PolarHBondContact OD1-ND2 3.29Å; N294-N1266 PolarHBondContact OD1-OD1 3.44Å; N294-N1267 WeakPolarHBondContact CA-OD1 3.33Å; N294-N1267 PolarHBondContact OD1-ND2 3.26Å
295	N	28.5	Very low	27.1	Very low	44 Å²	44	121.8 Å²	121.8	24%	0.235	65%	0.647	C	S	.	*			trans	100	80.5	142.9	-52.6	-7.8	0	0	0	123.7	N1263 N1264 N1265 N1266	N295-N1263 PolarHBondContact O-OD1 2.73Å; N295-N1263 VanDerWaalsContact O-OD1 3.13Å; N295-N1264 WeakPolarHBondContact CB-OD1 3.37Å; N295-N1264 VanDerWaalsContact ND2-CG 3.29Å; N295-N1264 PolarHBondContact ND2-OD1 3.2Å; N295-N1265 VanDerWaalsContact CG-N 3.26Å; N295-N1265 PolarHBondContact ND2-OD1 3.47Å; N295-N1265 WeakPolarHBondContact OD1-CA 3.4Å; N295-N1265 WeakPolarHBondContact OD1-CB 3.25Å; N295-N1265 PolarHBondContact OD1-N 3.11Å; N295-N1265 PolarHBondContact OD1-OD1 3.42Å; N295-N1266 PolarHBondContact OD1-OD1 3.2Å
296	N	29.2	Very low	27	Very low	57 Å²	57	121.5 Å²	121.5	31%	0.305	65%	0.645	S	S	.	*				66.1	133	113.4	-98.5	32.9	0	0	0	128.3	N1263 N1264 N1265 N1266	N296-N1263 WeakPolarHBondContact O-CA 3.3Å; N296-N1263 PolarHBondContact O-N 3.49Å; N296-N1263 VanDerWaalsContact O-N 3.15Å; N296-N1264 VanDerWaalsContact CB-C 3.4Å; N296-N1264 VanDerWaalsContact CG-C 3.41Å; N296-N1264 PolarHBondContact ND2-O 3.08Å; N296-N1265 VanDerWaalsContact CG-N 3.31Å; N296-N1265 PolarHBondContact ND2-N 2.87Å; N296-N1265 PolarHBondContact ND2-O 3.42Å; N296-N1265 PolarHBondContact OD1-O 2.91Å; N296-N1265 VanDerWaalsContact OD1-O 3.06Å; N296-N1266 PolarHBondContact OD1-N 3.43Å
297	N	27.9	Very low	27	Very low	97 Å²	97	116.6 Å²	116.6	52%	0.519	64%	0.637	S	S	.	*				68.3	121.7	124.1	-78.7	4.4	0	0	0	124.7
298	I	28.8	Very low	27	Very low	151 Å²	151	119 Å²	119	77%	0.774	64%	0.642	S	S	*	*				81.7	149.3	127.7	-65.3	171.8	0	0	0	118.9
299	K	22.8	Very low	26.8	Very low	199 Å²	199	120 Å²	120	87%	0.865	65%	0.648	S	S	*	*			trans	-81.7	133.5	-174	-52.5	170.9	-179.9	179.5	0	113.1
300	A	26.4	Very low	27.1	Very low	90 Å²	90	116.1 Å²	116.1	74%	0.744	63%	0.634	S	S	*	*			trans	-146.8	142.6	139	0	0	0	0	0	106.7
301	N	25	Very low	27.4	Very low	139 Å²	139	115.7 Å²	115.7	74%	0.743	64%	0.637	S	S	*	*			cis	76.1	89.3	35.8	-80.4	21.8	0	0	0	116.3
302	N	24.4	Very low	27.5	Very low	135 Å²	135	115.9 Å²	115.9	72%	0.722	64%	0.636	S	S	*	*			trans	72.3	160.8	135.9	-58.9	-1.6	0	0	0	120
303	I	30.5	Very low	27.1	Very low	134 Å²	134	113.8 Å²	113.8	69%	0.687	63%	0.629	S	S	*	*			trans	73.7	126.3	165.4	-63.7	154.1	0	0	0	113.6
304	E	23.5	Very low	26.9	Very low	131 Å²	131	119.3 Å²	119.3	61%	0.612	65%	0.651	S	S	*	*			cis	173.2	164.5	-15.9	-128.1	174.1	-167	0	0	105.6
305	M	27.5	Very low	26.8	Very low	137 Å²	137	119.2 Å²	119.2	68%	0.675	65%	0.654	S	S	*	*			trans	66.2	142.6	167.6	-58	-161.6	-159.4	0	0	116
306	N	28.5	Very low	26.5	Very low	120 Å²	120	124.6 Å²	124.6	64%	0.642	68%	0.68	S	S	*	*			cis	-153.5	159.2	-0.3	-123.5	-21.4	0	0	0	110.7
307	T	26.9	Very low	26.5	Very low	108 Å²	108	126.8 Å²	126.8	66%	0.663	70%	0.699	S	S	*	*			trans	27.2	117.1	142.7	-9.6	0	0	0	0	116.2
308	I	29.4	Very low	26.5	Very low	143 Å²	143	127.7 Å²	127.7	73%	0.733	71%	0.709	S	S	*	*				-168.3	134.2	77.5	-94	170.2	0	0	0	110.6	P310	I308-P310 VanDerWaalsContact CG2-CD 3.49Å; I308-P310 HydrophobicContact CG2-CG 4.32Å
309	V	23.8	Very low	26.7	Very low	133 Å²	133	125.8 Å²	125.8	81%	0.806	71%	0.706	S	S	*	*			trans	-96.6	136.5	151.5	166.1	0	0	0	0	106.1
310	P	28.8	Very low	27	Very low	90 Å²	90	124.3 Å²	124.3	58%	0.584	71%	0.706	S	S	*	*				-151.3	151.5	119.1	38	-18	0	0	0	114.5	I308 P312	I308-P310 VanDerWaalsContact CG2-CD 3.49Å; I308-P310 HydrophobicContact CG2-CG 4.32Å; P310-P312 HydrophobicContact CB-CG 4.3Å; P310-P312 HydrophobicContact CG-CG 4.38Å; P310-P312 WeakPolarHBondContact O-CD 3.47Å
311	V	33.2	Very low	27.3	Very low	130 Å²	130	124.2 Å²	124.2	79%	0.788	71%	0.705	S	S	*	*			trans	-84.8	113.2	149.3	170.5	0	0	0	0	107.5	V313	V311-V313 HydrophobicContact CG1-CG2 3.52Å
312	P	27.2	Very low	27.5	Very low	96 Å²	96	125.5 Å²	125.5	62%	0.623	71%	0.712	S	S	*	*			trans	-143.7	120.2	137.7	29.5	-9.3	0	0	0	109.3	P310	P310-P312 HydrophobicContact CB-CG 4.3Å; P310-P312 HydrophobicContact CG-CG 4.38Å; P310-P312 WeakPolarHBondContact O-CD 3.47Å
313	V	22	Very low	27.8	Very low	107 Å²	107	122.1 Å²	122.1	65%	0.648	71%	0.709	S	S	*	*				49.4	129.7	55	-152.6	0	0	0	0	111.8	V311	V311-V313 HydrophobicContact CG1-CG2 3.52Å
314	E	23.1	Very low	27.8	Very low	166 Å²	166	122 Å²	122	78%	0.776	72%	0.715	S	S	*	*			trans	76.4	139.5	169.9	-53.1	-146.7	-176.6	0	0	118.2
315	T	24.6	Very low	27.8	Very low	96 Å²	96	121.9 Å²	121.9	59%	0.589	72%	0.723	S	S	*	*			cis	-156.4	156.1	-14.7	15.4	0	0	0	0	111.1
316	M	23.8	Very low	27.7	Very low	157 Å²	157	122.2 Å²	122.2	77%	0.773	73%	0.726	S	S	*	*			trans	50.8	132.9	144.3	-62.8	175.9	-169.5	0	0	119.5
317	S	27.9	Very low	27.5	Very low	103 Å²	103	124.8 Å²	124.8	72%	0.72	73%	0.734	S	S	*	*				-160	112.5	67.2	-64.4	0	0	0	0	111.2
318	T	28.9	Very low	27.5	Very low	116 Å²	116	124.6 Å²	124.6	71%	0.712	73%	0.732	S	S	*	*				82	154.8	93.5	68.9	0	0	0	0	115
319	P	32.4	Very low	27.2	Very low	112 Å²	112	125.1 Å²	125.1	73%	0.727	73%	0.732	S	S	*	*			cis	-125.1	177.1	-0.4	38.8	-24.2	0	0	0	115.5
320	I	30.2	Very low	27.5	Very low	168 Å²	168	124.3 Å²	124.3	86%	0.862	72%	0.723	S	S	*	*			trans	95.4	126.8	171.2	-63.4	172.8	0	0	0	114.6
321	A	30.6	Very low	27.6	Very low	87 Å²	87	122.8 Å²	122.8	72%	0.719	71%	0.714	S	S	*	*			cis	-157.6	-139	-19.1	0	0	0	0	0	111.9
322	N	31.2	Very low	27.4	Very low	167 Å²	167	122.6 Å²	122.6	89%	0.893	71%	0.709	S	S	*	*			trans	-113.4	161.5	-171.4	-44	-25	0	0	0	109.9
323	G	30	Very low	27.5	Very low	64 Å²	64	122.3 Å²	122.3	66%	0.66	70%	0.702	S	S	*	*			cis	157.9	150.2	-7.7	0	0	0	0	0	114.2
324	T	29.1	Very low	27.8	Very low	132 Å²	132	121.2 Å²	121.2	81%	0.81	69%	0.693	S	S	*	*			trans	47.2	105.2	151.7	53.2	0	0	0	0	123.2
325	T	25.3	Very low	28.1	Very low	128 Å²	128	117 Å²	117	79%	0.785	68%	0.678	S	S	*	*				71.6	141.4	117.8	-24.2	0	0	0	0	122.9
326	I	25.5	Very low	28.3	Very low	143 Å²	143	117.2 Å²	117.2	73%	0.733	68%	0.675	S	S	*	*			trans	112.2	112.4	148.7	-59.3	-174.9	0	0	0	119.9
327	H	23.9	Very low	28.5	Very low	175 Å²	175	114.3 Å²	114.3	81%	0.81	66%	0.66	S	S	*	*			trans	62.9	130.8	147.7	-80.6	-50.7	0	0	0	126.7
328	V	25.6	Very low	28.5	Very low	103 Å²	103	114.7 Å²	114.7	62%	0.624	65%	0.652	S	S	*	*				99.9	113.8	123.8	156.7	0	0	0	0	123
329	Q	25	Very low	28.6	Very low	154 Å²	154	116.2 Å²	116.2	72%	0.72	65%	0.645	S	S	*	*			trans	56.2	152.5	139.7	-58.9	-177.5	-95.2	0	0	121.9
330	D	28.8	Very low	28.4	Very low	116 Å²	116	116.2 Å²	116.2	62%	0.62	65%	0.645	S	S	*	*			cis	-164.8	161.1	-17.5	-97	-16.5	0	0	0	111.9
331	S	30.5	Very low	28.3	Very low	58 Å²	58	114.5 Å²	114.5	41%	0.406	64%	0.636	S	S	.	*			trans	56.4	119.1	152.7	60.3	0	0	0	0	125.3
332	D	30.2	Very low	28.3	Very low	126 Å²	126	116.5 Å²	116.5	67%	0.674	64%	0.64	S	S	*	*				60.2	157.4	129.7	-50.3	-16.1	0	0	0	123.2	H165	H165-D332 WeakPolarHBondContact CB-O 3.42Å
333	N	29.1	Very low	28.3	Very low	90 Å²	90	112.2 Å²	112.2	48%	0.481	61%	0.614	S	S	.	*			cis	-171.4	168.2	-38.1	-151.6	37.7	0	0	0	109.1	P164 H165	P164-N333 VanDerWaalsContact CB-O 3.28Å; P164-N333 WeakPolarHBondContact CB-O 3.31Å; H165-N333 PolarHBondContact CD2-O 3.33Å; H165-N333 PolarHBondContact CE1-O 3.37Å; H165-N333 PolarHBondContact ND1-N 2.64Å; H165-N333 PolarHBondContact ND1-O 2.97Å; H165-N333 PolarHBondContact NE2-O 3.34Å
334	D	27.8	Very low	28.2	Very low	84 Å²	84	116.2 Å²	116.2	45%	0.449	62%	0.616	S	S	.	*			trans	60.3	150.1	155.4	-61.1	-34.1	0	0	0	123.1	H163 P164	H163-D334 VanDerWaalsContact ND1-C 3.3Å; P164-D334 WeakPolarHBondContact CA-O 3.35Å; P164-D334 WeakPolarHBondContact CB-O 3.27Å
335	V	29	Very low	28	Very low	78 Å²	78	114.2 Å²	114.2	47%	0.473	61%	0.607	S	S	.	*			cis	-158.9	129.1	-5	124.7	0	0	0	0	114.2	H163	H163-V335 WeakPolarHBondContact CE1-CA 3.41Å; H163-V335 PolarHBondContact CE1-N 3.11Å; H163-V335 PolarHBondContact ND1-N 2.66Å; H163-V335 VanDerWaalsContact ND1-N 3.16Å
336	I	29	Very low	28.2	Very low	101 Å²	101	116.5 Å²	116.5	52%	0.518	62%	0.615	S	S	.	*			trans	47.6	155	131	-42.4	170.3	0	0	0	124.1	P161 H163	P161-I336 WeakPolarHBondContact CG-O 3.48Å; H163-I336 PolarHBondContact CD2-N 2.88Å; H163-I336 PolarHBondContact NE2-N 3.16Å
337	M	28.9	Very low	28.2	Very low	95 Å²	95	117.1 Å²	117.1	47%	0.468	61%	0.614	S	S	.	*			trans	116.6	166	154	-79.5	-171	-83.6	0	0	114.8	P161 V162	P161-M337 HydrophobicContact CB-CB 4.28Å; P161-M337 VanDerWaalsContact CD-C 3.46Å; P161-M337 WeakPolarHBondContact CD-O 3.42Å; P161-M337 VanDerWaalsContact CG-CA 3.47Å; P161-M337 HydrophobicContact CG-CB 3.24Å; P161-M337 WeakPolarHBondContact CG-O 3.41Å; V162-M337 VanDerWaalsContact CG2-O 3.23Å; V162-M337 WeakPolarHBondContact CG2-O 3.42Å
338	M	27.8	Very low	28.2	Very low	111 Å²	111	117.4 Å²	117.4	55%	0.547	61%	0.613	S	S	.	*			cis	-102.4	156.3	-3.7	-85.2	-178.1	144.9	0	0	111.4	N160	N160-M338 HydrophobicContact CB-CE 3.76Å; N160-M338 HydrophobicContact CB-CG 3.8Å; N160-M338 HydrophobicContact CB-SD 3.61Å; N160-M338 WeakPolarHBondContact ND2-CG 3.33Å
339	R	30.3	Very low	28.2	Very low	149 Å²	149	121.1 Å²	121.1	56%	0.562	62%	0.624	S	S	*	*				58.7	136.5	62.3	-85.6	-169.7	-174.9	179.4	8.1	113.4	E343	R339-E343 IonicContact CZ-OE1 3.4Å; R339-E343 IonicContact NE-OE1 3.79Å; R339-E343 IonicContact NH1-OE1 2.62Å; R339-E343 PolarHBondContact NH1-OE1 2.88Å
340	P	29.4	Very low	28.4	Very low	112 Å²	112	120 Å²	120	73%	0.727	63%	0.628	S	S	*	*				-97	149.7	85.8	-21	35.4	0	0	0	114.8
341	L	26.6	Very low	28.2	Very low	131 Å²	131	119.4 Å²	119.4	69%	0.686	63%	0.633	S	S	*	*				44.1	142	120.9	-48.2	172.3	0	0	0	118.3	E343	L341-E343 WeakPolarHBondContact CD2-OE2 3.44Å
342	V	30.8	Very low	27.8	Very low	130 Å²	130	125 Å²	125	79%	0.788	65%	0.652	S	S	*	*			cis	-158.6	143.3	6.1	100.1	0	0	0	0	108.3
343	E	30.7	Very low	27.5	Very low	76 Å²	76	124.4 Å²	124.4	36%	0.355	66%	0.657	S	S	.	*			cis	-156.4	173.5	-40	-142	79.9	-101.4	0	0	109.4	R339 L341	R339-E343 IonicContact CZ-OE1 3.4Å; R339-E343 IonicContact NE-OE1 3.79Å; R339-E343 IonicContact NH1-OE1 2.62Å; R339-E343 PolarHBondContact NH1-OE1 2.88Å; L341-E343 WeakPolarHBondContact CD2-OE2 3.44Å
344	Q	29	Very low	27.5	Very low	148 Å²	148	128.3 Å²	128.3	69%	0.692	68%	0.677	S	S	*	*			trans	27	124.2	146.3	-73.5	155.5	5.5	0	0	121.2
345	S	24.3	Very low	27.3	Very low	91 Å²	91	130 Å²	130	64%	0.636	70%	0.695	S	S	*	*			cis	60.7	117	40.2	90.7	0	0	0	0	115.6
346	N	30.8	Very low	27.3	Very low	175 Å²	175	129.8 Å²	129.8	94%	0.936	71%	0.709	S	S	*	*			trans	-135.5	145.1	151.6	-97.8	-35	0	0	0	109.3
347	H	24.7	Very low	27.2	Very low	156 Å²	156	132.4 Å²	132.4	72%	0.722	72%	0.724	S	S	*	*			trans	-134.7	164.3	-160.6	-118.9	-65.7	0	0	0	110.4
348	F	23.5	Very low	27	Very low	181 Å²	181	132.8 Å²	132.8	79%	0.794	74%	0.736	S	S	*	*			trans	40.6	101	152.2	-75.8	-66.5	0	0	0	119.8
349	E	26.9	Very low	26.8	Very low	181 Å²	181	133 Å²	133	85%	0.846	74%	0.743	S	S	*	*				-146.9	147.7	128.7	-73.5	-163.3	160.4	0	0	107.2
350	T	28.9	Very low	26.8	Very low	131 Å²	131	133.5 Å²	133.5	80%	0.804	76%	0.755	S	S	*	*			cis	-147.5	166	-18.7	15.5	0	0	0	0	108
351	S	23.2	Very low	26.7	Very low	103 Å²	103	130.8 Å²	130.8	72%	0.72	74%	0.739	S	S	*	*			trans	-89.9	145.5	-174.6	54.3	0	0	0	0	114.7
352	E	23.6	Very low	26.8	Very low	176 Å²	176	129.7 Å²	129.7	82%	0.822	73%	0.734	S	S	*	*			trans	75.3	140.5	152.7	-71.3	-177.3	162.5	0	0	121.8
353	C	23.7	Very low	26.7	Very low	114 Å²	114	128.2 Å²	128.2	77%	0.77	72%	0.722	S	S	*	*			trans	54.3	106.5	151.9	-64.3	0	0	0	0	119.9
354	L	27.9	Very low	26.6	Very low	172 Å²	172	129.1 Å²	129.1	90%	0.901	73%	0.728	S	S	*	*				-160.1	151	105.4	-105.7	165.3	0	0	0	112.4
355	S	24.3	Very low	26.7	Very low	118 Å²	118	128.5 Å²	128.5	83%	0.825	73%	0.729	S	S	*	*			trans	-74.7	130.7	179	55	0	0	0	0	112.2
356	G	28.3	Very low	26.8	Very low	75 Å²	75	128.5 Å²	128.5	77%	0.773	72%	0.721	S	S	*	*			trans	-139	143.3	174.4	0	0	0	0	0	112
357	N	27.2	Very low	26.7	Very low	156 Å²	156	126.3 Å²	126.3	83%	0.834	71%	0.705	S	S	*	*			trans	-84.9	157.5	177.5	-63.1	-60.7	0	0	0	111.7
358	S	25.6	Very low	26.9	Very low	102 Å²	102	123 Å²	123	71%	0.713	69%	0.692	S	S	*	*			trans	47.7	121.9	140	64.1	0	0	0	0	121.1
359	V	24.2	Very low	27.3	Very low	115 Å²	115	123.7 Å²	123.7	70%	0.697	69%	0.691	S	S	*	*			trans	55.3	106.9	132.7	-174.2	0	0	0	0	118.2
360	I	29.6	Very low	27.5	Very low	160 Å²	160	117.5 Å²	117.5	82%	0.821	67%	0.667	S	S	*	*			trans	-176.9	111.5	140.5	-90.3	144.6	0	0	0	103.3
361	S	26.8	Very low	27.5	Very low	55 Å²	55	116.9 Å²	116.9	39%	0.385	67%	0.668	S	S	.	*				77.1	116	58.4	-60	0	0	0	0	114.1	T384	S361-T384 PolarHBondContact OG-OG1 3.15Å
362	N	29.1	Very low	27.7	Very low	108 Å²	108	118 Å²	118	58%	0.578	67%	0.666	S	S	*	*			trans	72.9	101.2	142.4	-62.8	31.6	0	0	0	120.6
363	D	27.9	Very low	28.3	Very low	99 Å²	99	116 Å²	116	53%	0.529	66%	0.661	S	S	.	*				70.3	135.2	99.5	-82.2	-16.2	0	0	0	124.9
364	L	29.1	Very low	28.6	Very low	95 Å²	95	114.1 Å²	114.1	50%	0.497	64%	0.643	S	S	.	*				80.4	151.7	129.3	-74.8	170	0	0	0	123.6
365	I	30.5	Very low	28.8	Very low	136 Å²	136	111.6 Å²	111.6	70%	0.697	64%	0.64	S	S	*	*			trans	77.9	147.9	141.4	-83.6	160	0	0	0	118.6
366	D	27.9	Very low	29	Very low	90 Å²	90	108.8 Å²	108.8	48%	0.481	63%	0.629	S	S	.	*			cis	173.6	174.3	-35.3	-106	11.9	0	0	0	107	T377	D366-T377 WeakPolarHBondContact OD2-CB 3.28Å; D366-T377 PolarHBondContact OD2-OG1 3.29Å
367	H	27.6	Very low	29	Very low	129 Å²	129	109.3 Å²	109.3	60%	0.597	62%	0.618	S	S	*	*			cis	-179.4	-161.6	-31.4	177.9	57.3	0	0	0	105.8
368	I	30.2	Very low	29	Very low	88 Å²	88	105.4 Å²	105.4	45%	0.451	60%	0.6	S	S	.	*			trans	68.8	153.5	164.3	-16.5	162.2	0	0	0	112.7	N374	I368-N374 HydrophobicContact CG2-CB 4.46Å; I368-N374 WeakPolarHBondContact CG2-ND2 3.31Å
369	Y	30.6	Very low	29.1	Very low	194 Å²	194	106.5 Å²	106.5	76%	0.761	60%	0.598	S	S	*	*			cis	-145.8	158.9	17.8	-91	-94	0	0	0	109
370	C	30.9	Very low	29.3	Very low	51 Å²	51	107.2 Å²	107.2	35%	0.345	60%	0.597	S	S	.	*			cis	-165.1	151.8	-16.7	-148.5	0	0	0	0	109.8	N372 N374	C370-N372 PolarHBondContact SG-N 2.76Å; C370-N372 VanDerWaalsContact SG-N 3.41Å; C370-N372 PolarHBondContact SG-OD1 3.19Å; C370-N372 VanDerWaalsContact SG-OD1 3.36Å; C370-N374 PolarHBondContact SG-ND2 3.4Å; C370-N374 VanDerWaalsContact SG-ND2 3.42Å
371	S	29.5	Very low	29.4	Very low	119 Å²	119	104.4 Å²	104.4	83%	0.832	59%	0.592	S	S	*	*	S	Bend	trans	-146.4	55.6	146	-90.6	0	0	0	0	110.2
372	N	28.2	Very low	29.7	Very low	125 Å²	125	106.7 Å²	106.7	67%	0.668	61%	0.608	S	S	*	*	S	Bend	trans	49.2	108.9	158.3	-57.2	-3.8	0	0	0	118.8	C370	C370-N372 PolarHBondContact SG-N 2.76Å; C370-N372 VanDerWaalsContact SG-N 3.41Å; C370-N372 PolarHBondContact SG-OD1 3.19Å; C370-N372 VanDerWaalsContact SG-OD1 3.36Å
373	N	34.7	Very low	29.7	Very low	136 Å²	136	109.5 Å²	109.5	73%	0.727	62%	0.618	S	S	*	*			cis	-146	125.5	-11.2	-66.7	-67.8	0	0	0	106.3
374	N	31.6	Very low	29.7	Very low	74 Å²	74	109 Å²	109	40%	0.396	62%	0.619	S	S	.	*			cis	87.6	73.1	45.6	-77.5	40.2	0	0	0	115.7	I368 C370	I368-N374 HydrophobicContact CG2-CB 4.46Å; I368-N374 WeakPolarHBondContact CG2-ND2 3.31Å; C370-N374 PolarHBondContact SG-ND2 3.4Å; C370-N374 VanDerWaalsContact SG-ND2 3.42Å
375	S	30.5	Very low	29.8	Very low	119 Å²	119	108.7 Å²	108.7	83%	0.832	63%	0.63	S	S	*	*			trans	-173.9	143.9	140.8	8.3	0	0	0	0	106.3
376	G	29.8	Very low	29.7	Very low	58 Å²	58	108.5 Å²	108.5	60%	0.598	63%	0.634	S	S	*	*			cis	104.1	125.5	16.2	0	0	0	0	0	110.1
377	T	27.9	Very low	29.7	Very low	86 Å²	86	110.1 Å²	110.1	53%	0.528	65%	0.647	S	S	.	*			cis	-157.8	-172	-2.1	-24.8	0	0	0	0	110.5	D366	D366-T377 WeakPolarHBondContact OD2-CB 3.28Å; D366-T377 PolarHBondContact OD2-OG1 3.29Å
378	T	27.8	Very low	29.7	Very low	75 Å²	75	108.7 Å²	108.7	46%	0.46	66%	0.658	S	S	.	*			trans	-40	150.8	-178.8	46.6	0	0	0	0	122.1
379	N	27.5	Very low	29.6	Very low	125 Å²	125	108.1 Å²	108.1	67%	0.668	67%	0.667	S	S	*	*			trans	70.8	130.3	133.6	-60.3	-3.4	0	0	0	124.8
380	N	28.7	Very low	29.5	Very low	129 Å²	129	105.8 Å²	105.8	69%	0.69	67%	0.667	S	S	*	*				33.1	114.3	128.7	-56.7	-1	0	0	0	124.6
381	S	30.6	Very low	29.4	Very low	101 Å²	101	109 Å²	109	71%	0.706	68%	0.681	S	S	*	*				61.5	99.8	129	66.6	0	0	0	0	124.4
382	S	32.4	Very low	29.4	Very low	104 Å²	104	109.5 Å²	109.5	73%	0.727	67%	0.674	S	S	*	*				73.6	133.5	125	61.8	0	0	0	0	125
383	E	30	Very low	29.5	Very low	166 Å²	166	110.7 Å²	110.7	78%	0.776	68%	0.676	S	S	*	*			trans	72.6	120.7	159.7	-65.2	-155.1	148.1	0	0	122.2
384	T	28.5	Very low	29.1	Very low	90 Å²	90	111.3 Å²	111.3	55%	0.552	67%	0.674	S	S	*	*				170.6	168.4	115.3	34.6	0	0	0	0	113.4	S361	S361-T384 PolarHBondContact OG-OG1 3.15Å
385	A	29.4	Very low	29.2	Very low	88 Å²	88	113.3 Å²	113.3	73%	0.727	68%	0.681	S	S	*	*			trans	66.2	126.5	160.2	0	0	0	0	0	119.4
386	V	29	Very low	29.3	Very low	131 Å²	131	114 Å²	114	79%	0.794	67%	0.671	S	S	*	*				74.2	117.7	58.8	170.5	0	0	0	0	112.4
387	T	27.5	Very low	29.3	Very low	124 Å²	124	116.9 Å²	116.9	76%	0.761	67%	0.668	S	S	*	*			cis	-162.4	154.5	-2.2	17.6	0	0	0	0	111.9
388	A	28.1	Very low	29.4	Very low	99 Å²	99	122.1 Å²	122.1	82%	0.818	68%	0.679	S	S	*	*			trans	67.2	149.7	151.7	0	0	0	0	0	119.6
389	A	27.8	Very low	29.3	Very low	77 Å²	77	124.4 Å²	124.4	64%	0.636	69%	0.689	S	S	*	*			cis	-169	159.7	-21.2	0	0	0	0	0	110
390	N	28.2	Very low	29.3	Very low	144 Å²	144	124.2 Å²	124.2	77%	0.77	69%	0.693	S	S	*	*			trans	67.8	152.5	164.5	-60.6	-13.6	0	0	0	115.9
391	N	29.8	Very low	29.3	Very low	119 Å²	119	124.2 Å²	124.2	64%	0.636	69%	0.692	S	S	*	*			cis	-164.1	149.1	-2.6	-114.7	-10.5	0	0	0	110.2
392	N	28.9	Very low	29.3	Very low	129 Å²	129	124.5 Å²	124.5	69%	0.69	69%	0.69	S	S	*	*			trans	65.4	165.3	152.1	-63.9	-28.4	0	0	0	117.9
393	H	30.4	Very low	29.1	Very low	151 Å²	151	126 Å²	126	70%	0.699	69%	0.689	S	S	*	*			cis	-158	-174.1	-8.9	-126.3	38.7	0	0	0	111.7
394	H	27.7	Very low	29.6	Very low	149 Å²	149	123.9 Å²	123.9	69%	0.69	69%	0.689	S	S	*	*			trans	-50.9	153.6	164.3	-56.6	-82.3	0	0	0	113.3
395	H	32.5	Very low	29.7	Very low	115 Å²	115	125.8 Å²	125.8	53%	0.532	70%	0.695	S	S	.	*				178.6	164.9	79	-100.7	-62.6	0	0	0	114.8	S122 S123	S122-H395 CarbonylContact C-O 3.3Å; S123-H395 PolarHBondContact N-O 2.74Å
396	H	33	Very low	29.7	Very low	135 Å²	135	128.9 Å²	128.9	63%	0.625	70%	0.695	S	S	*	*			trans	19.1	144.2	148.5	-64.7	-48.3	0	0	0	122.5	S122	S122-H396 CarbonylContact O-C 3.59Å
397	H	28.5	Very low	29.9	Very low	117 Å²	117	129.9 Å²	129.9	54%	0.542	69%	0.694	S	S	.	*			cis	114.3	135.9	29.8	-152.9	-60.9	0	0	0	109.8
398	Y	30.4	Very low	29.9	Very low	196 Å²	196	133.4 Å²	133.4	77%	0.769	70%	0.695	S	S	*	*			trans	69	157.4	-178.7	-56.7	-76.2	0	0	0	117.4
399	D	26.1	Very low	30.6	Very low	124 Å²	124	133 Å²	133	66%	0.663	68%	0.684	S	S	*	*			cis	160.7	138.2	-39	-114.8	-45.6	0	0	0	108.5
400	T	26.9	Very low	30.7	Very low	121 Å²	121	135.3 Å²	135.3	74%	0.742	69%	0.69	S	S	*	*			trans	65.2	159.7	165.1	73	0	0	0	0	117
401	N	29.1	Very low	30.9	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	69%	0.69	S	S	*	*			cis	-159	152.5	19.6	-140.1	-14.1	0	0	0	114.6
402	T	30.2	Very low	30.9	Very low	107 Å²	107	135.9 Å²	135.9	66%	0.656	69%	0.686	S	S	*	*			trans	50.4	126.1	152.3	47.7	0	0	0	0	121.8
403	I	29.3	Very low	31.2	Very low	136 Å²	136	136.2 Å²	136.2	70%	0.697	68%	0.684	S	S	*	*				87.5	125.5	53	-71.8	168.5	0	0	0	115	L405	I403-L405 HydrophobicContact CG2-CD2 4.41Å; I403-L405 HydrophobicContact CG2-CG 3.88Å
404	P	40.2	Very low	31.7	Very low	121 Å²	121	131.4 Å²	131.4	79%	0.786	67%	0.665	S	S	*	*				-129.8	126.9	118.2	21.6	-4	0	0	0	112.1
405	L	29.8	Very low	32	Very low	131 Å²	131	128 Å²	128	69%	0.686	65%	0.652	S	S	*	*				79.9	130.2	66.8	-71	172.3	0	0	0	113.9	I403	I403-L405 HydrophobicContact CG2-CD2 4.41Å; I403-L405 HydrophobicContact CG2-CG 3.88Å
406	Q	30.8	Very low	32.1	Very low	153 Å²	153	128.1 Å²	128.1	72%	0.715	65%	0.649	S	S	*	*			cis	-166.3	177.8	-12.5	-147.8	-178.6	16.1	0	0	112.1
407	I	31.9	Very low	31.9	Very low	152 Å²	152	125.5 Å²	125.5	78%	0.779	65%	0.646	S	S	*	*			trans	91.8	140.9	165.9	-75.3	166.7	0	0	0	116.2
408	Y	29	Very low	32.3	Very low	197 Å²	197	126.3 Å²	126.3	77%	0.773	66%	0.662	S	S	*	*			cis	178.7	164.6	-29.6	-140.9	-140.5	0	0	0	109.1
409	P	42.6	Very low	32.4	Very low	90 Å²	90	120.3 Å²	120.3	58%	0.584	65%	0.653	S	S	*	*			cis	-121.1	172.2	-33.6	30.6	-12.4	0	0	0	115
410	T	29.4	Very low	32.6	Very low	126 Å²	126	118.1 Å²	118.1	77%	0.773	64%	0.644	S	S	*	*			trans	95.6	147	176.7	69.2	0	0	0	0	117.6
411	I	31.6	Very low	32.7	Very low	151 Å²	151	115.3 Å²	115.3	77%	0.774	63%	0.629	S	S	*	*			cis	99.4	123.4	7.7	-60.5	167.4	0	0	0	114.1
412	F	30.7	Very low	32.8	Very low	124 Å²	124	113.2 Å²	113.2	54%	0.544	63%	0.625	S	S	.	*			cis	-146.8	-118.3	0.5	-150.6	-105.3	0	0	0	116.9	I831	F412-I831 HydrophobicContact CD1-CB 4.14Å; F412-I831 HydrophobicContact CD1-CG2 4.01Å; F412-I831 HydrophobicContact CE1-CB 3.74Å; F412-I831 HydrophobicContact CE1-CD1 4.21Å; F412-I831 HydrophobicContact CE1-CG2 3.91Å; F412-I831 HydrophobicContact CZ-CB 4.47Å; F412-I831 HydrophobicContact CZ-CD1 4.18Å; F412-I831 HydrophobicContact CZ-CG2 4.45Å
413	Q	35	Very low	32.8	Very low	137 Å²	137	113.2 Å²	113.2	64%	0.64	63%	0.629	S	S	*	*			trans	-151.7	-153.5	-165.8	-54.5	-173	-99.7	0	0	109.7
414	P	41.3	Very low	32.9	Very low	49 Å²	49	112.8 Å²	112.8	32%	0.318	63%	0.627	S	S	.	*			cis	-144.4	-171.8	-8.5	29.5	-2.7	0	0	0	118.2	T828 N830	P414-T828 CarbonylContact C-O 3.57Å; P414-T828 WeakPolarHBondContact CA-O 3.05Å; P414-T828 VanDerWaalsContact CB-O 3.29Å; P414-T828 WeakPolarHBondContact CB-O 3.27Å; P414-N830 VanDerWaalsContact CG-O 3.24Å; P414-N830 WeakPolarHBondContact CG-O 3.12Å
415	N	33.8	Very low	32.5	Very low	78 Å²	78	111.1 Å²	111.1	42%	0.417	62%	0.619	S	S	.	*			trans	103	147.3	154.2	-50.5	-64.6	0	0	0	117.4	N827 T828 S829 N830	N415-N827 CarbonylContact O-C 3.52Å; N415-T828 PolarHBondContact N-O 3.23Å; N415-S829 WeakPolarHBondContact OD1-CA 3.38Å; N415-N830 PolarHBondContact OD1-N 2.76Å; N415-N830 VanDerWaalsContact OD1-N 3.15Å
416	Y	33.8	Very low	32.7	Very low	117 Å²	117	108.7 Å²	108.7	46%	0.459	61%	0.612	S	S	.	*			cis	-152.7	-169.8	-13.3	-117.9	-52.6	0	0	0	111.5	N827 T828 S829 N830	Y416-N827 VanDerWaalsContact O-CA 3.27Å; Y416-N827 WeakPolarHBondContact O-CA 2.89Å; Y416-N827 PolarHBondContact O-N 2.6Å; Y416-N827 PolarHBondContact O-OD1 2.79Å; Y416-T828 VanDerWaalsContact N-N 3.16Å; Y416-S829 VanDerWaalsContact CZ-CB 3.44Å; Y416-N830 PolarHBondContact OH-OD1 2.83Å
417	S	29.4	Very low	32.8	Very low	81 Å²	81	106.7 Å²	106.7	57%	0.566	62%	0.616	S	S	*	*			trans	-54.2	-173.5	-169.7	-29.7	0	0	0	0	118.4
418	P	37.9	Very low	32.8	Very low	134 Å²	134	103.4 Å²	103.4	87%	0.87	61%	0.606	S	S	*	*			cis	-140.3	-130.9	17.5	43.2	-18.2	0	0	0	117.3
419	A	31.4	Very low	33.2	Very low	70 Å²	70	96.6 Å²	96.6	58%	0.579	59%	0.587	S	S	*	*			trans	-129.9	-163.2	-158.4	0	0	0	0	0	115.7	S250	S250-A419 PolarHBondContact OG-O 3.31Å
420	T	30	Very low	32.9	Very low	78 Å²	78	94 Å²	94	48%	0.479	57%	0.571	S	S	.	*			cis	-174.1	164.6	37.2	-17.9	0	0	0	0	115.1	E249 S250	E249-T420 WeakPolarHBondContact CB-O 3.35Å; S250-T420 WeakPolarHBondContact CB-O 3.19Å; S250-T420 WeakPolarHBondContact OG-CB 3.44Å; S250-T420 PolarHBondContact OG-N 3.27Å; S250-T420 VanDerWaalsContact OG-N 3.15Å; S250-T420 PolarHBondContact OG-OG1 3.14Å; S250-T420 VanDerWaalsContact OG-OG1 3.09Å
421	S	28.5	Very low	33.3	Very low	61 Å²	61	92 Å²	92	43%	0.427	56%	0.562	S	S	.	*			trans	9.3	158.7	147.1	66.1	0	0	0	0	124.2	E249	E249-S421 VanDerWaalsContact CD-O 3.3Å; E249-S421 VanDerWaalsContact OE2-C 3.26Å
422	S	32.8	Very low	33.3	Very low	85 Å²	85	86.8 Å²	86.8	59%	0.594	54%	0.538	S	S	*	.			cis	161.4	156.2	-11.6	65.1	0	0	0	0	113.2	E249	E249-S422 PolarHBondContact OE1-N 3.45Å; E249-S422 PolarHBondContact OE2-N 3.5Å
423	S	30.3	Very low	33.3	Very low	106 Å²	106	84.1 Å²	84.1	74%	0.741	54%	0.535	S	S	*	.			trans	-179.2	171.1	146.7	48.2	0	0	0	0	112.1
424	L	30.7	Very low	33	Very low	127 Å²	127	83 Å²	83	67%	0.665	54%	0.542	S	S	*	.			cis	-150.5	148	30.7	-84.3	165	0	0	0	114.9
425	S	31.8	Very low	32.6	Very low	87 Å²	87	85.5 Å²	85.5	61%	0.608	56%	0.561	S	S	*	*				42	150.5	128.3	86.8	0	0	0	0	123.5
426	S	33	Very low	32.4	Very low	79 Å²	79	91.7 Å²	91.7	55%	0.552	58%	0.584	S	S	*	*			cis	-174.8	141.5	-12.2	43.1	0	0	0	0	113.4
427	S	34.1	Very low	32.4	Very low	112 Å²	112	90.9 Å²	90.9	78%	0.783	60%	0.596	S	S	*	*			trans	58.3	141.7	152.6	75.1	0	0	0	0	119.6
428	S	32.5	Very low	32.6	Very low	83 Å²	83	91.4 Å²	91.4	58%	0.58	60%	0.599	S	S	*	*			cis	-165.2	-177.4	21.3	59.4	0	0	0	0	112.7	H1524	S428-H1524 WeakPolarHBondContact CA-NE2 3.4Å; S428-H1524 PolarHBondContact O-CE1 2.85Å
429	S	35.5	Very low	32.1	Very low	53 Å²	53	93.1 Å²	93.1	37%	0.371	60%	0.6	S	S	.	*			trans	88.3	134.4	147.2	99.3	0	0	0	0	120.6	H1524 H1525	S429-H1524 VanDerWaalsContact C-CB 3.48Å; S429-H1524 PolarHBondContact N-CD2 3.48Å; S429-H1524 PolarHBondContact N-CE1 2.82Å; S429-H1524 PolarHBondContact N-ND1 3.06Å; S429-H1524 PolarHBondContact N-NE2 3.08Å; S429-H1524 PolarHBondContact O-CE1 3.36Å; S429-H1524 PolarHBondContact O-ND1 3.42Å; S429-H1525 VanDerWaalsContact CA-CG 3.46Å; S429-H1525 WeakPolarHBondContact CB-CD2 3.4Å
430	S	37.8	Very low	32.2	Very low	35 Å²	35	94.4 Å²	94.4	25%	0.245	61%	0.605	C	S	.	*			trans	-101.3	168.1	-161.5	-69.5	0	0	0	0	116.2	H1524 H1525	S430-H1524 VanDerWaalsContact OG-CA 3.28Å; S430-H1524 WeakPolarHBondContact OG-CA 3.37Å; S430-H1524 WeakPolarHBondContact OG-CB 3.31Å; S430-H1525 VanDerWaalsContact CB-N 3.29Å; S430-H1525 WeakPolarHBondContact CB-O 3.42Å; S430-H1525 PolarHBondContact N-CD2 2.85Å; S430-H1525 VanDerWaalsContact N-N 3.1Å; S430-H1525 PolarHBondContact OG-N 2.71Å; S430-H1525 PolarHBondContact OG-O 3.27Å
431	C	37	Very low	32.3	Very low	86 Å²	86	95.8 Å²	95.8	58%	0.581	62%	0.618	S	S	*	*			trans	-37.6	176.4	142.7	66.3	0	0	0	0	115.9	K1526	C431-K1526 VanDerWaalsContact O-CB 3.31Å; C431-K1526 WeakPolarHBondContact O-CB 3.48Å
432	S	32.1	Very low	32.2	Very low	40 Å²	40	100.9 Å²	100.9	28%	0.28	64%	0.64	S	S	.	*			cis	-138.8	172.5	5.9	-35	0	0	0	0	108.8	G105 N106 R107	G105-S432 CarbonylContact C-O 3.6Å; N106-S432 CarbonylContact C-O 3.49Å; N106-S432 PolarHBondContact N-O 3.03Å; N106-S432 CarbonylContact O-C 3.47Å; N106-S432 VanDerWaalsContact O-CB 3.3Å; N106-S432 WeakPolarHBondContact O-CB 3.29Å; R107-S432 VanDerWaalsContact O-CB 3.27Å; R107-S432 WeakPolarHBondContact O-CB 3.33Å; R107-S432 PolarHBondContact O-OG 3.21Å
433	S	31.1	Very low	32.2	Very low	68 Å²	68	102.2 Å²	102.2	48%	0.476	65%	0.649	S	S	.	*			cis	-156.1	-164.8	-1.7	54.8	0	0	0	0	108.2	N106	N106-S433 WeakPolarHBondContact O-CB 3.49Å; N106-S433 PolarHBondContact O-N 3.12Å; N106-S433 PolarHBondContact O-OG 2.8Å
434	S	28.5	Very low	32.2	Very low	114 Å²	114	102.9 Å²	102.9	80%	0.797	65%	0.654	S	S	*	*			trans	-141.1	155	164.8	67.3	0	0	0	0	114
435	S	32.4	Very low	32	Very low	101 Å²	101	102.6 Å²	102.6	71%	0.706	66%	0.662	S	S	*	*			trans	-40.9	151.4	-171.4	-51.6	0	0	0	0	117.3
436	F	30.5	Very low	31.8	Very low	208 Å²	208	107.2 Å²	107.2	91%	0.912	68%	0.676	S	S	*	*				-134.5	177.5	66.3	-85.7	-88	0	0	0	116.4
437	S	33	Very low	31.7	Very low	101 Å²	101	111 Å²	111	71%	0.706	69%	0.689	S	S	*	*			trans	-86.2	173.7	-163.8	57.8	0	0	0	0	114.7
438	S	33.1	Very low	31.2	Very low	91 Å²	91	112.9 Å²	112.9	64%	0.636	69%	0.69	S	S	*	*			cis	-167.8	150.7	36.2	-35	0	0	0	0	115.1
439	L	28.8	Very low	31	Very low	170 Å²	170	113.7 Å²	113.7	89%	0.89	69%	0.694	S	S	*	*			trans	58	138.8	146.2	-62	166.2	0	0	0	119.6
440	S	32	Very low	30.6	Very low	97 Å²	97	117 Å²	117	68%	0.678	71%	0.712	S	S	*	*			cis	-172.3	152.2	12.2	43.9	0	0	0	0	113.6
441	S	32.6	Very low	30.1	Very low	108 Å²	108	122.2 Å²	122.2	76%	0.755	73%	0.733	S	S	*	*			trans	55.3	137.2	161.7	56.8	0	0	0	0	120.5
442	L	27.4	Very low	29.7	Very low	168 Å²	168	123.5 Å²	123.5	88%	0.88	74%	0.738	S	S	*	*			cis	116	139.8	12.9	-87.1	168.3	0	0	0	114.3
443	S	32.5	Very low	29.5	Very low	112 Å²	112	128.6 Å²	128.6	78%	0.783	76%	0.761	S	S	*	*			trans	101.9	147.3	170.6	77.5	0	0	0	0	117.5
444	S	30.3	Very low	29.2	Very low	121 Å²	121	130 Å²	130	85%	0.846	77%	0.771	S	S	*	*			cis	-165.6	165.7	-22.7	-96.1	0	0	0	0	110.6
445	S	26.4	Very low	29.4	Very low	120 Å²	120	132.1 Å²	132.1	84%	0.839	77%	0.772	S	S	*	*			trans	-89.1	169.3	-178.9	-53.6	0	0	0	0	115.7
446	M	28.2	Very low	29.4	Very low	184 Å²	184	133.3 Å²	133.3	91%	0.906	78%	0.775	S	S	*	*			trans	-20.1	132.8	-179.5	-61	-168.1	-65.1	0	0	120.8
447	I	29.6	Very low	29.5	Very low	159 Å²	159	129.4 Å²	129.4	82%	0.815	77%	0.77	S	S	*	*			trans	-139	125.3	147.5	-62.3	-176.3	0	0	0	105.8
448	L	25.1	Very low	29.3	Very low	152 Å²	152	128.5 Å²	128.5	80%	0.796	77%	0.769	S	S	*	*				86.3	139.7	60.1	-114.7	165	0	0	0	114.7
449	C	27.4	Very low	29.2	Very low	100 Å²	100	130.8 Å²	130.8	68%	0.676	78%	0.779	S	S	*	*			trans	71.4	127.4	-178.4	-48.8	0	0	0	0	115.5
450	T	26.1	Very low	29.2	Very low	121 Å²	121	127.1 Å²	127.1	74%	0.742	77%	0.774	S	S	*	*			cis	72.4	136.3	44.2	72.7	0	0	0	0	113.4
451	E	28.5	Very low	29.1	Very low	146 Å²	146	132.1 Å²	132.1	68%	0.682	78%	0.783	S	S	*	*			cis	-162.1	165.7	17.5	-141.2	171	-140.9	0	0	115.3
452	T	28.8	Very low	29	Very low	112 Å²	112	131.9 Å²	131.9	69%	0.687	78%	0.781	S	S	*	*			trans	72.3	135	153.1	60.7	0	0	0	0	125.6
453	L	28.5	Very low	29.3	Very low	147 Å²	147	128.7 Å²	128.7	77%	0.77	77%	0.773	S	S	*	*			trans	74.4	89.3	133.2	-71.8	167.6	0	0	0	124.2
454	S	23.8	Very low	29.1	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	77%	0.774	S	S	*	*				82.4	164.2	115.8	76.7	0	0	0	0	122.5
455	I	33	Very low	29.2	Very low	159 Å²	159	131 Å²	131	82%	0.815	77%	0.771	S	S	*	*			trans	85.2	103.1	170.7	-54.6	172.4	0	0	0	116.9
456	T	32.9	Very low	29.3	Very low	126 Å²	126	130.4 Å²	130.4	77%	0.773	76%	0.762	S	S	*	*			trans	-67.4	151	156.3	46	0	0	0	0	110.2
457	P	32.2	Very low	29.2	Very low	125 Å²	125	127 Å²	127	81%	0.812	75%	0.752	S	S	*	*				-151.5	179.4	61.7	41.6	-21.2	0	0	0	116.9
458	A	28.3	Very low	29.3	Very low	82 Å²	82	125.4 Å²	125.4	68%	0.678	75%	0.75	S	S	*	*			trans	-90.5	142.1	162.5	0	0	0	0	0	111
459	T	30.5	Very low	29.4	Very low	139 Å²	139	124.7 Å²	124.7	85%	0.853	75%	0.746	S	S	*	*				170.2	149.1	112.7	35.5	0	0	0	0	114.2
460	A	29.5	Very low	29.6	Very low	94 Å²	94	125.7 Å²	125.7	78%	0.777	75%	0.749	S	S	*	*			trans	56.2	123.6	146.4	0	0	0	0	0	121.9
461	K	29.8	Very low	29.7	Very low	201 Å²	201	126.8 Å²	126.8	87%	0.874	75%	0.75	S	S	*	*				-109.6	125.9	125.6	-78.8	-175	176.5	178.9	0	109.2
462	S	31	Very low	29.9	Very low	103 Å²	103	127.6 Å²	127.6	72%	0.72	76%	0.757	S	S	*	*			trans	21.6	141.9	142.5	56.5	0	0	0	0	121.3
463	S	32.1	Very low	29.8	Very low	101 Å²	101	127.4 Å²	127.4	71%	0.706	76%	0.76	S	S	*	*			cis	-179.8	150.5	-3.2	48.5	0	0	0	0	113.1
464	L	29.9	Very low	30.2	Very low	152 Å²	152	125.7 Å²	125.7	80%	0.796	76%	0.758	S	S	*	*			trans	55.9	126.1	142.3	-95.6	67.1	0	0	0	122.9
465	V	30.8	Very low	30.5	Very low	129 Å²	129	125.5 Å²	125.5	78%	0.782	76%	0.757	S	S	*	*				57.7	140.9	115.7	165.6	0	0	0	0	120
466	T	28.7	Very low	30.3	Very low	108 Å²	108	123.2 Å²	123.2	66%	0.663	76%	0.755	S	S	*	*			cis	-174	132.1	-11.9	-86.3	0	0	0	0	110.2
467	T	27.3	Very low	30.1	Very low	112 Å²	112	120.9 Å²	120.9	69%	0.687	74%	0.744	S	S	*	*			trans	49	156.3	149.3	-46	0	0	0	0	123.2
468	T	30.2	Very low	29.8	Very low	127 Å²	127	124 Å²	124	78%	0.779	74%	0.741	S	S	*	*			trans	86.7	153.1	169.5	72.2	0	0	0	0	117.7
469	I	27.5	Very low	29.8	Very low	137 Å²	137	128.8 Å²	128.8	70%	0.703	74%	0.743	S	S	*	*			cis	-177.3	163.3	-49.8	-101.7	162.1	0	0	0	107.3
470	T	31.7	Very low	29.7	Very low	121 Å²	121	127.6 Å²	127.6	74%	0.742	74%	0.735	S	S	*	*			trans	79.4	152.2	-179.4	74.9	0	0	0	0	117.1
471	N	28.8	Very low	29.5	Very low	144 Å²	144	128.8 Å²	128.8	77%	0.77	73%	0.729	S	S	*	*			cis	-175.5	173.3	-42.6	-102.5	-4.3	0	0	0	108.8
472	I	31.5	Very low	29.4	Very low	162 Å²	162	126.3 Å²	126.3	83%	0.831	72%	0.72	S	S	*	*			trans	114.7	107.5	155.8	-59.7	167.5	0	0	0	115.1
473	S	28.6	Very low	29.2	Very low	108 Å²	108	127 Å²	127	76%	0.755	72%	0.716	S	S	*	*			trans	-95.9	177.9	159	-42.3	0	0	0	0	109.8
474	P	36.7	Very low	29.2	Very low	112 Å²	112	132.8 Å²	132.8	73%	0.727	72%	0.724	S	S	*	*				-158.5	173	96.9	40.1	-20.7	0	0	0	118.1
475	S	29.8	Very low	29.2	Very low	94 Å²	94	134.8 Å²	134.8	66%	0.657	73%	0.726	S	S	*	*			trans	48.8	121	147.2	54.6	0	0	0	0	121
476	S	28.5	Very low	29	Very low	111 Å²	111	136 Å²	136	78%	0.776	73%	0.728	S	S	*	*				77.7	149.2	55.1	87.4	0	0	0	0	113.8
477	S	28.4	Very low	29.2	Very low	77 Å²	77	138.3 Å²	138.3	54%	0.538	74%	0.742	S	S	.	*			cis	-175.9	166	18.9	45.1	0	0	0	0	113.4
478	Y	26.7	Very low	29.4	Very low	190 Å²	190	136.3 Å²	136.3	75%	0.745	74%	0.743	S	S	*	*			trans	70.3	158	153.2	-58.8	-45.9	0	0	0	119.4
479	Y	27.6	Very low	29.4	Very low	183 Å²	183	138 Å²	138	72%	0.718	74%	0.744	S	S	*	*			cis	-164.9	153.6	-13.1	-119.7	-46.2	0	0	0	111.2
480	T	27.6	Very low	29.7	Very low	113 Å²	113	137.8 Å²	137.8	69%	0.693	74%	0.744	S	S	*	*			trans	61.3	159.9	151.8	56.2	0	0	0	0	119.7
481	N	26.6	Very low	29.5	Very low	120 Å²	120	141.6 Å²	141.6	64%	0.642	75%	0.746	S	S	*	*			cis	-158.2	165.9	-3.6	-125.2	-0.5	0	0	0	112.8
482	Q	27.9	Very low	29.6	Very low	148 Å²	148	141.6 Å²	141.6	69%	0.692	74%	0.741	S	S	*	*			trans	23.8	150.5	136.6	-65.4	-178.8	-86.8	0	0	121.7
483	D	27.1	Very low	29.6	Very low	118 Å²	118	141.5 Å²	141.5	63%	0.631	74%	0.737	S	S	*	*			cis	-166.2	-170.7	5.2	-129.3	-50.9	0	0	0	112.5
484	Y	30.6	Very low	29.8	Very low	222 Å²	222	143.4 Å²	143.4	87%	0.871	73%	0.734	S	S	*	*			trans	112.2	157	155.3	-69.3	-75.5	0	0	0	121.1
485	K	30.5	Very low	29.5	Very low	194 Å²	194	145 Å²	145	84%	0.843	73%	0.732	S	S	*	*			trans	-118.8	161.7	-155.5	-77.3	-176.6	175.9	-179.9	0	115.7
486	L	27.2	Very low	29.5	Very low	156 Å²	156	147.7 Å²	147.7	82%	0.817	74%	0.738	S	S	*	*			trans	-19.4	145.8	162.7	-60.8	78.4	0	0	0	118.5
487	T	33.1	Very low	29.4	Very low	156 Å²	156	152 Å²	152	96%	0.957	74%	0.743	S	S	*	*				-154.4	163.6	120.6	19.4	0	0	0	0	109.4
488	G	30.9	Very low	29.4	Very low	69 Å²	69	152.8 Å²	152.8	71%	0.711	75%	0.748	S	S	*	*			trans	-173.9	163.9	175	0	0	0	0	0	111.8
489	M	31	Very low	29.6	Very low	162 Å²	162	150.7 Å²	150.7	80%	0.798	75%	0.75	S	S	*	*			trans	-151.4	128.7	173.3	-99.4	-159.1	-67.4	0	0	114.5	L717	M489-L717 HydrophobicContact SD-CD1 4.24Å
490	N	32.2	Very low	29.5	Very low	134 Å²	134	148.3 Å²	148.3	72%	0.717	75%	0.75	S	S	*	*			trans	67.9	160.2	146.1	-75	-29.1	0	0	0	122.1
491	Y	28.8	Very low	29.6	Very low	200 Å²	200	149 Å²	149	78%	0.784	75%	0.745	S	S	*	*			trans	-138.6	132.2	-154.6	-106.5	-103.4	0	0	0	109.7
492	H	29.7	Very low	29.7	Very low	144 Å²	144	147 Å²	147	67%	0.667	74%	0.737	S	S	*	*			trans	167.9	145	141.2	-94.1	53.4	0	0	0	105.7	Q494	H492-Q494 PolarHBondContact NE2-NE2 2.68Å; H492-Q494 VanDerWaalsContact NE2-NE2 3.17Å
493	Q	33.2	Very low	29.5	Very low	160 Å²	160	146.7 Å²	146.7	75%	0.748	74%	0.74	S	S	*	*	S	Bend	cis	-138.1	162.2	17.3	-149.9	165.7	9.3	0	0	110.7
494	Q	31.5	Very low	29.4	Very low	148 Å²	148	146.5 Å²	146.5	69%	0.692	75%	0.747	S	S	*	*				-87.7	147.2	-118.9	-68.1	145.5	9.9	0	0	116.3	H492	H492-Q494 PolarHBondContact NE2-NE2 2.68Å; H492-Q494 VanDerWaalsContact NE2-NE2 3.17Å
495	H	30.7	Very low	29.1	Very low	147 Å²	147	142.9 Å²	142.9	68%	0.681	74%	0.743	S	S	*	*			trans	-89.6	148.2	-161.1	-76.1	-103.3	0	0	0	113.4
496	L	29.1	Very low	29	Very low	149 Å²	149	139.8 Å²	139.8	78%	0.78	74%	0.735	S	S	*	*			cis	-145.4	118.8	2	-103.8	146.5	0	0	0	110.9
497	K	27.7	Very low	29.4	Very low	202 Å²	202	138.1 Å²	138.1	88%	0.878	73%	0.732	S	S	*	*			trans	-89.7	146.9	138.5	-73.7	-179.2	-180	179.6	0	106.3
498	S	27	Very low	29.4	Very low	93 Å²	93	137.7 Å²	137.7	65%	0.65	72%	0.723	S	S	*	*			cis	-158	174	-5.2	49	0	0	0	0	106.1
499	N	31	Very low	29.3	Very low	146 Å²	146	142 Å²	142	78%	0.781	73%	0.728	S	S	*	*				-154.5	150.8	50.9	-77	-36.4	0	0	0	111.5
500	N	25.9	Very low	29.1	Very low	133 Å²	133	139.6 Å²	139.6	71%	0.711	72%	0.723	S	S	*	*			trans	-72.4	138.2	150.3	-61.4	-45	0	0	0	108.4
501	H	29.6	Very low	29	Very low	127 Å²	127	138.8 Å²	138.8	59%	0.588	72%	0.723	S	S	*	*			trans	-166.5	139.9	133.6	-120.7	-89.6	0	0	0	113	I116	I116-H501 VanDerWaalsContact CD1-CE1 3.44Å; I116-H501 WeakPolarHBondContact CD1-CE1 3.49Å; I116-H501 WeakPolarHBondContact CG2-NE2 3.49Å
502	T	28.8	Very low	28.8	Very low	78 Å²	78	134.9 Å²	134.9	48%	0.479	72%	0.72	S	S	.	*			trans	15.8	125.7	146.6	56	0	0	0	0	120.9	I116	I116-T502 HydrophobicContact CD1-CG2 4.29Å
503	D	25.2	Very low	28.8	Very low	142 Å²	142	133.8 Å²	133.8	76%	0.759	72%	0.724	S	S	*	*				84	151.7	119.5	-57.7	-14.9	0	0	0	123.1	N505	D503-N505 PolarHBondContact O-N 2.85Å; D503-N505 VanDerWaalsContact O-N 3.07Å
504	C	24.2	Very low	28.5	Very low	115 Å²	115	131.6 Å²	131.6	78%	0.777	72%	0.722	S	S	*	*			trans	-48.2	97.4	-179.4	51.2	0	0	0	0	115.2
505	N	24.6	Very low	28.4	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	72%	0.724	S	S	*	*			trans	-167.3	128.5	131.5	-89.5	-44.5	0	0	0	105.7	D503	D503-N505 PolarHBondContact O-N 2.85Å; D503-N505 VanDerWaalsContact O-N 3.07Å
506	N	27.4	Very low	28.3	Very low	129 Å²	129	129.5 Å²	129.5	69%	0.69	73%	0.725	S	S	*	*			cis	-170.8	177.9	48.7	-118.2	-41.3	0	0	0	110.2
507	T	36.2	Very low	28.3	Very low	120 Å²	120	128.4 Å²	128.4	74%	0.736	72%	0.72	S	S	*	*			trans	61.3	142.4	146.9	49.9	0	0	0	0	120.8
508	L	32	Very low	28.2	Very low	148 Å²	148	125.3 Å²	125.3	78%	0.775	71%	0.713	S	S	*	*			cis	-166.9	108.3	-18	-171.7	74.6	0	0	0	109.6
509	L	30.5	Very low	28.3	Very low	158 Å²	158	126.9 Å²	126.9	83%	0.827	71%	0.714	S	S	*	*				-171.6	138.7	116.5	-142.2	62.8	0	0	0	111.5
510	T	27.1	Very low	28.3	Very low	113 Å²	113	127.2 Å²	127.2	69%	0.693	72%	0.716	S	S	*	*			trans	-79.7	170	175.4	42.5	0	0	0	0	113.1
511	T	28.2	Very low	28.4	Very low	116 Å²	116	127.7 Å²	127.7	71%	0.712	72%	0.718	S	S	*	*			trans	74.7	115.8	146.3	38.8	0	0	0	0	121
512	T	26.6	Very low	28.5	Very low	118 Å²	118	129.3 Å²	129.3	72%	0.724	73%	0.731	S	S	*	*			trans	78.1	140.9	132.7	53.3	0	0	0	0	122.9
513	T	28.3	Very low	28.5	Very low	121 Å²	121	133 Å²	133	74%	0.742	75%	0.748	S	S	*	*			trans	68.8	112.9	147.3	43.8	0	0	0	0	121.2
514	T	28.2	Very low	28.8	Very low	115 Å²	115	131 Å²	131	71%	0.706	75%	0.745	S	S	*	*			trans	26.5	114.5	131.9	46.5	0	0	0	0	120.2
515	T	29.2	Very low	29.6	Very low	118 Å²	118	132.7 Å²	132.7	72%	0.724	75%	0.746	S	S	*	*			trans	47.5	123.4	133.8	60.2	0	0	0	0	118.4
516	N	27.7	Very low	30.4	Very low	133 Å²	133	132.8 Å²	132.8	71%	0.711	74%	0.742	S	S	*	*				-167.3	157.7	61.8	-113.9	-28.2	0	0	0	114.1
517	N	28.6	Very low	31.1	Very low	126 Å²	126	131 Å²	131	67%	0.674	74%	0.74	S	S	*	*			trans	11.3	133.5	146.6	-53	-14.3	0	0	0	118.6
518	N	27.2	Very low	31.9	Very low	137 Å²	137	132.5 Å²	132.5	73%	0.733	74%	0.743	S	S	*	*				-161.5	158.5	63.5	-94	-52.4	0	0	0	114.2
519	N	27.2	Very low	33.8	Very low	125 Å²	125	129.7 Å²	129.7	67%	0.668	73%	0.726	S	S	*	*			trans	45.3	112.7	151.3	-55.2	-13.9	0	0	0	117.7
520	N	31.2	Very low	36.3	Very low	153 Å²	153	128.6 Å²	128.6	82%	0.818	72%	0.715	S	S	*	*				-148.4	138.1	84.5	-93.8	-35.2	0	0	0	115.2	N522	N520-N522 PolarHBondContact O-N 3.12Å
521	N	29.5	Very low	39.6	Very low	144 Å²	144	129.9 Å²	129.9	77%	0.77	71%	0.711	S	S	*	*			trans	-21.4	113.3	170.1	-55.5	-22.2	0	0	0	116.9
522	N	31.8	Very low	42.9	Very low	160 Å²	160	124.5 Å²	124.5	86%	0.856	68%	0.678	S	S	*	*			trans	-162	53.8	157.8	-104.6	-34.2	0	0	0	111.5	N520	N520-N522 PolarHBondContact O-N 3.12Å
523	N	28.2	Very low	46.1	Very low	157 Å²	157	123 Å²	123	84%	0.84	66%	0.661	S	S	*	*			trans	-143.9	54.9	-176.8	-125.3	-13.6	0	0	0	114
524	S	32.2	Very low	49.4	Very low	100 Å²	100	117.3 Å²	117.3	70%	0.699	63%	0.626	S	S	*	*			trans	-130.2	26.4	175	53.6	0	0	0	0	113.3
525	N	39.3	Very low	52.6	Low	149 Å²	149	112 Å²	112	80%	0.797	59%	0.594	S	S	*	*			trans	-108	21.2	-179	-88.6	-18.3	0	0	0	114.5
526	H	42.8	Very low	55.7	Low	149 Å²	149	108.3 Å²	108.3	69%	0.69	58%	0.579	S	S	*	*			trans	-78.5	-7.3	169.8	-90.8	-32.8	0	0	0	113.9	N528	H526-N528 PolarHBondContact O-N 3.28Å
527	S	40.5	Very low	59	Low	92 Å²	92	104.4 Å²	104.4	64%	0.643	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	50.9	175.7	46.8	0	0	0	0	113.7
528	N	54.7	Low	62.1	Low	151 Å²	151	105.7 Å²	105.7	81%	0.807	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.2	32.9	157.5	-101.8	-36.4	0	0	0	113.9	H526 K530	H526-N528 PolarHBondContact O-N 3.28Å; N528-K530 PolarHBondContact O-N 2.95Å
529	E	70.2	Confident	65.3	Low	88 Å²	88	100 Å²	100	41%	0.411	53%	0.525	S	S	.	.			trans	-67.1	103.6	176.7	-176	159.6	-68.8	0	0	111.9	K531 R538	E529-K531 PolarHBondContact O-N 2.93Å; E529-R538 HydrophobicContact CG-CG 4.09Å; E529-R538 IonicContact OE1-CZ 2.71Å; E529-R538 IonicContact OE1-NE 3.86Å; E529-R538 PolarHBondContact OE1-NE 2.82Å; E529-R538 IonicContact OE1-NH2 3.6Å; E529-R538 PolarHBondContact OE1-NH2 3.49Å; E529-R538 WeakPolarHBondContact OE2-CG 3.48Å; E529-R538 IonicContact OE2-NE 3.78Å; E529-R538 PolarHBondContact OE2-NE 2.66Å; E529-R538 VanDerWaalsContact OE2-NE 3.12Å
530	K	84.5	Confident	68.2	Low	135 Å²	135	98.9 Å²	98.9	59%	0.587	52%	0.523	S	S	*	.			trans	-61.2	119.7	-177	-75.4	179.8	-176.3	178.5	0	111.1	N528 A539 L547	N528-K530 PolarHBondContact O-N 2.95Å; K530-A539 HydrophobicContact CB-CB 4.42Å; K530-A539 VanDerWaalsContact O-CB 3.24Å; K530-A539 WeakPolarHBondContact O-CB 3.38Å; K530-A539 PolarHBondContact O-N 3.07Å; K530-L547 HydrophobicContact CB-CD1 4.16Å; K530-L547 HydrophobicContact CB-CD2 3.97Å; K530-L547 HydrophobicContact CB-CG 4.38Å; K530-L547 HydrophobicContact CD-CD1 4.12Å; K530-L547 HydrophobicContact CD-CD2 4.45Å; K530-L547 HydrophobicContact CG-CD2 4.2Å
531	K	95.3	Very high	71	Confident	141 Å²	141	95.4 Å²	95.4	61%	0.613	50%	0.504	S	S	*	.	B	Isolated β-bridge	trans	-97.4	150.9	-179.9	-66.9	-176	-178.7	176.7	0	112.5	E529 K533	E529-K531 PolarHBondContact O-N 2.93Å; K531-K533 PolarHBondContact O-N 3.45Å
532	C	96.7	Very high	74.1	Confident	3 Å²	3	94.1 Å²	94.1	2%	0.02	49%	0.493	C	S	.	.			trans	-75.7	115.3	-179.7	174.2	0	0	0	0	111.3	V534 C535 G536 D537 L547 C549	C532-V534 PolarHBondContact O-N 3.01Å; C532-C535 PolarHBondContact O-N 3.37Å; C532-C535 VanDerWaalsContact O-N 3.08Å; C532-G536 PolarHBondContact O-N 3.16Å; C532-D537 WeakPolarHBondContact CB-O 3.28Å; C532-D537 PolarHBondContact N-O 3.11Å; C532-L547 WeakPolarHBondContact CA-O 3.25Å; C532-C549 HydrophobicContact CB-CB 4.04Å; C532-C549 PolarHBondContact SG-N 3.01Å; C532-C549 VanDerWaalsContact SG-N 3.39Å
533	K	95.7	Very high	77	Confident	86 Å²	86	87.3 Å²	87.3	37%	0.374	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-30.7	179.7	-71.9	-161.3	-179.1	-176.4	0	113.5	K531 L547 V628 E666	K531-K533 PolarHBondContact O-N 3.45Å; K533-L547 PolarHBondContact N-O 3.22Å; K533-V628 HydrophobicContact CB-CB 3.98Å; K533-V628 HydrophobicContact CB-CG1 4.03Å; K533-V628 HydrophobicContact CB-CG2 4.23Å; K533-E666 IonicContact NZ-OE1 2.7Å; K533-E666 PolarHBondContact NZ-OE1 3.08Å; K533-E666 IonicContact NZ-OE2 3.3Å
534	V	96.5	Very high	80.1	Confident	2 Å²	2	81.1 Å²	81.1	1%	0.012	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-33.5	-179.7	-177.2	0	0	0	0	113.8	C532 T548 C552 I609 R621 Q624 V628 M630	C532-V534 PolarHBondContact O-N 3.01Å; V534-T548 HydrophobicContact CG2-CG2 3.92Å; V534-C552 HydrophobicContact CB-CB 4.28Å; V534-C552 HydrophobicContact CG1-CB 4.42Å; V534-C552 HydrophobicContact CG2-CB 4.33Å; V534-I609 WeakPolarHBondContact O-CG2 3.44Å; V534-R621 HydrophobicContact CG1-CG 4.46Å; V534-Q624 HydrophobicContact CG1-CG 4.32Å; V534-V628 HydrophobicContact CG2-CG2 3.55Å; V534-M630 HydrophobicContact CG2-CG 4.42Å; V534-M630 HydrophobicContact CG2-SD 3.64Å
535	C	96	Very high	83	Confident	4 Å²	4	78.3 Å²	78.3	3%	0.027	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-153.2	8.2	-166.9	71.9	0	0	0	0	116.8	C532 D537 C549 C552 I609 T610 P611 R614	C532-C535 PolarHBondContact O-N 3.37Å; C532-C535 VanDerWaalsContact O-N 3.08Å; C535-D537 PolarHBondContact O-N 3.18Å; C535-C549 VanDerWaalsContact SG-SG 3.67Å; C535-C552 PolarHBondContact SG-SG 2.66Å; C535-I609 WeakPolarHBondContact CA-O 3.43Å; C535-I609 HydrophobicContact CB-CG2 3.87Å; C535-T610 CarbonylContact O-C 3.43Å; C535-T610 VanDerWaalsContact O-C 3.3Å; C535-T610 WeakPolarHBondContact O-CA 3.4Å; C535-P611 WeakPolarHBondContact O-CD 3.33Å; C535-P611 WeakPolarHBondContact O-CG 3.13Å; C535-P611 VanDerWaalsContact O-N 3.17Å; C535-R614 HydrophobicContact CB-CB 4.4Å; C535-R614 PolarHBondContact SG-NH1 3.04Å
536	G	94.7	Very high	85.6	Confident	40 Å²	40	72.9 Å²	72.9	41%	0.412	38%	0.379	S	S	.	.	S	Bend	trans	75.3	-15.5	177.7	0	0	0	0	0	116.7	C532	C532-G536 PolarHBondContact O-N 3.16Å
537	D	95.4	Very high	88.2	Confident	51 Å²	51	67.2 Å²	67.2	27%	0.273	35%	0.354	S	S	.	.	S	Bend	trans	-62.9	160.9	178.1	-167.8	18.3	0	0	0	113	C532 C535 A539 C549 P611 R614	C532-D537 WeakPolarHBondContact CB-O 3.28Å; C532-D537 PolarHBondContact N-O 3.11Å; C535-D537 PolarHBondContact O-N 3.18Å; D537-A539 PolarHBondContact O-N 2.6Å; D537-C549 HydrophobicContact CB-CB 4.18Å; D537-P611 HydrophobicContact CB-CB 4.12Å; D537-P611 HydrophobicContact CB-CG 4.11Å; D537-R614 IonicContact OD2-CZ 3.11Å; D537-R614 IonicContact OD2-NH1 3.12Å; D537-R614 PolarHBondContact OD2-NH1 3.39Å; D537-R614 IonicContact OD2-NH2 2.74Å; D537-R614 PolarHBondContact OD2-NH2 2.93Å
538	R	94.5	Very high	90.8	Very high	153 Å²	153	62.8 Å²	62.8	58%	0.577	32%	0.323	S	S	*	.	B	Isolated β-bridge	trans	-55.3	119	-179.3	-154.7	177.7	-152.4	-147	3.1	110.5	E529 C549	E529-R538 HydrophobicContact CG-CG 4.09Å; E529-R538 IonicContact OE1-CZ 2.71Å; E529-R538 IonicContact OE1-NE 3.86Å; E529-R538 PolarHBondContact OE1-NE 2.82Å; E529-R538 IonicContact OE1-NH2 3.6Å; E529-R538 PolarHBondContact OE1-NH2 3.49Å; E529-R538 WeakPolarHBondContact OE2-CG 3.48Å; E529-R538 IonicContact OE2-NE 3.78Å; E529-R538 PolarHBondContact OE2-NE 2.66Å; E529-R538 VanDerWaalsContact OE2-NE 3.12Å; R538-C549 WeakPolarHBondContact O-CB 3.44Å
539	A	94.4	Very high	92.8	Very high	16 Å²	16	55.8 Å²	55.8	13%	0.132	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-80.2	147.3	177.4	0	0	0	0	0	110.7	K530 D537 L547 T548	K530-A539 HydrophobicContact CB-CB 4.42Å; K530-A539 VanDerWaalsContact O-CB 3.24Å; K530-A539 WeakPolarHBondContact O-CB 3.38Å; K530-A539 PolarHBondContact O-N 3.07Å; D537-A539 PolarHBondContact O-N 2.6Å; A539-L547 HydrophobicContact CB-CD1 4.08Å; A539-L547 HydrophobicContact CB-CG 3.89Å; A539-T548 WeakPolarHBondContact CA-O 3.32Å
540	V	88.5	Confident	94	Very high	102 Å²	102	55.6 Å²	55.6	62%	0.618	28%	0.284	S	S	*	.			trans	-96.2	-48.8	178.2	-174.3	0	0	0	0	109.8	T548 E550	V540-T548 PolarHBondContact N-O 3.06Å; V540-E550 HydrophobicContact CG2-CB 4.33Å
541	N	90	Very high	94.6	Very high	80 Å²	80	51.3 Å²	51.3	43%	0.428	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	-166.4	174.3	70	-20.5	0	0	0	110.2	N543 T548	N541-N543 PolarHBondContact OD1-ND2 2.57Å; N541-N543 PolarHBondContact OD1-OD1 2.92Å; N541-T548 PolarHBondContact O-N 3.21Å
542	H	93.9	Very high	94.7	Very high	118 Å²	118	44.6 Å²	44.6	55%	0.546	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	123.5	163.4	-66.6	97.4	0	0	0	110.2	Q546 L547	H542-Q546 WeakPolarHBondContact CA-O 3.33Å; H542-L547 PolarHBondContact CD2-N 2.91Å
543	N	93	Very high	94.6	Very high	16 Å²	16	46.6 Å²	46.6	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.7	169.8	-57.8	-87	0	0	0	109.2	N541 G545 Q546 T548 K553	N541-N543 PolarHBondContact OD1-ND2 2.57Å; N541-N543 PolarHBondContact OD1-OD1 2.92Å; N543-G545 PolarHBondContact O-N 3.12Å; N543-Q546 PolarHBondContact N-O 2.91Å; N543-Q546 PolarHBondContact O-N 3.17Å; N543-Q546 VanDerWaalsContact O-O 3.11Å; N543-T548 WeakPolarHBondContact CB-OG1 3.24Å; N543-T548 PolarHBondContact ND2-OG1 3.28Å; N543-T548 VanDerWaalsContact ND2-OG1 3.08Å; N543-K553 HydrophobicContact CB-CB 3.87Å; N543-K553 HydrophobicContact CB-CD 4.34Å; N543-K553 HydrophobicContact CB-CG 3.78Å; N543-K553 WeakPolarHBondContact OD1-CD 3.47Å; N543-K553 WeakPolarHBondContact OD1-CE 3.36Å; N543-K553 WeakPolarHBondContact OD1-CG 3.38Å
544	F	94	Very high	94.6	Very high	28 Å²	28	43.5 Å²	43.5	12%	0.123	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	43.1	179.9	-48.9	-71.9	0	0	0	111.9	Q546 K553 F556 R557 M630 R631 L634 I635	F544-Q546 PolarHBondContact O-N 3.16Å; F544-K553 HydrophobicContact CD2-CG 4.46Å; F544-K553 HydrophobicContact CE2-CB 4.28Å; F544-K553 HydrophobicContact CE2-CG 3.71Å; F544-F556 HydrophobicContact CB-CD1 3.96Å; F544-F556 HydrophobicContact CB-CE1 3.88Å; F544-F556 HydrophobicContact CD1-CD1 4.31Å; F544-F556 HydrophobicContact CD1-CE1 4.4Å; F544-F556 AromaticContact CD2-CD1 3.69Å; F544-F556 HydrophobicContact CD2-CD1 3.69Å; F544-F556 HydrophobicContact CD2-CE1 4.41Å; F544-F556 HydrophobicContact CE2-CD1 4.27Å; F544-F556 AromaticContact CG-CD1 3.7Å; F544-F556 HydrophobicContact CG-CD1 3.7Å; F544-F556 AromaticContact CG-CE1 3.97Å; F544-F556 HydrophobicContact CG-CE1 3.97Å; F544-R557 HydrophobicContact CE2-CB 4.28Å; F544-R557 HydrophobicContact CZ-CB 3.92Å; F544-R557 HydrophobicContact CZ-CG 4.19Å; F544-M630 HydrophobicContact CB-CB 4.49Å; F544-M630 HydrophobicContact CB-CE 4.09Å; F544-M630 HydrophobicContact CD2-CE 3.69Å; F544-M630 HydrophobicContact CG-CE 4.34Å; F544-M630 CarbonylContact O-C 3.56Å; F544-M630 WeakPolarHBondContact O-CA 3.45Å; F544-R631 PolarHBondContact O-N 3.11Å; F544-L634 HydrophobicContact CD1-CB 4.03Å; F544-L634 WeakPolarHBondContact CD1-O 3.49Å; F544-L634 WeakPolarHBondContact CE1-O 3.47Å; F544-I635 HydrophobicContact CD1-CG1 3.74Å; F544-I635 HydrophobicContact CE1-CB 4.35Å; F544-I635 HydrophobicContact CE1-CG1 3.49Å; F544-I635 VanDerWaalsContact CE1-CG1 3.49Å; F544-I635 HydrophobicContact CZ-CG1 4.21Å
545	G	91.8	Very high	94.6	Very high	40 Å²	40	44.2 Å²	44.2	41%	0.412	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.3	-11.1	-178.3	0	0	0	0	0	116.2	N543	N543-G545 PolarHBondContact O-N 3.12Å
546	Q	95.1	Very high	94.6	Very high	35 Å²	35	44 Å²	44	16%	0.164	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	144.8	-168.8	-68	-64.2	-21.6	0	0	115.6	H542 N543 F544 T548 V628 G629 M630	H542-Q546 WeakPolarHBondContact CA-O 3.33Å; N543-Q546 PolarHBondContact N-O 2.91Å; N543-Q546 PolarHBondContact O-N 3.17Å; N543-Q546 VanDerWaalsContact O-O 3.11Å; F544-Q546 PolarHBondContact O-N 3.16Å; Q546-T548 HydrophobicContact CB-CG2 4.41Å; Q546-T548 WeakPolarHBondContact O-CG2 3.38Å; Q546-T548 PolarHBondContact O-N 2.97Å; Q546-T548 VanDerWaalsContact O-N 3.16Å; Q546-T548 PolarHBondContact O-OG1 3.3Å; Q546-V628 WeakPolarHBondContact CG-O 3.4Å; Q546-V628 PolarHBondContact NE2-O 2.92Å; Q546-G629 VanDerWaalsContact CG-C 3.5Å; Q546-G629 WeakPolarHBondContact CG-O 3.37Å; Q546-M630 HydrophobicContact CB-CG 4.12Å; Q546-M630 HydrophobicContact CG-CG 4.4Å
547	L	95.8	Very high	94.6	Very high	30 Å²	30	48.5 Å²	48.5	16%	0.157	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	109.9	-178.3	-168.9	64.6	0	0	0	110.6	K530 C532 K533 A539 H542	K530-L547 HydrophobicContact CB-CD1 4.16Å; K530-L547 HydrophobicContact CB-CD2 3.97Å; K530-L547 HydrophobicContact CB-CG 4.38Å; K530-L547 HydrophobicContact CD-CD1 4.12Å; K530-L547 HydrophobicContact CD-CD2 4.45Å; K530-L547 HydrophobicContact CG-CD2 4.2Å; C532-L547 WeakPolarHBondContact CA-O 3.25Å; K533-L547 PolarHBondContact N-O 3.22Å; A539-L547 HydrophobicContact CB-CD1 4.08Å; A539-L547 HydrophobicContact CB-CG 3.89Å; H542-L547 PolarHBondContact CD2-N 2.91Å
548	T	96.7	Very high	94.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	151.8	-163.4	43.4	0	0	0	0	114.8	V534 A539 V540 N541 N543 Q546 C552 M630	V534-T548 HydrophobicContact CG2-CG2 3.92Å; A539-T548 WeakPolarHBondContact CA-O 3.32Å; V540-T548 PolarHBondContact N-O 3.06Å; N541-T548 PolarHBondContact O-N 3.21Å; N543-T548 WeakPolarHBondContact CB-OG1 3.24Å; N543-T548 PolarHBondContact ND2-OG1 3.28Å; N543-T548 VanDerWaalsContact ND2-OG1 3.08Å; Q546-T548 HydrophobicContact CB-CG2 4.41Å; Q546-T548 WeakPolarHBondContact O-CG2 3.38Å; Q546-T548 PolarHBondContact O-N 2.97Å; Q546-T548 VanDerWaalsContact O-N 3.16Å; Q546-T548 PolarHBondContact O-OG1 3.3Å; T548-C552 HydrophobicContact CG2-CB 4.45Å; T548-M630 HydrophobicContact CG2-CE 4.07Å; T548-M630 HydrophobicContact CG2-SD 4.03Å
549	C	96.9	Very high	94.3	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.02	24%	0.241	C	C	.	.			trans	-79.4	153.8	168.9	68.4	0	0	0	0	110.8	C532 C535 D537 R538 S551 C552 K553 R614	C532-C549 HydrophobicContact CB-CB 4.04Å; C532-C549 PolarHBondContact SG-N 3.01Å; C532-C549 VanDerWaalsContact SG-N 3.39Å; C535-C549 VanDerWaalsContact SG-SG 3.67Å; D537-C549 HydrophobicContact CB-CB 4.18Å; R538-C549 WeakPolarHBondContact O-CB 3.44Å; C549-S551 PolarHBondContact O-N 3.18Å; C549-S551 VanDerWaalsContact O-N 3.13Å; C549-C552 PolarHBondContact O-N 2.84Å; C549-K553 PolarHBondContact O-N 2.96Å; C549-R614 PolarHBondContact SG-NH1 3.2Å
550	E	95.5	Very high	94	Very high	84 Å²	84	46.8 Å²	46.8	39%	0.393	24%	0.235	S	C	.	.	H	α-helix	trans	-54.8	-36.3	-177	-167.2	62.2	-158	0	0	113	V540 C552 K553 A554	V540-E550 HydrophobicContact CG2-CB 4.33Å; E550-C552 VanDerWaalsContact C-N 3.33Å; E550-C552 PolarHBondContact O-N 3.39Å; E550-K553 VanDerWaalsContact CD-CD 3.43Å; E550-K553 PolarHBondContact O-N 3.3Å; E550-K553 VanDerWaalsContact OE1-CD 3.28Å; E550-K553 WeakPolarHBondContact OE1-CD 3.09Å; E550-K553 WeakPolarHBondContact OE1-CE 3.38Å; E550-K553 IonicContact OE1-NZ 3Å; E550-K553 PolarHBondContact OE1-NZ 3.11Å; E550-K553 WeakPolarHBondContact OE2-CD 3.49Å; E550-K553 WeakPolarHBondContact OE2-CE 3.17Å; E550-K553 IonicContact OE2-NZ 3.19Å; E550-K553 PolarHBondContact OE2-NZ 3.26Å; E550-A554 VanDerWaalsContact O-CB 3.3Å; E550-A554 WeakPolarHBondContact O-CB 3.32Å; E550-A554 PolarHBondContact O-N 2.66Å
551	S	95.9	Very high	93.7	Very high	45 Å²	45	46 Å²	46	32%	0.315	22%	0.224	S	C	.	.	H	α-helix	trans	-67.9	-30.3	179.1	91.4	0	0	0	0	113.3	C549 F555 R614 R621	C549-S551 PolarHBondContact O-N 3.18Å; C549-S551 VanDerWaalsContact O-N 3.13Å; S551-F555 WeakPolarHBondContact O-CB 3.42Å; S551-F555 PolarHBondContact O-N 3.04Å; S551-R614 PolarHBondContact OG-NH1 3.38Å; S551-R621 VanDerWaalsContact C-NH2 3.27Å; S551-R621 PolarHBondContact O-NH2 3.15Å; S551-R621 VanDerWaalsContact O-NH2 3.16Å; S551-R621 PolarHBondContact OG-NH2 3.42Å
552	C	97.6	Very high	92.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-77.3	-42.3	176.3	-76.3	0	0	0	0	111.6	V534 C535 T548 C549 E550 F555 F556 R621	V534-C552 HydrophobicContact CB-CB 4.28Å; V534-C552 HydrophobicContact CG1-CB 4.42Å; V534-C552 HydrophobicContact CG2-CB 4.33Å; C535-C552 PolarHBondContact SG-SG 2.66Å; T548-C552 HydrophobicContact CG2-CB 4.45Å; C549-C552 PolarHBondContact O-N 2.84Å; E550-C552 VanDerWaalsContact C-N 3.33Å; E550-C552 PolarHBondContact O-N 3.39Å; C552-F555 PolarHBondContact O-N 3.43Å; C552-F556 WeakPolarHBondContact O-CB 3.02Å; C552-F556 PolarHBondContact O-N 3.18Å; C552-R621 PolarHBondContact SG-NH2 3.14Å
553	K	95.7	Very high	91.1	Very high	45 Å²	45	41.2 Å²	41.2	20%	0.196	20%	0.202	C	C	.	.	H	α-helix	trans	-53	-53.9	168.2	169.8	-155.8	-168	-177.2	0	111.3	N543 F544 C549 E550 F555 F556 R557	N543-K553 HydrophobicContact CB-CB 3.87Å; N543-K553 HydrophobicContact CB-CD 4.34Å; N543-K553 HydrophobicContact CB-CG 3.78Å; N543-K553 WeakPolarHBondContact OD1-CD 3.47Å; N543-K553 WeakPolarHBondContact OD1-CE 3.36Å; N543-K553 WeakPolarHBondContact OD1-CG 3.38Å; F544-K553 HydrophobicContact CD2-CG 4.46Å; F544-K553 HydrophobicContact CE2-CB 4.28Å; F544-K553 HydrophobicContact CE2-CG 3.71Å; C549-K553 PolarHBondContact O-N 2.96Å; E550-K553 VanDerWaalsContact CD-CD 3.43Å; E550-K553 PolarHBondContact O-N 3.3Å; E550-K553 VanDerWaalsContact OE1-CD 3.28Å; E550-K553 WeakPolarHBondContact OE1-CD 3.09Å; E550-K553 WeakPolarHBondContact OE1-CE 3.38Å; E550-K553 IonicContact OE1-NZ 3Å; E550-K553 PolarHBondContact OE1-NZ 3.11Å; E550-K553 WeakPolarHBondContact OE2-CD 3.49Å; E550-K553 WeakPolarHBondContact OE2-CE 3.17Å; E550-K553 IonicContact OE2-NZ 3.19Å; E550-K553 PolarHBondContact OE2-NZ 3.26Å; K553-F555 VanDerWaalsContact C-N 3.3Å; K553-F555 PolarHBondContact O-N 3.06Å; K553-F556 PolarHBondContact O-N 2.9Å; K553-R557 WeakPolarHBondContact O-CB 3.34Å; K553-R557 PolarHBondContact O-N 3.37Å
554	A	95.4	Very high	89.1	Confident	22 Å²	22	42.4 Å²	42.4	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-69.3	-24.2	-179.9	0	0	0	0	0	113.7	E550 R558	E550-A554 VanDerWaalsContact O-CB 3.3Å; E550-A554 WeakPolarHBondContact O-CB 3.32Å; E550-A554 PolarHBondContact O-N 2.66Å; A554-R558 PolarHBondContact O-NE 3.03Å
555	F	95.8	Very high	86.6	Confident	17 Å²	17	43.8 Å²	43.8	8%	0.075	22%	0.221	C	C	.	.	H	α-helix	trans	-75.3	-48	171.6	173.9	-92.8	0	0	0	111.7	S551 C552 K553 R558 N559 P618 R621 L622	S551-F555 WeakPolarHBondContact O-CB 3.42Å; S551-F555 PolarHBondContact O-N 3.04Å; C552-F555 PolarHBondContact O-N 3.43Å; K553-F555 VanDerWaalsContact C-N 3.3Å; K553-F555 PolarHBondContact O-N 3.06Å; F555-R558 PolarHBondContact O-N 2.78Å; F555-N559 HydrophobicContact CE1-CB 4.45Å; F555-N559 WeakPolarHBondContact CE2-ND2 3.28Å; F555-N559 HydrophobicContact CZ-CB 4.22Å; F555-N559 PolarHBondContact O-N 3.03Å; F555-N559 PolarHBondContact O-ND2 3.19Å; F555-P618 HydrophobicContact CE2-CB 3.83Å; F555-P618 HydrophobicContact CZ-CB 4Å; F555-P618 WeakPolarHBondContact CZ-O 3.46Å; F555-R621 HydrophobicContact CD1-CG 3.86Å; F555-R621 HydrophobicContact CE1-CB 4.04Å; F555-R621 HydrophobicContact CE1-CG 3.72Å; F555-R621 HydrophobicContact CG-CG 4.46Å; F555-R621 HydrophobicContact CZ-CB 4.15Å; F555-R621 HydrophobicContact CZ-CG 4.21Å; F555-L622 HydrophobicContact CE1-CB 3.91Å; F555-L622 HydrophobicContact CE1-CD1 4.31Å; F555-L622 HydrophobicContact CZ-CB 4.12Å
556	F	96	Very high	84	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-49.3	-178.6	-175.2	-109.7	0	0	0	111.4	F544 C552 K553 R558 N559 A560 L622 C625 F626 M630 P632 I635	F544-F556 HydrophobicContact CB-CD1 3.96Å; F544-F556 HydrophobicContact CB-CE1 3.88Å; F544-F556 HydrophobicContact CD1-CD1 4.31Å; F544-F556 HydrophobicContact CD1-CE1 4.4Å; F544-F556 AromaticContact CD2-CD1 3.69Å; F544-F556 HydrophobicContact CD2-CD1 3.69Å; F544-F556 HydrophobicContact CD2-CE1 4.41Å; F544-F556 HydrophobicContact CE2-CD1 4.27Å; F544-F556 AromaticContact CG-CD1 3.7Å; F544-F556 HydrophobicContact CG-CD1 3.7Å; F544-F556 AromaticContact CG-CE1 3.97Å; F544-F556 HydrophobicContact CG-CE1 3.97Å; C552-F556 WeakPolarHBondContact O-CB 3.02Å; C552-F556 PolarHBondContact O-N 3.18Å; K553-F556 PolarHBondContact O-N 2.9Å; F556-R558 PolarHBondContact O-N 3.07Å; F556-N559 PolarHBondContact O-N 3.43Å; F556-A560 HydrophobicContact CD1-CB 4.4Å; F556-A560 HydrophobicContact CD2-CB 4.1Å; F556-A560 HydrophobicContact CE1-CB 4.12Å; F556-A560 HydrophobicContact CE2-CB 3.81Å; F556-A560 HydrophobicContact CG-CB 4.4Å; F556-A560 HydrophobicContact CZ-CB 3.81Å; F556-A560 WeakPolarHBondContact O-CB 3.45Å; F556-A560 PolarHBondContact O-N 2.84Å; F556-L622 HydrophobicContact CD2-CD1 4.19Å; F556-C625 HydrophobicContact CD2-CB 3.52Å; F556-C625 HydrophobicContact CE2-CB 4.05Å; F556-C625 HydrophobicContact CG-CB 4.42Å; F556-F626 AromaticContact CE2-CD1 3.94Å; F556-F626 HydrophobicContact CE2-CD1 3.94Å; F556-F626 AromaticContact CE2-CE1 3.63Å; F556-F626 HydrophobicContact CE2-CE1 3.63Å; F556-F626 HydrophobicContact CE2-CZ 4.02Å; F556-F626 HydrophobicContact CZ-CD1 4.33Å; F556-F626 AromaticContact CZ-CE1 3.88Å; F556-F626 HydrophobicContact CZ-CE1 3.88Å; F556-M630 HydrophobicContact CB-CE 3.66Å; F556-M630 HydrophobicContact CB-SD 4.09Å; F556-M630 HydrophobicContact CD1-CB 4.11Å; F556-M630 HydrophobicContact CD1-CE 3.85Å; F556-M630 HydrophobicContact CD2-CB 3.99Å; F556-M630 HydrophobicContact CD2-SD 4.27Å; F556-M630 HydrophobicContact CE1-CB 3.86Å; F556-M630 HydrophobicContact CE2-CB 3.72Å; F556-M630 HydrophobicContact CG-CB 4.17Å; F556-M630 HydrophobicContact CG-CE 3.76Å; F556-M630 HydrophobicContact CG-SD 4.07Å; F556-M630 HydrophobicContact CZ-CB 3.65Å; F556-M630 WeakPolarHBondContact CZ-O 3.45Å; F556-P632 HydrophobicContact CE1-CB 4.49Å; F556-P632 HydrophobicContact CZ-CB 4.03Å; F556-I635 HydrophobicContact CD1-CD1 3.96Å; F556-I635 HydrophobicContact CD1-CG1 4.48Å; F556-I635 HydrophobicContact CE1-CD1 3.81Å; F556-I635 HydrophobicContact CE1-CG1 4.32Å
557	R	94	Very high	81.3	Confident	134 Å²	134	46.5 Å²	46.5	51%	0.506	23%	0.229	S	C	.	.	H	α-helix	trans	-54.4	-25.1	176.4	-168	175	69.4	-158.6	1.1	114.1	F544 K553 I635	F544-R557 HydrophobicContact CE2-CB 4.28Å; F544-R557 HydrophobicContact CZ-CB 3.92Å; F544-R557 HydrophobicContact CZ-CG 4.19Å; K553-R557 WeakPolarHBondContact O-CB 3.34Å; K553-R557 PolarHBondContact O-N 3.37Å; R557-I635 HydrophobicContact CG-CG2 4.21Å
558	R	91.6	Very high	78.4	Confident	167 Å²	167	49.1 Å²	49.1	63%	0.63	24%	0.241	S	C	*	.	H	α-helix	trans	-94.8	-13.2	179.6	-76.2	-175.5	-72.1	171.4	-4.9	114.7	A554 F555 F556	A554-R558 PolarHBondContact O-NE 3.03Å; F555-R558 PolarHBondContact O-N 2.78Å; F556-R558 PolarHBondContact O-N 3.07Å
559	N	93	Very high	75.4	Confident	16 Å²	16	53.7 Å²	53.7	9%	0.086	27%	0.269	C	S	.	.	H	α-helix	trans	-134.7	-15.1	-168.2	-62.2	-72.1	0	0	0	114.9	F555 F556 H561 K562 L598 L622	F555-N559 HydrophobicContact CE1-CB 4.45Å; F555-N559 WeakPolarHBondContact CE2-ND2 3.28Å; F555-N559 HydrophobicContact CZ-CB 4.22Å; F555-N559 PolarHBondContact O-N 3.03Å; F555-N559 PolarHBondContact O-ND2 3.19Å; F556-N559 PolarHBondContact O-N 3.43Å; N559-H561 VanDerWaalsContact C-N 3.27Å; N559-H561 PolarHBondContact O-N 3.39Å; N559-K562 HydrophobicContact CB-CD 4.46Å; N559-K562 WeakPolarHBondContact O-CB 3.14Å; N559-K562 PolarHBondContact O-N 2.77Å; N559-K562 WeakPolarHBondContact OD1-CE 3.3Å; N559-K562 PolarHBondContact OD1-NZ 3.42Å; N559-L598 HydrophobicContact CB-CD1 3.98Å; N559-L622 HydrophobicContact CB-CD1 4.17Å; N559-L622 HydrophobicContact CB-CD2 4.22Å; N559-L622 VanDerWaalsContact O-CD2 3.29Å; N559-L622 WeakPolarHBondContact O-CD2 3.03Å
560	A	88.9	Confident	72.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-49.7	-45.9	178	0	0	0	0	0	113.2	F556 K562 G563 L564 F626 P632 I635	F556-A560 HydrophobicContact CD1-CB 4.4Å; F556-A560 HydrophobicContact CD2-CB 4.1Å; F556-A560 HydrophobicContact CE1-CB 4.12Å; F556-A560 HydrophobicContact CE2-CB 3.81Å; F556-A560 HydrophobicContact CG-CB 4.4Å; F556-A560 HydrophobicContact CZ-CB 3.81Å; F556-A560 WeakPolarHBondContact O-CB 3.45Å; F556-A560 PolarHBondContact O-N 2.84Å; A560-K562 PolarHBondContact O-N 3.2Å; A560-G563 PolarHBondContact O-N 3.18Å; A560-L564 WeakPolarHBondContact O-CD1 3.29Å; A560-F626 HydrophobicContact CB-CZ 4.27Å; A560-P632 HydrophobicContact CB-CB 4.06Å; A560-I635 HydrophobicContact CB-CD1 3.38Å
561	H	80.6	Confident	69.3	Low	85 Å²	85	60.7 Å²	60.7	39%	0.394	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-63.9	-23.3	-180	-43.8	-54.7	0	0	0	113.7	N559 L648	N559-H561 VanDerWaalsContact C-N 3.27Å; N559-H561 PolarHBondContact O-N 3.39Å; H561-L648 VanDerWaalsContact CE1-CD1 3.41Å; H561-L648 WeakPolarHBondContact CE1-CD1 3.36Å; H561-L648 VanDerWaalsContact ND1-CD1 3.31Å; H561-L648 WeakPolarHBondContact ND1-CD1 3.34Å
562	K	73.7	Confident	66.2	Low	88 Å²	88	66 Å²	66	38%	0.383	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-78.8	-16.4	179.9	-54.1	178.2	-174.6	171.1	0	113.3	N559 A560 L598	N559-K562 HydrophobicContact CB-CD 4.46Å; N559-K562 WeakPolarHBondContact O-CB 3.14Å; N559-K562 PolarHBondContact O-N 2.77Å; N559-K562 WeakPolarHBondContact OD1-CE 3.3Å; N559-K562 PolarHBondContact OD1-NZ 3.42Å; A560-K562 PolarHBondContact O-N 3.2Å; K562-L598 HydrophobicContact CD-CD1 4.24Å; K562-L598 HydrophobicContact CD-CG 4.48Å
563	G	55.4	Low	63.1	Low	11 Å²	11	72.6 Å²	72.6	11%	0.113	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-86.3	-5.4	179.9	0	0	0	0	0	114.7	A560 S565	A560-G563 PolarHBondContact O-N 3.18Å; G563-S565 PolarHBondContact O-N 2.82Å
564	L	52.4	Low	59.7	Low	40 Å²	40	80.7 Å²	80.7	21%	0.209	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-9.1	-173.4	-90.2	78.6	0	0	0	114.8	A560 P652	A560-L564 WeakPolarHBondContact O-CD1 3.29Å; L564-P652 HydrophobicContact CD1-CG 3.88Å; L564-P652 HydrophobicContact CD2-CG 4.04Å; L564-P652 HydrophobicContact CG-CB 4.38Å; L564-P652 HydrophobicContact CG-CG 3.87Å
565	S	40.5	Very low	56.6	Low	58 Å²	58	85 Å²	85	41%	0.406	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-61.9	176.4	45.1	0	0	0	0	111.8	G563 L567 E597	G563-S565 PolarHBondContact O-N 2.82Å; S565-L567 PolarHBondContact O-N 3.16Å; S565-E597 VanDerWaalsContact CB-OE1 3.31Å; S565-E597 WeakPolarHBondContact CB-OE1 3.48Å; S565-E597 PolarHBondContact OG-OE1 3.01Å
566	T	38.4	Very low	53.3	Low	57 Å²	57	91.8 Å²	91.8	35%	0.35	45%	0.448	S	S	.	.	H	α-helix	trans	-67.9	-40.7	-169	-6.1	0	0	0	0	113.5	M568 V569 T570 E597	T566-M568 PolarHBondContact O-N 3.25Å; T566-V569 PolarHBondContact O-N 2.98Å; T566-T570 PolarHBondContact O-N 3.41Å; T566-T570 PolarHBondContact O-OG1 3.19Å; T566-E597 VanDerWaalsContact CB-OE1 3.28Å; T566-E597 WeakPolarHBondContact CB-OE1 3.39Å; T566-E597 HydrophobicContact CG2-CG 4.33Å; T566-E597 WeakPolarHBondContact CG2-OE1 3.38Å; T566-E597 PolarHBondContact N-OE1 3.02Å; T566-E597 WeakPolarHBondContact OG1-CG 3.34Å; T566-E597 PolarHBondContact OG1-OE1 2.82Å
567	L	38.6	Very low	50	Low	74 Å²	74	97.8 Å²	97.8	39%	0.387	48%	0.48	S	S	.	.	H	α-helix	trans	-71.5	-15.3	-172.2	-88.6	164.8	0	0	0	114.1	S565 A654	S565-L567 PolarHBondContact O-N 3.16Å; L567-A654 HydrophobicContact CB-CB 4.25Å; L567-A654 HydrophobicContact CD1-CB 4.33Å
568	M	34.2	Very low	46.8	Very low	86 Å²	86	98 Å²	98	42%	0.424	50%	0.496	S	S	.	.	H	α-helix	trans	-82	-36.7	173.8	-73.8	-177.8	161.4	0	0	112.2	T566	T566-M568 PolarHBondContact O-N 3.25Å
569	V	33.8	Very low	43.6	Very low	95 Å²	95	95.9 Å²	95.9	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-78.7	-47.4	-177.1	-176.3	0	0	0	0	111.6	T566 R571 M572	T566-V569 PolarHBondContact O-N 2.98Å; V569-R571 PolarHBondContact O-N 2.78Å; V569-M572 PolarHBondContact O-N 3.15Å
570	T	34.8	Very low	40.5	Very low	87 Å²	87	99.8 Å²	99.8	53%	0.534	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.7	-170.5	-39.3	0	0	0	0	113.7	T566	T566-T570 PolarHBondContact O-N 3.41Å; T566-T570 PolarHBondContact O-OG1 3.19Å
571	R	28.6	Very low	37.4	Very low	147 Å²	147	107.6 Å²	107.6	56%	0.555	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-11.4	-178	-144.5	173.5	-166.6	157.5	4.4	114.2	V569 L573 V657	V569-R571 PolarHBondContact O-N 2.78Å; R571-L573 VanDerWaalsContact C-N 3.34Å; R571-V657 VanDerWaalsContact NH2-CG1 3.29Å
572	M	31.9	Very low	34.8	Very low	158 Å²	158	111.2 Å²	111.2	78%	0.778	60%	0.597	S	S	*	*	S	Bend	trans	-86.3	-5.5	170.5	-71.6	-178.1	166.9	0	0	113	V569	V569-M572 PolarHBondContact O-N 3.15Å
573	L	31.8	Very low	32.5	Very low	137 Å²	137	116.7 Å²	116.7	72%	0.717	62%	0.617	S	S	*	*	S	Bend	trans	-112.9	29.7	-176	-61.3	174.2	0	0	0	112.5	R571	R571-L573 VanDerWaalsContact C-N 3.34Å
574	R	24.9	Very low	31.1	Very low	215 Å²	215	124.5 Å²	124.5	81%	0.811	65%	0.65	S	S	*	*			trans	-144.9	56.1	175.9	-75.5	-163.1	175.6	-171.4	-1.9	113
575	T	30.8	Very low	29.8	Very low	114 Å²	114	127.4 Å²	127.4	70%	0.699	67%	0.674	S	S	*	*	S	Bend	trans	-116.7	143.1	147.5	47	0	0	0	0	107.2	D577	T575-D577 PolarHBondContact O-N 2.98Å; T575-D577 VanDerWaalsContact O-N 3.12Å
576	N	25.6	Very low	29	Very low	158 Å²	158	132.3 Å²	132.3	85%	0.845	70%	0.696	S	S	*	*			trans	-89.8	67.7	-166.8	-72.6	-11.4	0	0	0	112.4
577	D	26.8	Very low	28.4	Very low	127 Å²	127	141 Å²	141	68%	0.679	72%	0.722	S	S	*	*			trans	-116.5	67	174	-70.7	-65.7	0	0	0	111.2	T575 S579	T575-D577 PolarHBondContact O-N 2.98Å; T575-D577 VanDerWaalsContact O-N 3.12Å; D577-S579 PolarHBondContact O-N 3.18Å
578	T	25.8	Very low	27.8	Very low	137 Å²	137	144.3 Å²	144.3	84%	0.84	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	62.3	178.7	53.1	0	0	0	0	111.9
579	S	26.3	Very low	27.3	Very low	124 Å²	124	144.3 Å²	144.3	87%	0.867	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.2	21.7	176.1	-79.2	0	0	0	0	116	D577	D577-S579 PolarHBondContact O-N 3.18Å
580	S	26.6	Very low	26.8	Very low	97 Å²	97	145.2 Å²	145.2	68%	0.678	76%	0.757	S	S	*	*			trans	-149	48	-179.4	52.3	0	0	0	0	114.9
581	L	24	Very low	26.5	Very low	164 Å²	164	148.7 Å²	148.7	86%	0.859	77%	0.77	S	S	*	*			trans	-135.9	71	177.6	-73.9	176.7	0	0	0	114
582	I	26.6	Very low	26.4	Very low	161 Å²	161	146.2 Å²	146.2	83%	0.826	76%	0.764	S	S	*	*	S	Bend	trans	-138.6	124.7	155.9	-54.3	-179.3	0	0	0	106.7
583	Y	24.5	Very low	26.3	Very low	203 Å²	203	143.3 Å²	143.3	80%	0.796	76%	0.759	S	S	*	*	S	Bend	trans	60.5	129.3	-147.7	-73.1	-115.6	0	0	0	111.1
584	E	26.4	Very low	26	Very low	175 Å²	175	143.9 Å²	143.9	82%	0.818	75%	0.752	S	S	*	*			cis	-133	129.5	13.1	-173.1	175.6	-147	0	0	110.7
585	S	24.4	Very low	26.3	Very low	102 Å²	102	136.5 Å²	136.5	71%	0.713	74%	0.742	S	S	*	*			trans	-128.5	27.3	-166.3	-51.3	0	0	0	0	115.5
586	N	23.9	Very low	27	Very low	160 Å²	160	138 Å²	138	86%	0.856	75%	0.746	S	S	*	*			trans	-133	39.1	-171	-86.8	-50.5	0	0	0	115.7
587	R	25.8	Very low	28.5	Very low	239 Å²	239	134.5 Å²	134.5	90%	0.902	72%	0.724	S	S	*	*			trans	-133.3	12.8	172.2	-109.5	-179.2	-177.6	-163.6	0.8	117
588	T	26.3	Very low	30.7	Very low	145 Å²	145	130.5 Å²	130.5	89%	0.89	70%	0.702	S	S	*	*			trans	-103.8	61.5	179.2	39.5	0	0	0	0	113.1
589	A	23.1	Very low	33	Very low	85 Å²	85	129.3 Å²	129.3	70%	0.702	70%	0.695	S	S	*	*			trans	-125.4	135.7	173.7	0	0	0	0	0	112.3
590	H	24.3	Very low	35.9	Very low	114 Å²	114	125.2 Å²	125.2	53%	0.528	67%	0.666	S	S	.	*			trans	72.1	71.6	166.3	-65	-17.4	0	0	0	119.6	L20 P21	L20-H590 HydrophobicContact CD2-CB 3.51Å; P21-H590 VanDerWaalsContact CD-NE2 3.26Å; P21-H590 WeakPolarHBondContact CD-NE2 3.18Å; P21-H590 WeakPolarHBondContact CG-NE2 3.28Å
591	I	29.1	Very low	38.2	Very low	160 Å²	160	126.9 Å²	126.9	82%	0.821	67%	0.672	S	S	*	*			trans	-120	109.8	131.4	-60.7	179.9	0	0	0	108.2	S593	I591-S593 PolarHBondContact O-N 2.63Å
592	K	26.1	Very low	40.6	Very low	95 Å²	95	120.7 Å²	120.7	41%	0.413	65%	0.645	S	S	.	*			trans	-94.4	77.9	176.2	-91.5	177.1	156.3	-172.4	0	110.5	L19 L20 R594	L19-K592 HydrophobicContact CB-CB 4.24Å; L19-K592 HydrophobicContact CB-CD 4.02Å; L19-K592 HydrophobicContact CD1-CB 4.48Å; L19-K592 HydrophobicContact CD2-CD 3.76Å; L19-K592 HydrophobicContact CG-CD 4.37Å; L20-K592 HydrophobicContact CD2-CB 4.26Å; L20-K592 HydrophobicContact CD2-CD 3.95Å; L20-K592 HydrophobicContact CD2-CG 4.19Å; L20-K592 HydrophobicContact CG-CB 4.11Å; L20-K592 HydrophobicContact CG-CD 4Å; L20-K592 HydrophobicContact CG-CG 4.41Å; K592-R594 PolarHBondContact O-N 3.3Å
593	S	29	Very low	42.4	Very low	98 Å²	98	123.8 Å²	123.8	69%	0.685	65%	0.652	S	S	*	*			trans	-75.8	104	175.2	54.7	0	0	0	0	111.8	I591 G595	I591-S593 PolarHBondContact O-N 2.63Å; S593-G595 PolarHBondContact O-N 2.83Å
594	R	24.8	Very low	44.8	Very low	149 Å²	149	118.1 Å²	118.1	56%	0.562	64%	0.642	S	S	*	*			trans	-77.6	78.7	179.6	-154.3	178.9	-138.2	160	8.1	111.7	E15 S18 L19 K592	E15-R594 PolarHBondContact O-NH1 3.45Å; E15-R594 VanDerWaalsContact O-NH1 3.11Å; S18-R594 PolarHBondContact OG-NH1 3.48Å; S18-R594 PolarHBondContact OG-NH2 3.43Å; L19-R594 HydrophobicContact CD1-CB 3.69Å; L19-R594 HydrophobicContact CD1-CG 3.53Å; K592-R594 PolarHBondContact O-N 3.3Å
595	G	32.6	Very low	47	Very low	59 Å²	59	110.8 Å²	110.8	61%	0.608	61%	0.613	S	S	*	*	S	Bend	trans	-157.1	131.6	175.7	0	0	0	0	0	111.7	S593 E597	S593-G595 PolarHBondContact O-N 2.83Å; G595-E597 PolarHBondContact O-N 3Å
596	L	44.2	Very low	49.5	Very low	147 Å²	147	111.8 Å²	111.8	77%	0.77	61%	0.607	S	S	*	*			trans	-62.5	108.3	-171.6	-81.8	75.7	0	0	0	112.2
597	E	57	Low	52.4	Low	84 Å²	84	106.9 Å²	106.9	39%	0.393	58%	0.579	S	S	.	*			trans	-70.2	125.8	163.7	-172.5	153.8	-107.6	0	0	109.3	S565 T566 G595 T599	S565-E597 VanDerWaalsContact CB-OE1 3.31Å; S565-E597 WeakPolarHBondContact CB-OE1 3.48Å; S565-E597 PolarHBondContact OG-OE1 3.01Å; T566-E597 VanDerWaalsContact CB-OE1 3.28Å; T566-E597 WeakPolarHBondContact CB-OE1 3.39Å; T566-E597 HydrophobicContact CG2-CG 4.33Å; T566-E597 WeakPolarHBondContact CG2-OE1 3.38Å; T566-E597 PolarHBondContact N-OE1 3.02Å; T566-E597 WeakPolarHBondContact OG1-CG 3.34Å; T566-E597 PolarHBondContact OG1-OE1 2.82Å; G595-E597 PolarHBondContact O-N 3Å; E597-T599 PolarHBondContact O-N 2.84Å; E597-T599 VanDerWaalsContact O-N 3.07Å
598	L	73.9	Confident	55.4	Low	43 Å²	43	101 Å²	101	23%	0.225	57%	0.569	C	S	.	*			trans	-81.1	92.1	-174.3	-75.7	168.2	0	0	0	110.4	N559 K562 P618 S619 L622	N559-L598 HydrophobicContact CB-CD1 3.98Å; K562-L598 HydrophobicContact CD-CD1 4.24Å; K562-L598 HydrophobicContact CD-CG 4.48Å; L598-P618 HydrophobicContact CD2-CB 4.24Å; L598-P618 HydrophobicContact CD2-CG 4.15Å; L598-S619 WeakPolarHBondContact O-CB 3.39Å; L598-S619 PolarHBondContact O-OG 3.16Å; L598-L622 HydrophobicContact CD1-CD2 3.88Å
599	T	73.7	Confident	58.6	Low	112 Å²	112	95.2 Å²	95.2	69%	0.687	53%	0.532	S	S	*	.			trans	-79.1	148.4	175.8	51.7	0	0	0	0	112.8	E597 S619	E597-T599 PolarHBondContact O-N 2.84Å; E597-T599 VanDerWaalsContact O-N 3.07Å; T599-S619 VanDerWaalsContact C-CB 3.42Å; T599-S619 WeakPolarHBondContact O-CB 3.36Å
600	C	86.8	Confident	62	Low	37 Å²	37	93.2 Å²	93.2	25%	0.25	51%	0.512	C	S	.	.			trans	-93.6	137.7	170.5	-176.4	0	0	0	0	110.2	H607 C617 S619 C620	C600-H607 PolarHBondContact SG-CE1 3.48Å; C600-H607 PolarHBondContact SG-ND1 3.48Å; C600-H607 VanDerWaalsContact SG-ND1 3.39Å; C600-C617 VanDerWaalsContact SG-SG 3.61Å; C600-S619 PolarHBondContact N-OG 2.97Å; C600-C620 PolarHBondContact SG-SG 3.2Å
601	T	76.8	Confident	65.3	Low	132 Å²	132	90.7 Å²	90.7	81%	0.81	51%	0.505	S	S	*	.			trans	-86.4	-20.1	178.6	46.6	0	0	0	0	114.2
602	A	73.6	Confident	68.4	Low	34 Å²	34	86.6 Å²	86.6	28%	0.281	49%	0.488	S	S	.	.	S	Bend	trans	-86	134.6	178.2	0	0	0	0	0	111.5	S604 G605 H607	A602-S604 PolarHBondContact O-N 2.94Å; A602-G605 PolarHBondContact O-N 3.2Å; A602-H607 WeakPolarHBondContact CB-CE1 3.46Å
603	K	64.3	Low	71.5	Confident	226 Å²	226	83.4 Å²	83.4	98%	0.983	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-25.6	-178.8	-67.5	-175.7	177.5	-178.9	0	114.5
604	S	74.2	Confident	74.5	Confident	84 Å²	84	80.4 Å²	80.4	59%	0.587	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.5	175.8	60.4	0	0	0	0	113.7	A602 E606	A602-S604 PolarHBondContact O-N 2.94Å; S604-E606 PolarHBondContact O-N 2.9Å; S604-E606 PolarHBondContact OG-N 2.87Å
605	G	72.4	Confident	77.7	Confident	21 Å²	21	83.8 Å²	83.8	22%	0.216	46%	0.463	C	S	.	.	S	Bend	trans	67.4	10.5	-169.7	0	0	0	0	0	114.6	A602 C620 K623	A602-G605 PolarHBondContact O-N 3.2Å; G605-C620 PolarHBondContact O-SG 3.1Å; G605-C620 VanDerWaalsContact O-SG 3.32Å; G605-K623 PolarHBondContact O-NZ 3.22Å; G605-K623 VanDerWaalsContact O-NZ 3.14Å
606	E	77.2	Confident	80.4	Confident	124 Å²	124	87 Å²	87	58%	0.579	46%	0.462	S	S	*	.			trans	-140.3	81.3	-169.6	-61.3	-160	144.5	0	0	111.6	S604 K623	S604-E606 PolarHBondContact O-N 2.9Å; S604-E606 PolarHBondContact OG-N 2.87Å; E606-K623 IonicContact OE1-NZ 3.76Å
607	H	86	Confident	82.8	Confident	56 Å²	56	80.2 Å²	80.2	26%	0.259	43%	0.427	S	S	.	.			trans	-78.4	135.5	163.8	-67.1	81.2	0	0	0	109.6	C600 A602 I609 C617 C620	C600-H607 PolarHBondContact SG-CE1 3.48Å; C600-H607 PolarHBondContact SG-ND1 3.48Å; C600-H607 VanDerWaalsContact SG-ND1 3.39Å; A602-H607 WeakPolarHBondContact CB-CE1 3.46Å; H607-I609 HydrophobicContact CB-CD1 4.47Å; H607-C617 HydrophobicContact CB-CB 4.09Å; H607-C617 WeakPolarHBondContact ND1-CB 3.31Å; H607-C620 HydrophobicContact CB-CB 3.93Å; H607-C620 PolarHBondContact N-SG 2.84Å; H607-C620 PolarHBondContact ND1-SG 3.26Å; H607-C620 VanDerWaalsContact ND1-SG 3.43Å
608	V	88.3	Confident	84.4	Confident	116 Å²	116	78.6 Å²	78.6	70%	0.703	42%	0.424	S	S	*	.			trans	-67.8	130.2	171	-178.1	0	0	0	0	109.3	T610 T613	V608-T610 HydrophobicContact CG1-CG2 3.99Å; V608-T613 PolarHBondContact O-OG1 2.96Å
609	I	93.3	Very high	85.3	Confident	23 Å²	23	77.6 Å²	77.6	12%	0.118	42%	0.42	C	S	.	.			trans	-103.8	109.5	-175.2	-53.8	-58.3	0	0	0	110.4	V534 C535 H607 R614 C620 R621 Q624	V534-I609 WeakPolarHBondContact O-CG2 3.44Å; C535-I609 WeakPolarHBondContact CA-O 3.43Å; C535-I609 HydrophobicContact CB-CG2 3.87Å; H607-I609 HydrophobicContact CB-CD1 4.47Å; I609-R614 HydrophobicContact CG2-CB 3.82Å; I609-C620 HydrophobicContact CD1-CB 4.01Å; I609-R621 HydrophobicContact CD1-CB 4.17Å; I609-R621 HydrophobicContact CG2-CG 4.33Å; I609-Q624 HydrophobicContact CB-CG 4.43Å; I609-Q624 HydrophobicContact CG1-CB 4.07Å; I609-Q624 HydrophobicContact CG1-CG 4.32Å
610	T	93.9	Very high	86.2	Confident	43 Å²	43	72.5 Å²	72.5	26%	0.264	39%	0.389	S	S	.	.			trans	-120.9	179.8	-179	80.1	0	0	0	0	110.5	C535 V608 T612 T613 R614	C535-T610 CarbonylContact O-C 3.43Å; C535-T610 VanDerWaalsContact O-C 3.3Å; C535-T610 WeakPolarHBondContact O-CA 3.4Å; V608-T610 HydrophobicContact CG1-CG2 3.99Å; T610-T612 PolarHBondContact O-N 2.99Å; T610-T612 PolarHBondContact OG1-N 3.3Å; T610-T612 PolarHBondContact OG1-OG1 3.37Å; T610-T613 HydrophobicContact CG2-CG2 4.37Å; T610-T613 PolarHBondContact N-OG1 3.39Å; T610-T613 PolarHBondContact OG1-N 2.84Å; T610-T613 VanDerWaalsContact OG1-N 3.11Å; T610-T613 PolarHBondContact OG1-OG1 3.26Å; T610-R614 WeakPolarHBondContact O-CB 3.28Å; T610-R614 WeakPolarHBondContact O-CD 3.4Å; T610-R614 VanDerWaalsContact O-CG 3.23Å; T610-R614 WeakPolarHBondContact O-CG 3.21Å; T610-R614 PolarHBondContact O-N 2.88Å
611	P	94.7	Very high	86.6	Confident	61 Å²	61	71.5 Å²	71.5	40%	0.396	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.6	177.1	-21.6	34.7	0	0	0	113.5	C535 D537 R614	C535-P611 WeakPolarHBondContact O-CD 3.33Å; C535-P611 WeakPolarHBondContact O-CG 3.13Å; C535-P611 VanDerWaalsContact O-N 3.17Å; D537-P611 HydrophobicContact CB-CB 4.12Å; D537-P611 HydrophobicContact CB-CG 4.11Å; P611-R614 PolarHBondContact O-NE 3.45Å; P611-R614 PolarHBondContact O-NH2 2.81Å
612	T	93.1	Very high	87.5	Confident	75 Å²	75	65.6 Å²	65.6	46%	0.46	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-56.8	174.8	50.1	0	0	0	0	111.1	T610 R614	T610-T612 PolarHBondContact O-N 2.99Å; T610-T612 PolarHBondContact OG1-N 3.3Å; T610-T612 PolarHBondContact OG1-OG1 3.37Å; T612-R614 VanDerWaalsContact C-N 3.26Å; T612-R614 PolarHBondContact O-N 3Å; T612-R614 VanDerWaalsContact O-N 3.16Å
613	T	92.6	Very high	88.4	Confident	27 Å²	27	68.7 Å²	68.7	17%	0.166	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-71.1	-14.8	-169.2	67.2	0	0	0	0	114.8	V608 T610 R615 E616	V608-T613 PolarHBondContact O-OG1 2.96Å; T610-T613 HydrophobicContact CG2-CG2 4.37Å; T610-T613 PolarHBondContact N-OG1 3.39Å; T610-T613 PolarHBondContact OG1-N 2.84Å; T610-T613 VanDerWaalsContact OG1-N 3.11Å; T610-T613 PolarHBondContact OG1-OG1 3.26Å; T613-R615 PolarHBondContact O-N 3.19Å; T613-E616 WeakPolarHBondContact CA-OE1 3.2Å; T613-E616 VanDerWaalsContact CB-OE2 3.29Å; T613-E616 WeakPolarHBondContact CB-OE2 3.26Å; T613-E616 WeakPolarHBondContact CG2-OE1 3.15Å; T613-E616 WeakPolarHBondContact O-CB 3.16Å; T613-E616 PolarHBondContact O-N 3.4Å
614	R	92	Very high	89.7	Confident	35 Å²	35	60.2 Å²	60.2	13%	0.132	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-58.8	3.5	176.9	65.6	-175.7	172.1	175.3	-8.5	116.1	C535 D537 C549 S551 I609 T610 P611 T612 R621	C535-R614 HydrophobicContact CB-CB 4.4Å; C535-R614 PolarHBondContact SG-NH1 3.04Å; D537-R614 IonicContact OD2-CZ 3.11Å; D537-R614 IonicContact OD2-NH1 3.12Å; D537-R614 PolarHBondContact OD2-NH1 3.39Å; D537-R614 IonicContact OD2-NH2 2.74Å; D537-R614 PolarHBondContact OD2-NH2 2.93Å; C549-R614 PolarHBondContact SG-NH1 3.2Å; S551-R614 PolarHBondContact OG-NH1 3.38Å; I609-R614 HydrophobicContact CG2-CB 3.82Å; T610-R614 WeakPolarHBondContact O-CB 3.28Å; T610-R614 WeakPolarHBondContact O-CD 3.4Å; T610-R614 VanDerWaalsContact O-CG 3.23Å; T610-R614 WeakPolarHBondContact O-CG 3.21Å; T610-R614 PolarHBondContact O-N 2.88Å; P611-R614 PolarHBondContact O-NE 3.45Å; P611-R614 PolarHBondContact O-NH2 2.81Å; T612-R614 VanDerWaalsContact C-N 3.26Å; T612-R614 PolarHBondContact O-N 3Å; T612-R614 VanDerWaalsContact O-N 3.16Å; R614-R621 WeakPolarHBondContact O-CD 3.14Å; R614-R621 PolarHBondContact O-NH1 3.13Å
615	R	91.9	Very high	90.8	Very high	220 Å²	220	56.2 Å²	56.2	83%	0.83	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-104.4	-22.6	170	-62.4	-173.4	-177	-169.1	2.8	113.3	T613	T613-R615 PolarHBondContact O-N 3.19Å
616	E	89.7	Confident	91.9	Very high	128 Å²	128	56.2 Å²	56.2	60%	0.598	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-49.9	-170.4	-65.9	158.5	-162.5	0	0	112.4	T613	T613-E616 WeakPolarHBondContact CA-OE1 3.2Å; T613-E616 VanDerWaalsContact CB-OE2 3.29Å; T613-E616 WeakPolarHBondContact CB-OE2 3.26Å; T613-E616 WeakPolarHBondContact CG2-OE1 3.15Å; T613-E616 WeakPolarHBondContact O-CB 3.16Å; T613-E616 PolarHBondContact O-N 3.4Å
617	C	93.2	Very high	92.6	Very high	3 Å²	3	57 Å²	57	2%	0.02	28%	0.278	C	S	.	.			trans	-123.5	94.8	178.8	-170.7	0	0	0	0	111.9	C600 H607 S619 C620 R621	C600-C617 VanDerWaalsContact SG-SG 3.61Å; H607-C617 HydrophobicContact CB-CB 4.09Å; H607-C617 WeakPolarHBondContact ND1-CB 3.31Å; C617-S619 PolarHBondContact O-N 2.81Å; C617-C620 HydrophobicContact CB-CB 4.07Å; C617-C620 PolarHBondContact O-N 2.98Å; C617-C620 PolarHBondContact SG-N 2.77Å; C617-C620 VanDerWaalsContact SG-N 3.37Å; C617-R621 PolarHBondContact O-N 2.98Å
618	P	91.7	Very high	92.8	Very high	51 Å²	51	54.7 Å²	54.7	33%	0.331	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-25.1	175.5	25.4	-33.7	0	0	0	112.8	F555 L598 L622	F555-P618 HydrophobicContact CE2-CB 3.83Å; F555-P618 HydrophobicContact CZ-CB 4Å; F555-P618 WeakPolarHBondContact CZ-O 3.46Å; L598-P618 HydrophobicContact CD2-CB 4.24Å; L598-P618 HydrophobicContact CD2-CG 4.15Å; P618-L622 WeakPolarHBondContact O-CB 3.43Å; P618-L622 PolarHBondContact O-N 3.33Å
619	S	91.7	Very high	93	Very high	22 Å²	22	50 Å²	50	15%	0.154	24%	0.244	C	C	.	.	H	α-helix	trans	-62.5	-57.5	171.7	-177.6	0	0	0	0	111.4	L598 T599 C600 C617 R621 L622 K623	L598-S619 WeakPolarHBondContact O-CB 3.39Å; L598-S619 PolarHBondContact O-OG 3.16Å; T599-S619 VanDerWaalsContact C-CB 3.42Å; T599-S619 WeakPolarHBondContact O-CB 3.36Å; C600-S619 PolarHBondContact N-OG 2.97Å; C617-S619 PolarHBondContact O-N 2.81Å; S619-R621 VanDerWaalsContact C-N 3.29Å; S619-R621 PolarHBondContact O-N 3.47Å; S619-L622 PolarHBondContact O-N 3.08Å; S619-L622 VanDerWaalsContact O-N 3.15Å; S619-K623 WeakPolarHBondContact O-CB 3.28Å; S619-K623 PolarHBondContact O-N 2.88Å
620	C	93.6	Very high	93.1	Very high	5 Å²	5	49 Å²	49	3%	0.034	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-34.9	177.3	-65.5	0	0	0	0	112.1	C600 G605 H607 I609 C617 K623 Q624	C600-C620 PolarHBondContact SG-SG 3.2Å; G605-C620 PolarHBondContact O-SG 3.1Å; G605-C620 VanDerWaalsContact O-SG 3.32Å; H607-C620 HydrophobicContact CB-CB 3.93Å; H607-C620 PolarHBondContact N-SG 2.84Å; H607-C620 PolarHBondContact ND1-SG 3.26Å; H607-C620 VanDerWaalsContact ND1-SG 3.43Å; I609-C620 HydrophobicContact CD1-CB 4.01Å; C617-C620 HydrophobicContact CB-CB 4.07Å; C617-C620 PolarHBondContact O-N 2.98Å; C617-C620 PolarHBondContact SG-N 2.77Å; C617-C620 VanDerWaalsContact SG-N 3.37Å; C620-K623 WeakPolarHBondContact O-CB 3.1Å; C620-K623 PolarHBondContact O-N 3.09Å; C620-Q624 WeakPolarHBondContact O-CB 3.37Å; C620-Q624 PolarHBondContact O-N 3.35Å
621	R	94.4	Very high	92.8	Very high	16 Å²	16	51.2 Å²	51.2	6%	0.06	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-42.4	173.6	-173.6	176.5	-174.9	175.8	-0.2	112.7	V534 S551 C552 F555 I609 R614 C617 S619 Q624 C625	V534-R621 HydrophobicContact CG1-CG 4.46Å; S551-R621 VanDerWaalsContact C-NH2 3.27Å; S551-R621 PolarHBondContact O-NH2 3.15Å; S551-R621 VanDerWaalsContact O-NH2 3.16Å; S551-R621 PolarHBondContact OG-NH2 3.42Å; C552-R621 PolarHBondContact SG-NH2 3.14Å; F555-R621 HydrophobicContact CD1-CG 3.86Å; F555-R621 HydrophobicContact CE1-CB 4.04Å; F555-R621 HydrophobicContact CE1-CG 3.72Å; F555-R621 HydrophobicContact CG-CG 4.46Å; F555-R621 HydrophobicContact CZ-CB 4.15Å; F555-R621 HydrophobicContact CZ-CG 4.21Å; I609-R621 HydrophobicContact CD1-CB 4.17Å; I609-R621 HydrophobicContact CG2-CG 4.33Å; R614-R621 WeakPolarHBondContact O-CD 3.14Å; R614-R621 PolarHBondContact O-NH1 3.13Å; C617-R621 PolarHBondContact O-N 2.98Å; S619-R621 VanDerWaalsContact C-N 3.29Å; S619-R621 PolarHBondContact O-N 3.47Å; R621-Q624 CarbonylContact O-C 3.3Å; R621-Q624 PolarHBondContact O-N 3.36Å; R621-C625 PolarHBondContact O-N 3.05Å; R621-C625 PolarHBondContact O-SG 3.21Å; R621-C625 VanDerWaalsContact O-SG 3.38Å
622	L	95.2	Very high	92.5	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-67.5	-42.1	176.5	-177.8	62.5	0	0	0	111.2	F555 F556 N559 L598 P618 S619 Q624 C625 F626	F555-L622 HydrophobicContact CE1-CB 3.91Å; F555-L622 HydrophobicContact CE1-CD1 4.31Å; F555-L622 HydrophobicContact CZ-CB 4.12Å; F556-L622 HydrophobicContact CD2-CD1 4.19Å; N559-L622 HydrophobicContact CB-CD1 4.17Å; N559-L622 HydrophobicContact CB-CD2 4.22Å; N559-L622 VanDerWaalsContact O-CD2 3.29Å; N559-L622 WeakPolarHBondContact O-CD2 3.03Å; L598-L622 HydrophobicContact CD1-CD2 3.88Å; P618-L622 WeakPolarHBondContact O-CB 3.43Å; P618-L622 PolarHBondContact O-N 3.33Å; S619-L622 PolarHBondContact O-N 3.08Å; S619-L622 VanDerWaalsContact O-N 3.15Å; L622-Q624 VanDerWaalsContact C-N 3.27Å; L622-Q624 PolarHBondContact O-N 2.92Å; L622-C625 WeakPolarHBondContact O-CB 3.42Å; L622-C625 PolarHBondContact O-N 2.94Å; L622-F626 HydrophobicContact CD1-CD2 4.24Å; L622-F626 HydrophobicContact CD1-CE2 3.73Å; L622-F626 HydrophobicContact CD1-CZ 4.33Å; L622-F626 HydrophobicContact CD2-CE2 4.24Å; L622-F626 HydrophobicContact CG-CD2 4.13Å; L622-F626 HydrophobicContact CG-CE2 3.77Å; L622-F626 VanDerWaalsContact O-CD2 3.31Å; L622-F626 WeakPolarHBondContact O-CD2 3.49Å; L622-F626 PolarHBondContact O-N 2.86Å; L622-F626 VanDerWaalsContact O-N 3.11Å
623	K	92.2	Very high	92	Very high	99 Å²	99	45.4 Å²	45.4	43%	0.43	21%	0.205	S	C	.	.	H	α-helix	trans	-52.3	-48.8	170.7	-154.4	-174.4	-175.2	-161.4	0	109.5	G605 E606 S619 C620 F626 R627	G605-K623 PolarHBondContact O-NZ 3.22Å; G605-K623 VanDerWaalsContact O-NZ 3.14Å; E606-K623 IonicContact OE1-NZ 3.76Å; S619-K623 WeakPolarHBondContact O-CB 3.28Å; S619-K623 PolarHBondContact O-N 2.88Å; C620-K623 WeakPolarHBondContact O-CB 3.1Å; C620-K623 PolarHBondContact O-N 3.09Å; K623-F626 PolarHBondContact O-N 3.5Å; K623-R627 VanDerWaalsContact O-CB 3.28Å; K623-R627 WeakPolarHBondContact O-CB 3.45Å; K623-R627 PolarHBondContact O-N 3.06Å
624	Q	93.5	Very high	91.7	Very high	48 Å²	48	47.1 Å²	47.1	22%	0.224	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-31.6	178.1	-172	62.6	11.4	0	0	114.3	V534 I609 C620 R621 L622 R627 V628	V534-Q624 HydrophobicContact CG1-CG 4.32Å; I609-Q624 HydrophobicContact CB-CG 4.43Å; I609-Q624 HydrophobicContact CG1-CB 4.07Å; I609-Q624 HydrophobicContact CG1-CG 4.32Å; C620-Q624 WeakPolarHBondContact O-CB 3.37Å; C620-Q624 PolarHBondContact O-N 3.35Å; R621-Q624 CarbonylContact O-C 3.3Å; R621-Q624 PolarHBondContact O-N 3.36Å; L622-Q624 VanDerWaalsContact C-N 3.27Å; L622-Q624 PolarHBondContact O-N 2.92Å; Q624-R627 CarbonylContact O-C 2.94Å; Q624-R627 VanDerWaalsContact O-C 3.3Å; Q624-R627 WeakPolarHBondContact O-CA 3.25Å; Q624-R627 PolarHBondContact O-N 3.26Å; Q624-V628 PolarHBondContact O-N 3.02Å
625	C	96.2	Very high	91.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-48.1	171.1	-75.4	0	0	0	0	111.1	F556 R621 L622 R627 V628 M630	F556-C625 HydrophobicContact CD2-CB 3.52Å; F556-C625 HydrophobicContact CE2-CB 4.05Å; F556-C625 HydrophobicContact CG-CB 4.42Å; R621-C625 PolarHBondContact O-N 3.05Å; R621-C625 PolarHBondContact O-SG 3.21Å; R621-C625 VanDerWaalsContact O-SG 3.38Å; L622-C625 WeakPolarHBondContact O-CB 3.42Å; L622-C625 PolarHBondContact O-N 2.94Å; C625-R627 VanDerWaalsContact C-N 3.32Å; C625-V628 WeakPolarHBondContact O-CG2 3.16Å; C625-V628 PolarHBondContact O-N 2.99Å; C625-M630 HydrophobicContact CB-CB 4.38Å; C625-M630 HydrophobicContact CB-CG 4.32Å; C625-M630 HydrophobicContact CB-SD 3.73Å; C625-M630 VanDerWaalsContact O-CB 3.25Å; C625-M630 WeakPolarHBondContact O-CB 3.11Å; C625-M630 WeakPolarHBondContact O-CG 3.48Å; C625-M630 PolarHBondContact O-N 3.43Å; C625-M630 VanDerWaalsContact SG-SD 3.65Å
626	F	94.6	Very high	90.5	Very high	20 Å²	20	40.1 Å²	40.1	9%	0.088	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-39.4	170.6	-66.2	-59.8	0	0	0	111.1	F556 A560 L622 K623 V628 G629 P632 H658	F556-F626 AromaticContact CE2-CD1 3.94Å; F556-F626 HydrophobicContact CE2-CD1 3.94Å; F556-F626 AromaticContact CE2-CE1 3.63Å; F556-F626 HydrophobicContact CE2-CE1 3.63Å; F556-F626 HydrophobicContact CE2-CZ 4.02Å; F556-F626 HydrophobicContact CZ-CD1 4.33Å; F556-F626 AromaticContact CZ-CE1 3.88Å; F556-F626 HydrophobicContact CZ-CE1 3.88Å; A560-F626 HydrophobicContact CB-CZ 4.27Å; L622-F626 HydrophobicContact CD1-CD2 4.24Å; L622-F626 HydrophobicContact CD1-CE2 3.73Å; L622-F626 HydrophobicContact CD1-CZ 4.33Å; L622-F626 HydrophobicContact CD2-CE2 4.24Å; L622-F626 HydrophobicContact CG-CD2 4.13Å; L622-F626 HydrophobicContact CG-CE2 3.77Å; L622-F626 VanDerWaalsContact O-CD2 3.31Å; L622-F626 WeakPolarHBondContact O-CD2 3.49Å; L622-F626 PolarHBondContact O-N 2.86Å; L622-F626 VanDerWaalsContact O-N 3.11Å; K623-F626 PolarHBondContact O-N 3.5Å; F626-V628 PolarHBondContact O-N 2.9Å; F626-G629 PolarHBondContact O-N 2.92Å; F626-P632 HydrophobicContact CE1-CB 4.22Å; F626-P632 HydrophobicContact CE1-CG 4.07Å; F626-H658 PolarHBondContact O-ND1 2.96Å
627	R	92.2	Very high	89.3	Confident	140 Å²	140	36.6 Å²	36.6	53%	0.528	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	12.2	178.4	-140.3	-165	100.3	157.5	9.9	115.8	K623 Q624 C625 H658	K623-R627 VanDerWaalsContact O-CB 3.28Å; K623-R627 WeakPolarHBondContact O-CB 3.45Å; K623-R627 PolarHBondContact O-N 3.06Å; Q624-R627 CarbonylContact O-C 2.94Å; Q624-R627 VanDerWaalsContact O-C 3.3Å; Q624-R627 WeakPolarHBondContact O-CA 3.25Å; Q624-R627 PolarHBondContact O-N 3.26Å; C625-R627 VanDerWaalsContact C-N 3.32Å; R627-H658 WeakPolarHBondContact CA-CE1 3.39Å; R627-H658 VanDerWaalsContact CA-NE2 3.32Å; R627-H658 WeakPolarHBondContact CA-NE2 3.5Å; R627-H658 VanDerWaalsContact CG-NE2 3.25Å; R627-H658 WeakPolarHBondContact CG-NE2 3.39Å; R627-H658 PolarHBondContact O-CE1 3.36Å; R627-H658 PolarHBondContact O-NE2 3.4Å
628	V	91.3	Very high	87.2	Confident	9 Å²	9	46.4 Å²	46.4	6%	0.055	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.5	7.5	162.7	-56	0	0	0	0	112.7	K533 V534 Q546 Q624 C625 F626 M630	K533-V628 HydrophobicContact CB-CB 3.98Å; K533-V628 HydrophobicContact CB-CG1 4.03Å; K533-V628 HydrophobicContact CB-CG2 4.23Å; V534-V628 HydrophobicContact CG2-CG2 3.55Å; Q546-V628 WeakPolarHBondContact CG-O 3.4Å; Q546-V628 PolarHBondContact NE2-O 2.92Å; Q624-V628 PolarHBondContact O-N 3.02Å; C625-V628 WeakPolarHBondContact O-CG2 3.16Å; C625-V628 PolarHBondContact O-N 2.99Å; F626-V628 PolarHBondContact O-N 2.9Å; V628-M630 HydrophobicContact CG2-CG 4.03Å
629	G	91.9	Very high	85.1	Confident	18 Å²	18	48.5 Å²	48.5	19%	0.186	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	26.5	178.2	0	0	0	0	0	115	Q546 F626 R631	Q546-G629 VanDerWaalsContact CG-C 3.5Å; Q546-G629 WeakPolarHBondContact CG-O 3.37Å; F626-G629 PolarHBondContact O-N 2.92Å; G629-R631 PolarHBondContact O-N 3.44Å
630	M	95.4	Very high	83.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	26%	0.258	C	S	.	.			trans	-67.8	121.9	170.3	-63.8	-169.9	75.7	0	0	110.2	V534 F544 Q546 T548 F556 C625 V628	V534-M630 HydrophobicContact CG2-CG 4.42Å; V534-M630 HydrophobicContact CG2-SD 3.64Å; F544-M630 HydrophobicContact CB-CB 4.49Å; F544-M630 HydrophobicContact CB-CE 4.09Å; F544-M630 HydrophobicContact CD2-CE 3.69Å; F544-M630 HydrophobicContact CG-CE 4.34Å; F544-M630 CarbonylContact O-C 3.56Å; F544-M630 WeakPolarHBondContact O-CA 3.45Å; Q546-M630 HydrophobicContact CB-CG 4.12Å; Q546-M630 HydrophobicContact CG-CG 4.4Å; T548-M630 HydrophobicContact CG2-CE 4.07Å; T548-M630 HydrophobicContact CG2-SD 4.03Å; F556-M630 HydrophobicContact CB-CE 3.66Å; F556-M630 HydrophobicContact CB-SD 4.09Å; F556-M630 HydrophobicContact CD1-CB 4.11Å; F556-M630 HydrophobicContact CD1-CE 3.85Å; F556-M630 HydrophobicContact CD2-CB 3.99Å; F556-M630 HydrophobicContact CD2-SD 4.27Å; F556-M630 HydrophobicContact CE1-CB 3.86Å; F556-M630 HydrophobicContact CE2-CB 3.72Å; F556-M630 HydrophobicContact CG-CB 4.17Å; F556-M630 HydrophobicContact CG-CE 3.76Å; F556-M630 HydrophobicContact CG-SD 4.07Å; F556-M630 HydrophobicContact CZ-CB 3.65Å; F556-M630 WeakPolarHBondContact CZ-O 3.45Å; C625-M630 HydrophobicContact CB-CB 4.38Å; C625-M630 HydrophobicContact CB-CG 4.32Å; C625-M630 HydrophobicContact CB-SD 3.73Å; C625-M630 VanDerWaalsContact O-CB 3.25Å; C625-M630 WeakPolarHBondContact O-CB 3.11Å; C625-M630 WeakPolarHBondContact O-CG 3.48Å; C625-M630 PolarHBondContact O-N 3.43Å; C625-M630 VanDerWaalsContact SG-SD 3.65Å; V628-M630 HydrophobicContact CG2-CG 4.03Å
631	R	88.5	Confident	81.5	Confident	90 Å²	90	62.8 Å²	62.8	34%	0.34	28%	0.282	S	S	.	.			trans	-90.9	113	-170.5	-84.8	-178.9	64.5	152.8	-4.3	112.7	F544 G629 D633 L634	F544-R631 PolarHBondContact O-N 3.11Å; G629-R631 PolarHBondContact O-N 3.44Å; R631-D633 VanDerWaalsContact C-N 3.32Å; R631-D633 VanDerWaalsContact CB-OD1 3.25Å; R631-D633 WeakPolarHBondContact CB-OD1 3.32Å; R631-D633 IonicContact CZ-OD2 2.67Å; R631-D633 VanDerWaalsContact CZ-OD2 3.23Å; R631-D633 IonicContact NE-OD1 3.31Å; R631-D633 IonicContact NE-OD2 2.69Å; R631-D633 PolarHBondContact NE-OD2 2.69Å; R631-D633 IonicContact NH2-OD2 2.77Å; R631-D633 PolarHBondContact NH2-OD2 3.17Å; R631-L634 HydrophobicContact CB-CD1 3.95Å; R631-L634 HydrophobicContact CB-CG 4.06Å; R631-L634 PolarHBondContact O-N 3.23Å
632	P	87.5	Confident	79	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.013	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-75.9	-20	-176	33.6	-37.5	0	0	0	113.6	F556 A560 F626 L634 I635 P652	F556-P632 HydrophobicContact CE1-CB 4.49Å; F556-P632 HydrophobicContact CZ-CB 4.03Å; A560-P632 HydrophobicContact CB-CB 4.06Å; F626-P632 HydrophobicContact CE1-CB 4.22Å; F626-P632 HydrophobicContact CE1-CG 4.07Å; P632-L634 VanDerWaalsContact C-N 3.26Å; P632-L634 PolarHBondContact O-N 3.06Å; P632-I635 WeakPolarHBondContact O-CB 3.25Å; P632-I635 PolarHBondContact O-N 2.75Å; P632-I635 VanDerWaalsContact O-N 3.1Å; P632-P652 VanDerWaalsContact CG-CD 3.45Å; P632-P652 HydrophobicContact CG-CG 3.89Å
633	D	82.4	Confident	77.1	Confident	13 Å²	13	67.6 Å²	67.6	7%	0.07	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-57.8	-35.2	168.4	48	-66.3	0	0	0	112.6	R631 I635 L648 V651	R631-D633 VanDerWaalsContact C-N 3.32Å; R631-D633 VanDerWaalsContact CB-OD1 3.25Å; R631-D633 WeakPolarHBondContact CB-OD1 3.32Å; R631-D633 IonicContact CZ-OD2 2.67Å; R631-D633 VanDerWaalsContact CZ-OD2 3.23Å; R631-D633 IonicContact NE-OD1 3.31Å; R631-D633 IonicContact NE-OD2 2.69Å; R631-D633 PolarHBondContact NE-OD2 2.69Å; R631-D633 IonicContact NH2-OD2 2.77Å; R631-D633 PolarHBondContact NH2-OD2 3.17Å; D633-I635 PolarHBondContact O-N 3.33Å; D633-L648 WeakPolarHBondContact CA-O 3.19Å; D633-L648 WeakPolarHBondContact CB-O 3.2Å; D633-L648 PolarHBondContact O-N 3.3Å; D633-L648 VanDerWaalsContact O-N 3.15Å; D633-V651 HydrophobicContact CB-CG2 4.02Å
634	L	87.5	Confident	74.7	Confident	63 Å²	63	71.8 Å²	71.8	33%	0.33	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-75.7	7.2	174	-60.1	179.3	0	0	0	113.6	F544 R631 P632 W647	F544-L634 HydrophobicContact CD1-CB 4.03Å; F544-L634 WeakPolarHBondContact CD1-O 3.49Å; F544-L634 WeakPolarHBondContact CE1-O 3.47Å; R631-L634 HydrophobicContact CB-CD1 3.95Å; R631-L634 HydrophobicContact CB-CG 4.06Å; R631-L634 PolarHBondContact O-N 3.23Å; P632-L634 VanDerWaalsContact C-N 3.26Å; P632-L634 PolarHBondContact O-N 3.06Å; L634-W647 HydrophobicContact CD2-CZ3 4.36Å
635	I	86.5	Confident	72.4	Confident	9 Å²	9	72.2 Å²	72.2	5%	0.046	36%	0.356	C	S	.	.	S	Bend	trans	-94.7	107.7	166.3	-57.3	164.8	0	0	0	108.2	F544 F556 R557 A560 P632 D633 V637	F544-I635 HydrophobicContact CD1-CG1 3.74Å; F544-I635 HydrophobicContact CE1-CB 4.35Å; F544-I635 HydrophobicContact CE1-CG1 3.49Å; F544-I635 VanDerWaalsContact CE1-CG1 3.49Å; F544-I635 HydrophobicContact CZ-CG1 4.21Å; F556-I635 HydrophobicContact CD1-CD1 3.96Å; F556-I635 HydrophobicContact CD1-CG1 4.48Å; F556-I635 HydrophobicContact CE1-CD1 3.81Å; F556-I635 HydrophobicContact CE1-CG1 4.32Å; R557-I635 HydrophobicContact CG-CG2 4.21Å; A560-I635 HydrophobicContact CB-CD1 3.38Å; P632-I635 WeakPolarHBondContact O-CB 3.25Å; P632-I635 PolarHBondContact O-N 2.75Å; P632-I635 VanDerWaalsContact O-N 3.1Å; D633-I635 PolarHBondContact O-N 3.33Å; I635-V637 PolarHBondContact O-N 3.32Å
636	Q	70.9	Confident	69.9	Low	99 Å²	99	79.3 Å²	79.3	46%	0.463	38%	0.382	S	S	.	.			trans	-56.4	120.8	171.3	-73.5	-179	-9.2	0	0	111	R638 P645 W647	Q636-R638 PolarHBondContact O-N 2.84Å; Q636-P645 HydrophobicContact CB-CB 4.28Å; Q636-W647 HydrophobicContact CG-CD2 4.26Å; Q636-W647 HydrophobicContact CG-CE3 3.92Å; Q636-W647 HydrophobicContact CG-CH2 4.07Å; Q636-W647 HydrophobicContact CG-CZ2 4.37Å; Q636-W647 HydrophobicContact CG-CZ3 3.83Å
637	V	64.2	Low	67.9	Low	54 Å²	54	84.8 Å²	84.8	33%	0.327	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-90.2	105.5	172.7	-176.1	0	0	0	0	108.2	I635 K639 R646 L648	I635-V637 PolarHBondContact O-N 3.32Å; V637-K639 PolarHBondContact O-N 3Å; V637-R646 PolarHBondContact N-O 3.23Å; V637-R646 PolarHBondContact O-N 3.45Å; V637-L648 HydrophobicContact CG2-CB 4.12Å; V637-L648 HydrophobicContact CG2-CD1 3.65Å; V637-L648 HydrophobicContact CG2-CG 3.7Å
638	R	51	Low	65.9	Low	208 Å²	208	80 Å²	80	79%	0.785	39%	0.387	S	S	*	.			trans	-69.1	113.9	162.3	-66	-175.8	-173.3	178.6	0.1	107.9	Q636 P645	Q636-R638 PolarHBondContact O-N 2.84Å; R638-P645 HydrophobicContact CG-CB 4.34Å
639	K	46.9	Very low	63.7	Low	95 Å²	95	84.4 Å²	84.4	41%	0.413	41%	0.41	S	S	.	.			trans	-69.2	152.4	170.2	-67.6	155	93	-104.5	0	108.4	V637 D641 S643	V637-K639 PolarHBondContact O-N 3Å; K639-D641 WeakPolarHBondContact CB-OD1 3.43Å; K639-D641 IonicContact NZ-OD1 2.72Å; K639-D641 IonicContact NZ-OD2 2.66Å; K639-D641 PolarHBondContact NZ-OD2 3.47Å; K639-D641 PolarHBondContact O-N 3.29Å; K639-S643 PolarHBondContact NZ-OG 2.97Å
640	K	54.3	Low	61.5	Low	226 Å²	226	87.4 Å²	87.4	98%	0.983	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-13	177.6	-73.7	-171.2	174.8	-173.7	0	113.4	G642	K640-G642 VanDerWaalsContact C-N 3.31Å
641	D	54.5	Low	59	Low	101 Å²	101	89.7 Å²	89.7	54%	0.54	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	2.5	-177.6	57.2	30.6	0	0	0	114.3	K639 S643	K639-D641 WeakPolarHBondContact CB-OD1 3.43Å; K639-D641 IonicContact NZ-OD1 2.72Å; K639-D641 IonicContact NZ-OD2 2.66Å; K639-D641 PolarHBondContact NZ-OD2 3.47Å; K639-D641 PolarHBondContact O-N 3.29Å; D641-S643 PolarHBondContact O-N 3.43Å; D641-S643 VanDerWaalsContact O-N 3.16Å; D641-S643 VanDerWaalsContact OD1-CB 3.27Å; D641-S643 WeakPolarHBondContact OD1-CB 3.37Å; D641-S643 PolarHBondContact OD1-N 2.98Å; D641-S643 PolarHBondContact OD1-OG 3.11Å
642	G	43.4	Very low	56.9	Low	73 Å²	73	86 Å²	86	75%	0.753	42%	0.42	S	S	*	.			trans	74.3	-5.6	-179.3	0	0	0	0	0	115.3	K640	K640-G642 VanDerWaalsContact C-N 3.31Å
643	S	53.9	Low	54.4	Low	52 Å²	52	93.7 Å²	93.7	36%	0.364	45%	0.449	S	S	.	.			trans	-65.5	154.5	177.8	66.2	0	0	0	0	112.2	K639 D641	K639-S643 PolarHBondContact NZ-OG 2.97Å; D641-S643 PolarHBondContact O-N 3.43Å; D641-S643 VanDerWaalsContact O-N 3.16Å; D641-S643 VanDerWaalsContact OD1-CB 3.27Å; D641-S643 WeakPolarHBondContact OD1-CB 3.37Å; D641-S643 PolarHBondContact OD1-N 2.98Å; D641-S643 PolarHBondContact OD1-OG 3.11Å
644	K	42.7	Very low	52.3	Low	188 Å²	188	94.3 Å²	94.3	82%	0.817	46%	0.455	S	S	*	.			trans	-45.9	133.4	-176	-90.3	-178.9	176.3	173	0	111.3	R646	K644-R646 PolarHBondContact O-N 3.11Å; K644-R646 VanDerWaalsContact O-N 3.08Å
645	P	43.9	Very low	49.9	Very low	57 Å²	57	91.9 Å²	91.9	37%	0.37	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-62	116.2	-175	25.1	-33.9	0	0	0	110.4	Q636 R638	Q636-P645 HydrophobicContact CB-CB 4.28Å; R638-P645 HydrophobicContact CG-CB 4.34Å
646	R	44.9	Very low	47.9	Very low	149 Å²	149	95.1 Å²	95.1	56%	0.562	46%	0.461	S	S	*	.	B	Isolated β-bridge	trans	-78.3	141.5	173.4	-128.7	174.5	-158.9	-125.5	0.7	108.8	V637 K644 D649	V637-R646 PolarHBondContact N-O 3.23Å; V637-R646 PolarHBondContact O-N 3.45Å; K644-R646 PolarHBondContact O-N 3.11Å; K644-R646 VanDerWaalsContact O-N 3.08Å; R646-D649 IonicContact CZ-OD1 2.74Å; R646-D649 IonicContact CZ-OD2 3.17Å; R646-D649 IonicContact NH1-OD1 2.77Å; R646-D649 PolarHBondContact NH1-OD1 3.04Å; R646-D649 VanDerWaalsContact NH1-OD1 3.16Å; R646-D649 IonicContact NH1-OD2 2.64Å; R646-D649 PolarHBondContact NH1-OD2 3.32Å
647	W	51.9	Low	46.7	Very low	135 Å²	135	92.9 Å²	92.9	51%	0.511	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-60	156.4	160.5	-59.9	99.8	0	0	0	108.6	L634 Q636 D649	L634-W647 HydrophobicContact CD2-CZ3 4.36Å; Q636-W647 HydrophobicContact CG-CD2 4.26Å; Q636-W647 HydrophobicContact CG-CE3 3.92Å; Q636-W647 HydrophobicContact CG-CH2 4.07Å; Q636-W647 HydrophobicContact CG-CZ2 4.37Å; Q636-W647 HydrophobicContact CG-CZ3 3.83Å; W647-D649 VanDerWaalsContact C-N 3.34Å; W647-D649 PolarHBondContact O-N 3.46Å
648	L	51.3	Low	45.7	Very low	39 Å²	39	91.5 Å²	91.5	20%	0.204	44%	0.444	C	S	.	.			trans	-75.6	94.6	-179.5	-142	157.9	0	0	0	107.4	H561 D633 V637 K650	H561-L648 VanDerWaalsContact CE1-CD1 3.41Å; H561-L648 WeakPolarHBondContact CE1-CD1 3.36Å; H561-L648 VanDerWaalsContact ND1-CD1 3.31Å; H561-L648 WeakPolarHBondContact ND1-CD1 3.34Å; D633-L648 WeakPolarHBondContact CA-O 3.19Å; D633-L648 WeakPolarHBondContact CB-O 3.2Å; D633-L648 PolarHBondContact O-N 3.3Å; D633-L648 VanDerWaalsContact O-N 3.15Å; V637-L648 HydrophobicContact CG2-CB 4.12Å; V637-L648 HydrophobicContact CG2-CD1 3.65Å; V637-L648 HydrophobicContact CG2-CG 3.7Å; L648-K650 PolarHBondContact O-N 3.01Å
649	D	45.4	Very low	45.2	Very low	101 Å²	101	85.4 Å²	85.4	54%	0.54	42%	0.424	S	S	.	.	S	Bend	trans	-49.2	-7.6	-169.3	-62.2	-38.8	0	0	0	115.9	R646 W647	R646-D649 IonicContact CZ-OD1 2.74Å; R646-D649 IonicContact CZ-OD2 3.17Å; R646-D649 IonicContact NH1-OD1 2.77Å; R646-D649 PolarHBondContact NH1-OD1 3.04Å; R646-D649 VanDerWaalsContact NH1-OD1 3.16Å; R646-D649 IonicContact NH1-OD2 2.64Å; R646-D649 PolarHBondContact NH1-OD2 3.32Å; W647-D649 VanDerWaalsContact C-N 3.34Å; W647-D649 PolarHBondContact O-N 3.46Å
650	K	44.3	Very low	45.2	Very low	82 Å²	82	86.1 Å²	86.1	36%	0.357	43%	0.429	S	S	.	.			trans	-140.1	96.1	-166.8	-63.6	-174	174	149.3	0	111.2	L648 P652 K1565	L648-K650 PolarHBondContact O-N 3.01Å; K650-P652 WeakPolarHBondContact O-CD 3.49Å; K650-K1565 WeakPolarHBondContact CD-O 3.47Å; K650-K1565 WeakPolarHBondContact CE-O 3.33Å; K650-K1565 PolarHBondContact NZ-O 2.97Å
651	V	43.9	Very low	44.9	Very low	47 Å²	47	80.7 Å²	80.7	29%	0.285	41%	0.407	S	S	.	.			trans	-54.8	123.4	163.1	-175	0	0	0	0	108.3	D633 A655 I656	D633-V651 HydrophobicContact CB-CG2 4.02Å; V651-A655 HydrophobicContact CG1-CB 3.86Å; V651-I656 HydrophobicContact CB-CG1 4.48Å; V651-I656 HydrophobicContact CG1-CD1 4.41Å; V651-I656 HydrophobicContact CG1-CG1 3.78Å
652	P	43.5	Very low	44.3	Very low	13 Å²	13	77 Å²	77	8%	0.084	39%	0.387	C	S	.	.			trans	-64.8	138.5	174.7	-19	31.5	0	0	0	110	L564 P632 K650 A654 A655	L564-P652 HydrophobicContact CD1-CG 3.88Å; L564-P652 HydrophobicContact CD2-CG 4.04Å; L564-P652 HydrophobicContact CG-CB 4.38Å; L564-P652 HydrophobicContact CG-CG 3.87Å; P632-P652 VanDerWaalsContact CG-CD 3.45Å; P632-P652 HydrophobicContact CG-CG 3.89Å; K650-P652 WeakPolarHBondContact O-CD 3.49Å; P652-A654 PolarHBondContact O-N 2.73Å; P652-A655 WeakPolarHBondContact O-CB 3.41Å; P652-A655 PolarHBondContact O-N 2.75Å
653	R	36.3	Very low	44.2	Very low	164 Å²	164	79.8 Å²	79.8	62%	0.619	38%	0.38	S	S	*	.	H	α-helix	trans	-48.4	-29.5	173.9	-99.8	-176.5	173.9	178.1	-2	113.3	A655 I656 V657	R653-A655 VanDerWaalsContact C-N 3.31Å; R653-A655 PolarHBondContact O-N 3.38Å; R653-I656 PolarHBondContact O-N 2.89Å; R653-V657 WeakPolarHBondContact O-CG2 3.46Å; R653-V657 PolarHBondContact O-N 3.23Å; R653-V657 VanDerWaalsContact O-N 3.09Å
654	A	36.6	Very low	43.5	Very low	25 Å²	25	79.8 Å²	79.8	21%	0.207	38%	0.381	C	S	.	.	H	α-helix	trans	-61.6	-31.6	174.8	0	0	0	0	0	114.4	L567 P652 H658	L567-A654 HydrophobicContact CB-CB 4.25Å; L567-A654 HydrophobicContact CD1-CB 4.33Å; P652-A654 PolarHBondContact O-N 2.73Å; A654-H658 WeakPolarHBondContact O-CB 3.4Å; A654-H658 PolarHBondContact O-N 3.46Å
655	A	37.4	Very low	43.2	Very low	12 Å²	12	73.2 Å²	73.2	10%	0.099	36%	0.358	C	S	.	.	H	α-helix	trans	-77.5	-41.4	174.8	0	0	0	0	0	111.5	V651 P652 R653 V657 H658 E659	V651-A655 HydrophobicContact CG1-CB 3.86Å; P652-A655 WeakPolarHBondContact O-CB 3.41Å; P652-A655 PolarHBondContact O-N 2.75Å; R653-A655 VanDerWaalsContact C-N 3.31Å; R653-A655 PolarHBondContact O-N 3.38Å; A655-V657 PolarHBondContact O-N 3.35Å; A655-H658 CarbonylContact O-C 3.55Å; A655-H658 WeakPolarHBondContact O-CA 3.31Å; A655-H658 WeakPolarHBondContact O-CB 3.5Å; A655-H658 PolarHBondContact O-N 3.34Å; A655-E659 PolarHBondContact O-N 3.46Å
656	I	45.4	Very low	42.7	Very low	78 Å²	78	73.6 Å²	73.6	40%	0.4	36%	0.355	S	S	.	.	H	α-helix	trans	-58.9	-49.4	177.8	-56.5	175.9	0	0	0	111	V651 R653 H658 E659 Q660	V651-I656 HydrophobicContact CB-CG1 4.48Å; V651-I656 HydrophobicContact CG1-CD1 4.41Å; V651-I656 HydrophobicContact CG1-CG1 3.78Å; R653-I656 PolarHBondContact O-N 2.89Å; I656-H658 PolarHBondContact O-N 3.18Å; I656-E659 WeakPolarHBondContact O-CB 3.14Å; I656-E659 PolarHBondContact O-N 2.74Å; I656-E659 VanDerWaalsContact O-N 3.1Å; I656-Q660 PolarHBondContact O-N 2.82Å; I656-Q660 VanDerWaalsContact O-N 3.15Å
657	V	46.1	Very low	42.2	Very low	52 Å²	52	69.5 Å²	69.5	32%	0.315	35%	0.349	S	S	.	.	H	α-helix	trans	-69.7	-18.1	176.8	-174.3	0	0	0	0	111.8	R571 R653 A655 H661	R571-V657 VanDerWaalsContact NH2-CG1 3.29Å; R653-V657 WeakPolarHBondContact O-CG2 3.46Å; R653-V657 PolarHBondContact O-N 3.23Å; R653-V657 VanDerWaalsContact O-N 3.09Å; A655-V657 PolarHBondContact O-N 3.35Å; V657-H661 WeakPolarHBondContact O-CB 3.3Å; V657-H661 PolarHBondContact O-N 2.79Å
658	H	43.2	Very low	41.4	Very low	24 Å²	24	68.4 Å²	68.4	11%	0.111	35%	0.353	C	S	.	.	H	α-helix	trans	-81.2	-30.6	170.5	-164.8	-89.6	0	0	0	112.9	F626 R627 A654 A655 I656 H661 L662	F626-H658 PolarHBondContact O-ND1 2.96Å; R627-H658 WeakPolarHBondContact CA-CE1 3.39Å; R627-H658 VanDerWaalsContact CA-NE2 3.32Å; R627-H658 WeakPolarHBondContact CA-NE2 3.5Å; R627-H658 VanDerWaalsContact CG-NE2 3.25Å; R627-H658 WeakPolarHBondContact CG-NE2 3.39Å; R627-H658 PolarHBondContact O-CE1 3.36Å; R627-H658 PolarHBondContact O-NE2 3.4Å; A654-H658 WeakPolarHBondContact O-CB 3.4Å; A654-H658 PolarHBondContact O-N 3.46Å; A655-H658 CarbonylContact O-C 3.55Å; A655-H658 WeakPolarHBondContact O-CA 3.31Å; A655-H658 WeakPolarHBondContact O-CB 3.5Å; A655-H658 PolarHBondContact O-N 3.34Å; I656-H658 PolarHBondContact O-N 3.18Å; H658-H661 CarbonylContact O-C 3.59Å; H658-H661 PolarHBondContact O-N 2.84Å; H658-H661 VanDerWaalsContact O-N 3.16Å; H658-L662 WeakPolarHBondContact CE1-CG 2.82Å; H658-L662 WeakPolarHBondContact ND1-CD1 3.08Å; H658-L662 PolarHBondContact O-N 3.27Å
659	E	40.1	Very low	40.3	Very low	81 Å²	81	73.4 Å²	73.4	38%	0.379	38%	0.375	S	S	.	.	H	α-helix	trans	-64.5	-44.1	173.5	-154.7	144.5	-159.4	0	0	109.9	A655 I656 H661 L662 Q663	A655-E659 PolarHBondContact O-N 3.46Å; I656-E659 WeakPolarHBondContact O-CB 3.14Å; I656-E659 PolarHBondContact O-N 2.74Å; I656-E659 VanDerWaalsContact O-N 3.1Å; E659-H661 VanDerWaalsContact C-N 3.33Å; E659-H661 PolarHBondContact O-N 3.49Å; E659-L662 PolarHBondContact O-N 3.48Å; E659-Q663 VanDerWaalsContact O-CG 3.28Å; E659-Q663 WeakPolarHBondContact O-CG 2.98Å; E659-Q663 PolarHBondContact O-N 3.18Å
660	Q	45.6	Very low	39.6	Very low	109 Å²	109	78.4 Å²	78.4	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-58.8	-38.8	168	-67.2	174.1	-39.1	0	0	112.9	I656 S664	I656-Q660 PolarHBondContact O-N 2.82Å; I656-Q660 VanDerWaalsContact O-N 3.15Å; Q660-S664 PolarHBondContact O-N 2.69Å; Q660-S664 PolarHBondContact O-OG 3.45Å
661	H	48.7	Very low	38.9	Very low	112 Å²	112	78.6 Å²	78.6	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-76.1	-27.6	179.4	-155.2	-4.4	0	0	0	113.5	V657 H658 E659 S664 S665	V657-H661 WeakPolarHBondContact O-CB 3.3Å; V657-H661 PolarHBondContact O-N 2.79Å; H658-H661 CarbonylContact O-C 3.59Å; H658-H661 PolarHBondContact O-N 2.84Å; H658-H661 VanDerWaalsContact O-N 3.16Å; E659-H661 VanDerWaalsContact C-N 3.33Å; E659-H661 PolarHBondContact O-N 3.49Å; H661-S664 WeakPolarHBondContact CA-OG 3.41Å; H661-S664 PolarHBondContact O-OG 2.68Å; H661-S665 VanDerWaalsContact O-CB 3.31Å; H661-S665 WeakPolarHBondContact O-CB 3.34Å; H661-S665 PolarHBondContact O-N 2.75Å; H661-S665 PolarHBondContact O-OG 2.94Å
662	L	42.6	Very low	38.2	Very low	24 Å²	24	81.5 Å²	81.5	13%	0.126	42%	0.416	C	S	.	.	H	α-helix	trans	-70.5	-48.3	169.8	-79.2	164.9	0	0	0	111.4	H658 E659 S664 S665 E666	H658-L662 WeakPolarHBondContact CE1-CG 2.82Å; H658-L662 WeakPolarHBondContact ND1-CD1 3.08Å; H658-L662 PolarHBondContact O-N 3.27Å; E659-L662 PolarHBondContact O-N 3.48Å; L662-S664 PolarHBondContact O-N 3.1Å; L662-S665 PolarHBondContact O-N 2.83Å; L662-S665 PolarHBondContact O-OG 3.3Å; L662-E666 PolarHBondContact O-N 2.8Å
663	Q	40.5	Very low	37.4	Very low	131 Å²	131	87.3 Å²	87.3	61%	0.612	45%	0.447	S	S	*	.	H	α-helix	trans	-58.5	-32.2	179.2	-71.2	165	-5	0	0	111.8	E659 S667	E659-Q663 VanDerWaalsContact O-CG 3.28Å; E659-Q663 WeakPolarHBondContact O-CG 2.98Å; E659-Q663 PolarHBondContact O-N 3.18Å; Q663-S667 WeakPolarHBondContact O-CB 3.42Å; Q663-S667 PolarHBondContact O-OG 2.87Å
664	S	39.9	Very low	37.1	Very low	53 Å²	53	86.6 Å²	86.6	37%	0.371	45%	0.453	S	S	.	.	H	α-helix	trans	-83.9	-25.2	172.6	48.5	0	0	0	0	115.4	Q660 H661 L662 S667 L668	Q660-S664 PolarHBondContact O-N 2.69Å; Q660-S664 PolarHBondContact O-OG 3.45Å; H661-S664 WeakPolarHBondContact CA-OG 3.41Å; H661-S664 PolarHBondContact O-OG 2.68Å; L662-S664 PolarHBondContact O-N 3.1Å; S664-S667 WeakPolarHBondContact CA-OG 3.5Å; S664-S667 PolarHBondContact O-OG 2.93Å; S664-L668 WeakPolarHBondContact O-CB 3.37Å; S664-L668 WeakPolarHBondContact O-CD1 3.08Å; S664-L668 VanDerWaalsContact O-CG 3.27Å; S664-L668 WeakPolarHBondContact O-CG 3.4Å; S664-L668 PolarHBondContact O-N 2.95Å
665	S	36.2	Very low	36.6	Very low	49 Å²	49	92.6 Å²	92.6	34%	0.343	48%	0.482	S	S	.	.	H	α-helix	trans	-93	-30.6	179.4	53.7	0	0	0	0	114.6	H661 L662 Q669	H661-S665 VanDerWaalsContact O-CB 3.31Å; H661-S665 WeakPolarHBondContact O-CB 3.34Å; H661-S665 PolarHBondContact O-N 2.75Å; H661-S665 PolarHBondContact O-OG 2.94Å; L662-S665 PolarHBondContact O-N 2.83Å; L662-S665 PolarHBondContact O-OG 3.3Å; S665-Q669 WeakPolarHBondContact O-CB 3.3Å; S665-Q669 PolarHBondContact O-N 3.09Å
666	E	32.2	Very low	36.1	Very low	65 Å²	65	98.4 Å²	98.4	30%	0.304	51%	0.511	S	S	.	.	H	α-helix	trans	-71.1	-37.7	171.9	-63.6	-168.5	146.6	0	0	110.3	K533 L662 Q669 W670	K533-E666 IonicContact NZ-OE1 2.7Å; K533-E666 PolarHBondContact NZ-OE1 3.08Å; K533-E666 IonicContact NZ-OE2 3.3Å; L662-E666 PolarHBondContact O-N 2.8Å; E666-Q669 PolarHBondContact O-N 3.03Å; E666-Q669 VanDerWaalsContact O-N 3.16Å; E666-W670 HydrophobicContact CB-CE3 4.28Å; E666-W670 HydrophobicContact CB-CZ3 3.88Å; E666-W670 PolarHBondContact O-N 3.43Å
667	S	36.1	Very low	35.3	Very low	63 Å²	63	101.5 Å²	101.5	44%	0.441	53%	0.534	S	S	.	.	H	α-helix	trans	-65.7	-37.2	171.9	52.5	0	0	0	0	113.7	Q663 S664 S671	Q663-S667 WeakPolarHBondContact O-CB 3.42Å; Q663-S667 PolarHBondContact O-OG 2.87Å; S664-S667 WeakPolarHBondContact CA-OG 3.5Å; S664-S667 PolarHBondContact O-OG 2.93Å; S667-S671 PolarHBondContact O-N 3.16Å; S667-S671 PolarHBondContact O-OG 3.43Å
668	L	33.3	Very low	34.4	Very low	112 Å²	112	104.3 Å²	104.3	59%	0.586	55%	0.552	S	S	*	*	H	α-helix	trans	-65.4	-37.3	168.8	-80.3	169	0	0	0	112.2	S664 W670 S671 T672	S664-L668 WeakPolarHBondContact O-CB 3.37Å; S664-L668 WeakPolarHBondContact O-CD1 3.08Å; S664-L668 VanDerWaalsContact O-CG 3.27Å; S664-L668 WeakPolarHBondContact O-CG 3.4Å; S664-L668 PolarHBondContact O-N 2.95Å; L668-W670 PolarHBondContact O-N 2.83Å; L668-S671 WeakPolarHBondContact CA-OG 3.43Å; L668-S671 PolarHBondContact O-N 3.14Å; L668-S671 PolarHBondContact O-OG 3.05Å; L668-S671 VanDerWaalsContact O-OG 3.08Å; L668-T672 PolarHBondContact O-N 3.4Å
669	Q	29.8	Very low	33.6	Very low	145 Å²	145	111.3 Å²	111.3	68%	0.678	58%	0.582	S	S	*	*	H	α-helix	trans	-72.7	-27.4	-179	-145.5	173.1	20.4	0	0	113.3	S665 E666 S671	S665-Q669 WeakPolarHBondContact O-CB 3.3Å; S665-Q669 PolarHBondContact O-N 3.09Å; E666-Q669 PolarHBondContact O-N 3.03Å; E666-Q669 VanDerWaalsContact O-N 3.16Å; Q669-S671 VanDerWaalsContact C-N 3.34Å
670	W	29.5	Very low	33.1	Very low	206 Å²	206	116 Å²	116	78%	0.78	60%	0.604	S	S	*	*	H	α-helix	trans	-73.7	-20.5	170.3	-87	-59.6	0	0	0	114.1	E666 L668	E666-W670 HydrophobicContact CB-CE3 4.28Å; E666-W670 HydrophobicContact CB-CZ3 3.88Å; E666-W670 PolarHBondContact O-N 3.43Å; L668-W670 PolarHBondContact O-N 2.83Å
671	S	30.8	Very low	32.2	Very low	85 Å²	85	116.5 Å²	116.5	59%	0.594	61%	0.61	S	S	*	*	H	α-helix	trans	-97.6	-2.7	-177.6	43	0	0	0	0	114.8	S667 L668 Q669	S667-S671 PolarHBondContact O-N 3.16Å; S667-S671 PolarHBondContact O-OG 3.43Å; L668-S671 WeakPolarHBondContact CA-OG 3.43Å; L668-S671 PolarHBondContact O-N 3.14Å; L668-S671 PolarHBondContact O-OG 3.05Å; L668-S671 VanDerWaalsContact O-OG 3.08Å; Q669-S671 VanDerWaalsContact C-N 3.34Å
672	T	27.7	Very low	31.4	Very low	108 Å²	108	118.2 Å²	118.2	66%	0.663	62%	0.623	S	S	*	*	S	Bend	trans	-124.6	20.9	179.5	71.5	0	0	0	0	115	L668	L668-T672 PolarHBondContact O-N 3.4Å
673	N	27.3	Very low	30.7	Very low	136 Å²	136	122.9 Å²	122.9	73%	0.727	65%	0.648	S	S	*	*	S	Bend	trans	-138.6	25.9	-178	-152.2	17.7	0	0	0	115.4
674	I	30.4	Very low	30.4	Very low	148 Å²	148	123.5 Å²	123.5	76%	0.759	66%	0.655	S	S	*	*	S	Bend	trans	-131.7	89.5	163	-56.6	179.1	0	0	0	107.3
675	N	26.8	Very low	30	Very low	151 Å²	151	125.4 Å²	125.4	81%	0.807	67%	0.669	S	S	*	*	S	Bend	trans	164.7	76.9	156.5	-87.1	-21.2	0	0	0	110.1
676	N	24.9	Very low	29.8	Very low	134 Å²	134	129.4 Å²	129.4	72%	0.717	69%	0.687	S	S	*	*			trans	176.3	82.1	149.4	-95.9	-17.3	0	0	0	113
677	T	30.2	Very low	29.7	Very low	144 Å²	144	130.7 Å²	130.7	88%	0.883	70%	0.695	S	S	*	*			trans	-157.7	117.2	142.2	42.7	0	0	0	0	108.6
678	T	26.9	Very low	29.4	Very low	111 Å²	111	129.9 Å²	129.9	68%	0.681	69%	0.69	S	S	*	*			trans	-107.4	162.2	171.5	-49	0	0	0	0	109
679	F	26.2	Very low	29.3	Very low	170 Å²	170	131.7 Å²	131.7	75%	0.746	70%	0.695	S	S	*	*			trans	72.7	144.4	-179.1	-46	-78.9	0	0	0	114.2
680	H	29.6	Very low	29.1	Very low	179 Å²	179	128.6 Å²	128.6	83%	0.829	69%	0.689	S	S	*	*			cis	-125.9	157.1	11.8	-113.9	-80.4	0	0	0	113.7
681	N	26.8	Very low	28.9	Very low	120 Å²	120	125.7 Å²	125.7	64%	0.642	69%	0.689	S	S	*	*			trans	-83.7	155.3	-178.8	-57	-6.7	0	0	0	113.6
682	N	31.6	Very low	28.6	Very low	149 Å²	149	125.5 Å²	125.5	80%	0.797	69%	0.688	S	S	*	*				-146.9	125.5	119.4	-80.5	-41.2	0	0	0	105
683	N	28.2	Very low	28.6	Very low	122 Å²	122	125.8 Å²	125.8	65%	0.652	69%	0.689	S	S	*	*				58.3	119.6	80.8	-62.2	24.1	0	0	0	110.1
684	D	34.9	Very low	28.3	Very low	143 Å²	143	128 Å²	128	77%	0.765	69%	0.693	S	S	*	*			cis	-123.1	132.5	29.5	-68.1	-35.7	0	0	0	111.9
685	S	30.6	Very low	28.2	Very low	93 Å²	93	128.1 Å²	128.1	65%	0.65	69%	0.693	S	S	*	*				52.3	125.4	88.4	80.4	0	0	0	0	114.6
686	D	31.5	Very low	28.1	Very low	134 Å²	134	127.8 Å²	127.8	72%	0.717	69%	0.692	S	S	*	*			cis	-159.8	148.7	15.2	-122.3	0.8	0	0	0	114.6
687	N	31	Very low	28.2	Very low	91 Å²	91	127 Å²	127	49%	0.487	70%	0.697	S	S	.	*			trans	51.6	153.4	140.3	-69.3	-34.9	0	0	0	122.5
688	S	30.1	Very low	28	Very low	47 Å²	47	127.9 Å²	127.9	33%	0.329	70%	0.696	S	S	.	*			cis	-172.3	174.4	-28.9	40.2	0	0	0	0	106.7	D884	S688-D884 WeakPolarHBondContact OG-CB 3.19Å; S688-D884 PolarHBondContact OG-OD1 3.41Å
689	H	29.7	Very low	27.9	Very low	150 Å²	150	134.4 Å²	134.4	69%	0.694	71%	0.708	S	S	*	*			cis	-148.9	148.4	-18.2	-111.8	15.4	0	0	0	105.4
690	S	26.3	Very low	27.9	Very low	80 Å²	80	132 Å²	132	56%	0.559	70%	0.701	S	S	*	*				52.9	140.6	80.8	119.2	0	0	0	0	114.7
691	N	25.4	Very low	28	Very low	145 Å²	145	130.1 Å²	130.1	78%	0.775	69%	0.69	S	S	*	*			cis	-173.1	162.9	-3.3	-103.6	-5	0	0	0	108.6
692	S	25.1	Very low	27.9	Very low	81 Å²	81	130.8 Å²	130.8	57%	0.566	69%	0.685	S	S	*	*			cis	-178	134.9	-20.2	56.5	0	0	0	0	113
693	T	26.1	Very low	27.6	Very low	113 Å²	113	130 Å²	130	69%	0.693	67%	0.67	S	S	*	*			trans	80.1	160.1	145.6	-40.9	0	0	0	0	121.2
694	F	22.8	Very low	27.5	Very low	183 Å²	183	129.7 Å²	129.7	80%	0.803	67%	0.668	S	S	*	*			trans	91.4	128.9	165.8	-60.1	-68	0	0	0	116.7
695	I	27	Very low	27.1	Very low	150 Å²	150	129.6 Å²	129.6	77%	0.769	67%	0.668	S	S	*	*			cis	-138.7	161.1	11.8	-103.3	143.2	0	0	0	112.7
696	N	25.1	Very low	26.8	Very low	144 Å²	144	129.4 Å²	129.4	77%	0.77	67%	0.666	S	S	*	*			trans	-29.4	141.5	170.9	-54.5	-18.7	0	0	0	116
697	S	27	Very low	26.5	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	66%	0.663	S	S	*	*				-166.7	173.4	83.4	-73.2	0	0	0	0	114.2
698	N	25.6	Very low	26.4	Very low	163 Å²	163	134.8 Å²	134.8	87%	0.872	69%	0.685	S	S	*	*			trans	-89.6	145.7	-163.6	-65.9	-64.1	0	0	0	116.4
699	R	25.6	Very low	26.2	Very low	248 Å²	248	139.6 Å²	139.6	94%	0.936	70%	0.7	S	S	*	*				123.8	149.6	126.6	-146.6	166.6	-167.2	171.9	2.9	116.5
700	M	26.5	Very low	26.3	Very low	119 Å²	119	137.1 Å²	137.1	59%	0.586	70%	0.699	S	S	*	*			trans	-116.4	167	-162.8	-50.5	137.4	144	0	0	113.2	G1309 I1310	M700-G1309 VanDerWaalsContact CE-O 3.31Å; M700-G1309 WeakPolarHBondContact CE-O 3.3Å; M700-G1309 WeakPolarHBondContact CG-O 3.5Å; M700-I1310 HydrophobicContact CE-CB 4.41Å; M700-I1310 HydrophobicContact CE-CD1 4.3Å; M700-I1310 HydrophobicContact SD-CB 4.12Å
701	K	30.2	Very low	26.4	Very low	139 Å²	139	140.6 Å²	140.6	60%	0.604	71%	0.705	S	S	*	*				-171.3	147.2	123.5	-108.7	171.1	-179.8	-176	0	115.4	S1308	K701-S1308 CarbonylContact O-C 3.55Å; K701-S1308 WeakPolarHBondContact O-CA 2.88Å; K701-S1308 VanDerWaalsContact O-CB 3.25Å; K701-S1308 WeakPolarHBondContact O-CB 3.23Å; K701-S1308 PolarHBondContact O-OG 3.41Å
702	Y	24.8	Very low	26.5	Very low	135 Å²	135	140.9 Å²	140.9	53%	0.529	71%	0.706	S	S	.	*			trans	-73.3	158.9	-168.2	-92.4	-55.9	0	0	0	113.3	M1307 S1308 G1309 I1310	Y702-M1307 HydrophobicContact CD1-SD 4.33Å; Y702-M1307 HydrophobicContact CE1-SD 4.2Å; Y702-S1308 WeakPolarHBondContact CA-OG 3.27Å; Y702-S1308 WeakPolarHBondContact CD1-O 3.35Å; Y702-S1308 WeakPolarHBondContact CE1-O 3.44Å; Y702-G1309 VanDerWaalsContact N-CA 3.27Å; Y702-I1310 HydrophobicContact CE2-CG1 4.05Å
703	R	26.5	Very low	27	Very low	131 Å²	131	146.8 Å²	146.8	49%	0.494	72%	0.722	S	S	.	*				155	160.4	111.7	-80.1	-176.6	174.6	130.8	-0.7	111.9	S1308 Q1312	R703-S1308 PolarHBondContact N-OG 3.22Å; R703-Q1312 PolarHBondContact NH2-O 2.77Å
704	L	26.4	Very low	27.7	Very low	117 Å²	117	145.7 Å²	145.7	61%	0.613	72%	0.724	S	S	*	*			cis	-171.7	145.9	-26.2	-104.8	172.8	0	0	0	109.4
705	N	25.2	Very low	28.2	Very low	140 Å²	140	142.3 Å²	142.3	75%	0.749	71%	0.709	S	S	*	*			trans	61.1	168.2	149.7	-66.7	0.7	0	0	0	118.5
706	S	24.5	Very low	28.4	Very low	89 Å²	89	138.1 Å²	138.1	62%	0.622	69%	0.686	S	S	*	*			cis	-146.7	-179.3	10.7	-156.1	0	0	0	0	114.2
707	D	26.4	Very low	28.4	Very low	121 Å²	121	136.2 Å²	136.2	65%	0.647	68%	0.675	S	S	*	*			trans	79.9	100.1	151.1	-61.6	-9.3	0	0	0	120.1
708	K	28.6	Very low	28.5	Very low	217 Å²	217	135.2 Å²	135.2	94%	0.943	66%	0.656	S	S	*	*				-132.1	128.7	111.8	-127.4	165.9	-169.6	168.1	0	112.8
709	F	25.2	Very low	29.1	Very low	149 Å²	149	131.1 Å²	131.1	65%	0.654	64%	0.638	S	S	*	*			trans	-86.2	166.1	-173.4	-117.2	-104.8	0	0	0	112.6
710	S	31.7	Very low	29.2	Very low	97 Å²	97	125.7 Å²	125.7	68%	0.678	62%	0.624	S	S	*	*			trans	78.3	141.3	153.7	-64.1	0	0	0	0	119.8
711	K	28.9	Very low	29.5	Very low	153 Å²	153	126.2 Å²	126.2	67%	0.665	63%	0.628	S	S	*	*			cis	-169.9	145	-28.6	-121.9	162.3	-172.5	174.3	0	109.6
712	N	27.1	Very low	29.8	Very low	151 Å²	151	124.3 Å²	124.3	81%	0.807	63%	0.628	S	S	*	*			trans	35.7	128.2	147.7	-54.4	-0.5	0	0	0	120.6
713	K	36	Very low	30.2	Very low	205 Å²	205	124.6 Å²	124.6	89%	0.891	63%	0.634	S	S	*	*			trans	-147.1	136.9	136.8	-140.7	173.7	-173.3	177.9	0	113.9
714	A	40.3	Very low	30.5	Very low	90 Å²	90	125.5 Å²	125.5	74%	0.744	64%	0.644	S	S	*	*			trans	42.1	91.9	156.1	0	0	0	0	0	118.8
715	K	33.6	Very low	30.6	Very low	112 Å²	112	128.1 Å²	128.1	49%	0.487	65%	0.653	S	S	.	*			trans	-55.5	175.2	134.6	-56.7	108.5	122.9	-84.8	0	108.3	E840	K715-E840 WeakPolarHBondContact CE-O 3.5Å; K715-E840 PolarHBondContact NZ-O 3.48Å
716	E	32.2	Very low	30.8	Very low	62 Å²	62	125.6 Å²	125.6	29%	0.29	64%	0.644	S	S	.	*				158.5	144.9	61.8	-147.7	148.7	-125.8	0	0	109.5	K718 E840 S841	E716-K718 VanDerWaalsContact C-CB 3.46Å; E716-K718 HydrophobicContact CB-CB 3.52Å; E716-K718 HydrophobicContact CB-CD 3.76Å; E716-K718 HydrophobicContact CB-CG 3.51Å; E716-K718 HydrophobicContact CG-CB 3.67Å; E716-K718 HydrophobicContact CG-CD 4.45Å; E716-K718 HydrophobicContact CG-CG 3.68Å; E716-K718 VanDerWaalsContact O-CB 3.29Å; E716-K718 WeakPolarHBondContact O-CB 3.34Å; E716-K718 IonicContact OE2-NZ 3.16Å; E716-K718 PolarHBondContact OE2-NZ 2.97Å; E716-E840 VanDerWaalsContact CD-N 3.34Å; E716-E840 HydrophobicContact CG-CB 4.11Å; E716-E840 PolarHBondContact OE1-N 2.84Å; E716-S841 WeakPolarHBondContact CA-O 3.47Å
717	L	23.5	Very low	30.9	Very low	104 Å²	104	128.5 Å²	128.5	55%	0.545	65%	0.651	S	S	.	*	B	Isolated β-bridge	trans	-112.9	107.9	139.9	-102.9	174.2	0	0	0	105.1	M489 E840 S841	M489-L717 HydrophobicContact SD-CD1 4.24Å; L717-E840 WeakPolarHBondContact O-CB 3.38Å; L717-S841 PolarHBondContact N-O 2.67Å
718	K	29.7	Very low	30.8	Very low	97 Å²	97	129.3 Å²	129.3	42%	0.422	66%	0.655	S	S	.	*			cis	78.7	162.5	5.2	-127.8	-156.2	-161.7	73.9	0	114.3	E716	E716-K718 VanDerWaalsContact C-CB 3.46Å; E716-K718 HydrophobicContact CB-CB 3.52Å; E716-K718 HydrophobicContact CB-CD 3.76Å; E716-K718 HydrophobicContact CB-CG 3.51Å; E716-K718 HydrophobicContact CG-CB 3.67Å; E716-K718 HydrophobicContact CG-CD 4.45Å; E716-K718 HydrophobicContact CG-CG 3.68Å; E716-K718 VanDerWaalsContact O-CB 3.29Å; E716-K718 WeakPolarHBondContact O-CB 3.34Å; E716-K718 IonicContact OE2-NZ 3.16Å; E716-K718 PolarHBondContact OE2-NZ 2.97Å
719	P	37.6	Very low	30.8	Very low	77 Å²	77	125.3 Å²	125.3	50%	0.5	64%	0.643	S	S	.	*				-133.8	-157.8	-78.3	44.9	-30.9	0	0	0	109.8
720	H	29.6	Very low	30.7	Very low	135 Å²	135	124.6 Å²	124.6	63%	0.625	65%	0.646	S	S	*	*	S	Bend		-121.1	121.8	125.9	-79.7	-81.1	0	0	0	109.3
721	L	32.2	Very low	30.6	Very low	129 Å²	129	127.2 Å²	127.2	68%	0.675	65%	0.653	S	S	*	*				78.6	137.1	108	-59.1	176.3	0	0	0	112.6
722	T	35.2	Very low	30.5	Very low	99 Å²	99	126.3 Å²	126.3	61%	0.607	66%	0.655	S	S	*	*			cis	-161.8	160.9	-2.8	9.6	0	0	0	0	113.1
723	E	33.6	Very low	30.6	Very low	142 Å²	142	123.6 Å²	123.6	66%	0.664	65%	0.648	S	S	*	*			trans	64.6	129.7	136.4	-68	169.8	124.8	0	0	124.7
724	H	32.4	Very low	30.1	Very low	150 Å²	150	119.9 Å²	119.9	69%	0.694	64%	0.638	S	S	*	*				58.4	153.5	118.1	-59	-22.1	0	0	0	122.5
725	Q	28.4	Very low	29.6	Very low	172 Å²	172	122.6 Å²	122.6	80%	0.804	64%	0.635	S	S	*	*			cis	-151.2	179.4	-11.8	-116.6	-151.5	8	0	0	109.6
726	P	30.9	Very low	29.5	Very low	87 Å²	87	122.8 Å²	122.8	57%	0.565	64%	0.641	S	S	*	*			trans	-114.2	175.5	-161.7	44.4	-38.4	0	0	0	116.5
727	I	25.3	Very low	29.7	Very low	150 Å²	150	124.9 Å²	124.9	77%	0.769	66%	0.663	S	S	*	*			trans	69.7	141.2	149.7	-74.7	157.2	0	0	0	114
728	D	24.8	Very low	30.1	Very low	137 Å²	137	126.3 Å²	126.3	73%	0.733	67%	0.671	S	S	*	*				-171.8	-172.6	52.1	-150.7	-14.9	0	0	0	114.1
729	I	29.3	Very low	30.2	Very low	134 Å²	134	127.8 Å²	127.8	69%	0.687	68%	0.683	S	S	*	*			trans	90	99.3	152.7	-65.3	149	0	0	0	118.8
730	N	23.2	Very low	29.8	Very low	133 Å²	133	132 Å²	132	71%	0.711	69%	0.694	S	S	*	*			trans	39.7	133.7	134.4	-62.4	-30.7	0	0	0	121.6
731	N	29.1	Very low	29.7	Very low	153 Å²	153	132.4 Å²	132.4	82%	0.818	70%	0.701	S	S	*	*				-143.4	158.6	105	-134.3	-29.1	0	0	0	114.1
732	N	26.9	Very low	29.4	Very low	133 Å²	133	131.3 Å²	131.3	71%	0.711	70%	0.695	S	S	*	*			trans	-72.4	172.3	170.2	-55.5	-75.5	0	0	0	109.5
733	S	28.7	Very low	29	Very low	95 Å²	95	132.4 Å²	132.4	66%	0.664	70%	0.698	S	S	*	*			cis	-163.9	177	19.5	-154	0	0	0	0	112.9
734	N	26.1	Very low	28.6	Very low	126 Å²	126	132.9 Å²	132.9	67%	0.674	70%	0.703	S	S	*	*			trans	84.6	130.9	146.1	-72.1	2.8	0	0	0	121.4
735	H	29.6	Very low	28.6	Very low	147 Å²	147	130 Å²	130	68%	0.681	70%	0.7	S	S	*	*			trans	74.8	105.2	143.8	-69.2	-44.7	0	0	0	121.4
736	N	30.6	Very low	28.4	Very low	116 Å²	116	127.2 Å²	127.2	62%	0.62	70%	0.698	S	S	*	*				51	120.4	109.5	-61.4	3.8	0	0	0	118.8	N738	N736-N738 PolarHBondContact O-N 2.91Å
737	S	36.6	Very low	28.1	Very low	107 Å²	107	128.7 Å²	128.7	75%	0.748	70%	0.699	S	S	*	*			trans	-46.3	104.5	133.7	54	0	0	0	0	112.2
738	N	31.5	Very low	28	Very low	133 Å²	133	126.6 Å²	126.6	71%	0.711	69%	0.686	S	S	*	*			trans	-160	90	157.8	-88.3	-17	0	0	0	104	N736	N736-N738 PolarHBondContact O-N 2.91Å
739	N	32.8	Very low	28.1	Very low	129 Å²	129	126.6 Å²	126.6	69%	0.69	68%	0.68	S	S	*	*			cis	55.8	112.7	32.2	-167.4	12.1	0	0	0	112.5
740	K	29.2	Very low	28.4	Very low	164 Å²	164	125.6 Å²	125.6	71%	0.713	68%	0.684	S	S	*	*			trans	66.3	129.2	-163.4	-43.9	162.1	-169.9	171.6	0	109.5
741	D	27.3	Very low	28.7	Very low	144 Å²	144	125.4 Å²	125.4	77%	0.77	68%	0.682	S	S	*	*			cis	-126.1	159	31.3	-76.8	-15	0	0	0	112.4
742	N	26.7	Very low	28.4	Very low	106 Å²	106	123.8 Å²	123.8	57%	0.567	67%	0.673	S	S	*	*			cis	-164.8	173.2	-19.1	-112.4	-29.7	0	0	0	109.2
743	N	26.4	Very low	28.4	Very low	123 Å²	123	124.1 Å²	124.1	66%	0.658	67%	0.674	S	S	*	*			trans	70.5	137.2	155	-69.4	-11.6	0	0	0	116.4	S745	N743-S745 VanDerWaalsContact C-N 3.29Å; N743-S745 PolarHBondContact O-N 3.03Å
744	I	24.9	Very low	28.2	Very low	151 Å²	151	130.2 Å²	130.2	77%	0.774	68%	0.683	S	S	*	*				51.1	50	71.8	-42.1	166.1	0	0	0	111
745	S	32.9	Very low	28	Very low	89 Å²	89	134.6 Å²	134.6	62%	0.622	69%	0.69	S	S	*	*				-163.4	93.8	125.7	-167.2	0	0	0	0	108.2	N743 M747	N743-S745 VanDerWaalsContact C-N 3.29Å; N743-S745 PolarHBondContact O-N 3.03Å; S745-M747 PolarHBondContact OG-N 3.07Å
746	C	23.8	Very low	27.7	Very low	115 Å²	115	137 Å²	137	78%	0.777	70%	0.699	S	S	*	*			cis	19.1	56.5	36.8	-162.1	0	0	0	0	114.8
747	M	24.2	Very low	27.3	Very low	118 Å²	118	138 Å²	138	58%	0.581	70%	0.704	S	S	*	*				-155.8	122.7	125.1	-103.9	163	-84.2	0	0	106	S745 K749	S745-M747 PolarHBondContact OG-N 3.07Å; M747-K749 VanDerWaalsContact CG-NZ 3.28Å; M747-K749 PolarHBondContact SD-NZ 2.99Å
748	E	24.4	Very low	26.8	Very low	106 Å²	106	138.9 Å²	138.9	50%	0.495	70%	0.699	S	S	.	*				47.2	79	59.9	-171.7	-133.3	-164.6	0	0	109.6	N752	E748-N752 PolarHBondContact OE1-ND2 3.2Å
749	K	26.8	Very low	26.5	Very low	137 Å²	137	139.6 Å²	139.6	60%	0.596	70%	0.703	S	S	*	*				-174.9	133.2	128.9	-86	136.9	-152.5	101	0	106.7	M747 I751	M747-K749 VanDerWaalsContact CG-NZ 3.28Å; M747-K749 PolarHBondContact SD-NZ 2.99Å; K749-I751 HydrophobicContact CG-CG1 4.33Å
750	S	34.6	Very low	26.3	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	70%	0.699	S	S	*	*	S	Bend	cis	-140.7	142.6	24.7	34.1	0	0	0	0	112.3
751	I	30.2	Very low	26.6	Very low	128 Å²	128	137.1 Å²	137.1	66%	0.656	70%	0.704	S	S	*	*			cis	-153.4	148.4	-7.7	-129	155.5	0	0	0	112.2	K749 L753	K749-I751 HydrophobicContact CG-CG1 4.33Å; I751-L753 HydrophobicContact CG2-CD1 3.99Å; I751-L753 PolarHBondContact O-N 3.16Å
752	N	22.9	Very low	26.5	Very low	119 Å²	119	137.3 Å²	137.3	64%	0.636	71%	0.705	S	S	*	*			trans	-69.2	117.5	167.4	-93.5	-50.2	0	0	0	110.6	E748	E748-N752 PolarHBondContact OE1-ND2 3.2Å
753	L	26.2	Very low	26.4	Very low	140 Å²	140	136.1 Å²	136.1	73%	0.733	71%	0.705	S	S	*	*			trans	-160.4	121.7	161.5	-102.4	147.5	0	0	0	107.3	I751	I751-L753 HydrophobicContact CG2-CD1 3.99Å; I751-L753 PolarHBondContact O-N 3.16Å
754	R	23.6	Very low	26.3	Very low	223 Å²	223	135.3 Å²	135.3	84%	0.842	71%	0.705	S	S	*	*				45.4	126.3	64.2	-92.1	-170.3	178.9	-164.8	2.9	112.8
755	R	22.7	Very low	26.5	Very low	218 Å²	218	136.2 Å²	136.2	82%	0.823	70%	0.703	S	S	*	*	S	Bend	trans	36.2	122.3	153.2	-68.6	-176.7	175.9	170.7	-1.2	118.6	N757	R755-N757 PolarHBondContact O-N 2.54Å
756	F	23.5	Very low	26.3	Very low	198 Å²	198	137.7 Å²	137.7	87%	0.868	70%	0.702	S	S	*	*				20.5	103.5	128.4	-67.1	-88.9	0	0	0	116.9
757	N	23.3	Very low	26.8	Very low	136 Å²	136	139.3 Å²	139.3	73%	0.727	70%	0.699	S	S	*	*				-162.6	134.8	101.7	-111	-4.2	0	0	0	114.3	R755	R755-N757 PolarHBondContact O-N 2.54Å
758	I	25.5	Very low	26.8	Very low	127 Å²	127	138.7 Å²	138.7	65%	0.651	71%	0.705	S	S	*	*				33.5	111.5	125.5	-57.2	174.3	0	0	0	116.6
759	N	24.1	Very low	27.4	Very low	147 Å²	147	139.5 Å²	139.5	79%	0.786	71%	0.713	S	S	*	*			trans	67	150.1	150.9	-62.7	6.6	0	0	0	118
760	S	29.1	Very low	27.8	Very low	88 Å²	88	139.3 Å²	139.3	62%	0.615	73%	0.726	S	S	*	*			cis	-162.5	166.4	-18.2	-100.3	0	0	0	0	108.5	D762	S760-D762 PolarHBondContact O-N 2.76Å
761	N	35.2	Very low	27.3	Very low	153 Å²	153	137.9 Å²	137.9	82%	0.818	72%	0.716	S	S	*	*			trans	-1.2	108.1	151.5	-55.6	-5.7	0	0	0	116
762	D	26.5	Very low	27	Very low	148 Å²	148	142 Å²	142	79%	0.791	73%	0.725	S	S	*	*				-147.1	142.7	122.2	-110.9	-23.3	0	0	0	109	S760	S760-D762 PolarHBondContact O-N 2.76Å
763	S	23.8	Very low	27.3	Very low	81 Å²	81	140.6 Å²	140.6	57%	0.566	72%	0.722	S	S	*	*			cis	-156.1	155.1	5.4	-146.2	0	0	0	0	112
764	V	24.5	Very low	27.3	Very low	107 Å²	107	138 Å²	138	65%	0.648	72%	0.716	S	S	*	*				34.3	105.8	126.3	176.3	0	0	0	0	113.7
765	K	28.1	Very low	27.4	Very low	170 Å²	170	134 Å²	134	74%	0.739	71%	0.71	S	S	*	*				-150.2	141.1	60.7	-78.9	-173.6	178.8	175.4	0	115.5
766	I	29.7	Very low	27.6	Very low	119 Å²	119	130.6 Å²	130.6	61%	0.61	71%	0.707	S	S	*	*				32.2	104.2	112.1	-40.3	164.1	0	0	0	112.3
767	H	33.4	Very low	27.8	Very low	150 Å²	150	129 Å²	129	69%	0.694	70%	0.702	S	S	*	*			cis	-127.3	148.1	31	-73.4	-95.3	0	0	0	111.2	D769	H767-D769 PolarHBondContact ND1-O 3.45Å
768	S	24.3	Very low	28.1	Very low	104 Å²	104	127 Å²	127	73%	0.727	70%	0.697	S	S	*	*	S	Bend	cis	53	78.2	11.9	-57.5	0	0	0	0	114.1
769	D	36.9	Very low	28.3	Very low	124 Å²	124	127.4 Å²	127.4	66%	0.663	70%	0.696	S	S	*	*			trans	40.4	135.8	170.3	-53.8	-27.8	0	0	0	119.2	H767 S771	H767-D769 PolarHBondContact ND1-O 3.45Å; D769-S771 PolarHBondContact O-N 3.11Å
770	P	35.5	Very low	28.8	Very low	133 Å²	133	126.6 Å²	126.6	86%	0.864	69%	0.687	S	S	*	*	S	Bend	trans	-69	73	140.3	34	-31.6	0	0	0	108.8
771	S	25.1	Very low	29	Very low	83 Å²	83	129.4 Å²	129.4	58%	0.58	69%	0.691	S	S	*	*			trans	52.9	108.7	140.5	-57.7	0	0	0	0	118	D769	D769-S771 PolarHBondContact O-N 3.11Å
772	Y	23	Very low	28.7	Very low	214 Å²	214	126.9 Å²	126.9	84%	0.839	68%	0.677	S	S	*	*				80.8	157.4	118.3	-92.7	-142.6	0	0	0	118
773	P	29.1	Very low	28.7	Very low	90 Å²	90	126.7 Å²	126.7	58%	0.584	67%	0.671	S	S	*	*			cis	-146.5	-171.2	-33.2	36.6	-17.4	0	0	0	114.9
774	S	27.3	Very low	28.9	Very low	85 Å²	85	131 Å²	131	59%	0.594	68%	0.676	S	S	*	*				84.4	122	129.4	-83.4	0	0	0	0	119.8
775	I	25	Very low	29	Very low	138 Å²	138	133.3 Å²	133.3	71%	0.708	68%	0.68	S	S	*	*				66.5	131.6	120.2	-60.2	167.2	0	0	0	116.4
776	L	27.5	Very low	29	Very low	148 Å²	148	133.9 Å²	133.9	78%	0.775	69%	0.685	S	S	*	*			trans	71.9	145	-179.6	-56.8	146.6	0	0	0	112.2
777	Q	27.6	Very low	29.5	Very low	163 Å²	163	134 Å²	134	76%	0.762	69%	0.693	S	S	*	*			cis	46.9	81.6	3.1	-161.1	-179	67.1	0	0	114.8
778	P	29.4	Very low	29.6	Very low	95 Å²	95	131.5 Å²	131.5	62%	0.617	69%	0.691	S	S	*	*				-86	145	87.6	20.8	-31.2	0	0	0	111
779	H	30	Very low	29.7	Very low	136 Å²	136	131.6 Å²	131.6	63%	0.63	69%	0.691	S	S	*	*				62.1	137.2	71.9	-62.4	-15.9	0	0	0	112.3
780	Q	33.4	Very low	29	Very low	129 Å²	129	132.8 Å²	132.8	60%	0.603	70%	0.696	S	S	*	*			cis	-157.3	144.7	2.2	-115.6	151.3	-2.9	0	0	109.1
781	Q	33.8	Very low	28.5	Very low	148 Å²	148	131.6 Å²	131.6	69%	0.692	69%	0.691	S	S	*	*			trans	62	140.4	137.2	-63.2	165.2	-16	0	0	118.8
782	N	29.8	Very low	29	Very low	99 Å²	99	133.3 Å²	133.3	53%	0.529	70%	0.7	S	S	.	*			cis	-154.9	160.6	-9.9	-108.5	-9.4	0	0	0	105.6
783	H	25.9	Very low	29.1	Very low	144 Å²	144	134.4 Å²	134.4	67%	0.667	70%	0.703	S	S	*	*				36.8	137.4	81.2	-52.9	-71.5	0	0	0	113.1
784	Y	28.5	Very low	28.9	Very low	172 Å²	172	134.2 Å²	134.2	68%	0.675	70%	0.703	S	S	*	*			cis	-135.9	140.1	31.1	-86	-95.4	0	0	0	109.4
785	Q	25.2	Very low	28.8	Very low	155 Å²	155	136.8 Å²	136.8	72%	0.724	71%	0.71	S	S	*	*				55.9	132.9	97	-57.2	-171.2	-21.2	0	0	115.6
786	H	28.5	Very low	29.2	Very low	183 Å²	183	137.2 Å²	137.2	85%	0.847	71%	0.709	S	S	*	*			trans	-38.9	170.3	174.9	-48.2	-91.9	0	0	0	117.9
787	P	40.4	Very low	29.3	Very low	120 Å²	120	136.7 Å²	136.7	78%	0.779	70%	0.702	S	S	*	*			cis	-121	-96.6	-9.1	15.3	10.1	0	0	0	116.7
788	P	36.2	Very low	29.4	Very low	99 Å²	99	135.2 Å²	135.2	64%	0.643	70%	0.695	S	S	*	*			trans	-116.2	158.2	-134.9	40.1	-26.2	0	0	0	116
789	S	24.8	Very low	29.4	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	70%	0.702	S	S	*	*			trans	62.8	154.4	149.4	67.2	0	0	0	0	120.6
790	I	24.1	Very low	29	Very low	149 Å²	149	137.8 Å²	137.8	76%	0.764	71%	0.711	S	S	*	*			trans	87.2	88.2	163.8	-52.4	-179.5	0	0	0	118.1
791	S	24.7	Very low	28.8	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	72%	0.716	S	S	*	*				80.8	169.2	126.7	94.7	0	0	0	0	120
792	P	35.8	Very low	28.4	Very low	119 Å²	119	136.3 Å²	136.3	77%	0.773	71%	0.713	S	S	*	*			trans	-126.2	-129.6	-147.9	46.5	-33.5	0	0	0	114.4
793	R	24	Very low	28.2	Very low	237 Å²	237	139.8 Å²	139.8	89%	0.894	72%	0.72	S	S	*	*			trans	79.8	150.7	174.1	-99	-178.6	176.6	161.1	-0.2	115.6
794	S	24.4	Very low	28	Very low	86 Å²	86	140.2 Å²	140.2	60%	0.601	72%	0.723	S	S	*	*			cis	-159.7	174.7	-0.9	-154.9	0	0	0	0	112.1
795	L	25.5	Very low	27.9	Very low	139 Å²	139	139.6 Å²	139.6	73%	0.728	73%	0.726	S	S	*	*			trans	71.9	144.3	166.2	-56.8	140	0	0	0	114.7
796	H	33	Very low	27.8	Very low	147 Å²	147	139.3 Å²	139.3	68%	0.681	72%	0.722	S	S	*	*			cis	-124.8	163.9	11.7	-112.2	-50.7	0	0	0	111.2
797	H	31.4	Very low	27.9	Very low	137 Å²	137	136.8 Å²	136.8	63%	0.634	72%	0.719	S	S	*	*				37.4	139.7	91.3	-69.5	21	0	0	0	114.9
798	Q	28.7	Very low	27.5	Very low	131 Å²	131	136.4 Å²	136.4	61%	0.612	72%	0.715	S	S	*	*			cis	-168.1	169.4	-3.4	-119.9	168.4	-20.8	0	0	109
799	Q	29.4	Very low	27.2	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	72%	0.717	S	S	*	*			trans	65.7	124.2	146.1	-73.9	166.8	-9.3	0	0	120.8
800	C	20.7	Very low	27.4	Very low	119 Å²	119	138 Å²	138	80%	0.804	72%	0.717	S	S	*	*			trans	-50.1	161.9	143.7	-54.5	0	0	0	0	111
801	P	30.5	Very low	27.7	Very low	109 Å²	109	138.3 Å²	138.3	71%	0.708	72%	0.72	S	S	*	*			cis	-148.9	-161.7	42.4	48	-26.9	0	0	0	112
802	Q	24.2	Very low	27.9	Very low	137 Å²	137	142.1 Å²	142.1	64%	0.64	73%	0.726	S	S	*	*			cis	-177.4	170.3	-1.2	-129	161.3	-6.5	0	0	106.2
803	Y	25.5	Very low	27.6	Very low	171 Å²	171	144.1 Å²	144.1	67%	0.671	73%	0.729	S	S	*	*			trans	45.5	119.2	153.1	-58.9	-51.5	0	0	0	119.7
804	E	22.2	Very low	27.7	Very low	154 Å²	154	140.2 Å²	140.2	72%	0.72	73%	0.726	S	S	*	*				52.8	125	70	-59.7	-167.9	109.6	0	0	114.4
805	E	26.2	Very low	27.7	Very low	158 Å²	158	142 Å²	142	74%	0.738	73%	0.729	S	S	*	*				-157	148	97	-169.7	149.7	-140.1	0	0	112.8
806	K	24.2	Very low	27.5	Very low	149 Å²	149	145.3 Å²	145.3	65%	0.648	73%	0.733	S	S	*	*			trans	-51.9	152.6	-178.4	-38.5	115	-165.5	163.8	0	114.7
807	V	30.9	Very low	27.3	Very low	131 Å²	131	145.9 Å²	145.9	79%	0.794	74%	0.74	S	S	*	*			trans	-139.3	104.9	140.1	175.2	0	0	0	0	109.3
808	T	30.9	Very low	27.2	Very low	111 Å²	111	146.1 Å²	146.1	68%	0.681	74%	0.742	S	S	*	*			trans	57.1	118.1	154.3	58	0	0	0	0	119.3
809	C	29.8	Very low	27	Very low	103 Å²	103	145.1 Å²	145.1	70%	0.696	75%	0.749	S	S	*	*				78.5	141.6	83.4	-68.7	0	0	0	0	113.7
810	D	30.3	Very low	26.9	Very low	135 Å²	135	142.9 Å²	142.9	72%	0.722	75%	0.746	S	S	*	*			cis	-153.6	173.8	2.5	-104	-21.2	0	0	0	112.5
811	D	29.6	Very low	27.2	Very low	156 Å²	156	142.7 Å²	142.7	83%	0.834	74%	0.742	S	S	*	*			trans	75.6	145.5	161.5	-67.4	-28.3	0	0	0	120.8
812	Q	28.8	Very low	27.1	Very low	188 Å²	188	141.9 Å²	141.9	88%	0.879	74%	0.738	S	S	*	*			trans	-125.9	-172.9	-166.7	-65.7	-175.2	-32	0	0	111.5	N814	Q812-N814 PolarHBondContact O-N 2.69Å
813	L	28.6	Very low	27	Very low	161 Å²	161	140.6 Å²	140.6	84%	0.843	74%	0.744	S	S	*	*			trans	-37	133.3	173.3	-73	66.5	0	0	0	113.2
814	N	27.2	Very low	27.3	Very low	155 Å²	155	137.5 Å²	137.5	83%	0.829	75%	0.745	S	S	*	*				-149	153.1	129.2	-114.5	-48.9	0	0	0	113.9	Q812	Q812-N814 PolarHBondContact O-N 2.69Å
815	D	23.7	Very low	27.4	Very low	124 Å²	124	134.9 Å²	134.9	66%	0.663	74%	0.744	S	S	*	*			trans	-45.5	159.5	174.8	-91.5	-43.8	0	0	0	117.4
816	Y	22.6	Very low	27.2	Very low	209 Å²	209	133.7 Å²	133.7	82%	0.82	74%	0.742	S	S	*	*			trans	46.2	108.2	147.4	-76.8	-119.7	0	0	0	118.4
817	I	27.1	Very low	27.1	Very low	159 Å²	159	130.4 Å²	130.4	82%	0.815	73%	0.732	S	S	*	*				-162	135.1	117.6	-112.4	161.1	0	0	0	113.4
818	M	29.2	Very low	26.7	Very low	141 Å²	141	127.1 Å²	127.1	70%	0.695	71%	0.712	S	S	*	*			trans	52.4	99.5	165.5	-60.4	-64.3	-78.4	0	0	117.3
819	C	24.5	Very low	26.3	Very low	110 Å²	110	124 Å²	124	74%	0.743	70%	0.695	S	S	*	*				70.2	158.6	63.1	-58.2	0	0	0	0	114.6
820	V	27.8	Very low	26.1	Very low	120 Å²	120	124 Å²	124	73%	0.727	69%	0.688	S	S	*	*			trans	75.8	105.9	173.5	-171.1	0	0	0	0	112.6
821	T	27.6	Very low	26	Very low	116 Å²	116	122.9 Å²	122.9	71%	0.712	68%	0.681	S	S	*	*			cis	-159.9	153.3	9	-4.1	0	0	0	0	112.5
822	S	27.8	Very low	26	Very low	91 Å²	91	122 Å²	122	64%	0.636	68%	0.675	S	S	*	*			trans	33.3	136.2	145.3	65.1	0	0	0	0	121
823	S	23.5	Very low	26	Very low	110 Å²	110	118.9 Å²	118.9	77%	0.769	67%	0.665	S	S	*	*				59.1	161.6	52.3	-40.4	0	0	0	0	112.7
824	P	30.3	Very low	26	Very low	106 Å²	106	117.9 Å²	117.9	69%	0.688	66%	0.66	S	S	*	*			cis	-140.7	-173.7	11.2	41.6	-21.2	0	0	0	115.9
825	S	24	Very low	26.2	Very low	100 Å²	100	115.2 Å²	115.2	70%	0.699	65%	0.649	S	S	*	*			trans	48.9	154.6	138.2	80	0	0	0	0	121.3
826	L	22.1	Very low	26.4	Very low	133 Å²	133	116.6 Å²	116.6	70%	0.696	65%	0.652	S	S	*	*			cis	69.1	126.4	37.1	-130.7	172.7	0	0	0	113.3
827	N	22.3	Very low	26.6	Very low	80 Å²	80	113.9 Å²	113.9	43%	0.428	64%	0.641	S	S	.	*			trans	72.1	130	160	-96.3	-24.5	0	0	0	123.4	N415 Y416	N415-N827 CarbonylContact O-C 3.52Å; Y416-N827 VanDerWaalsContact O-CA 3.27Å; Y416-N827 WeakPolarHBondContact O-CA 2.89Å; Y416-N827 PolarHBondContact O-N 2.6Å; Y416-N827 PolarHBondContact O-OD1 2.79Å
828	T	24.1	Very low	26.5	Very low	61 Å²	61	109.9 Å²	109.9	37%	0.374	63%	0.627	S	S	.	*			trans	52.1	152.8	143.6	58.3	0	0	0	0	122.8	P414 N415 Y416	P414-T828 CarbonylContact C-O 3.57Å; P414-T828 WeakPolarHBondContact CA-O 3.05Å; P414-T828 VanDerWaalsContact CB-O 3.29Å; P414-T828 WeakPolarHBondContact CB-O 3.27Å; N415-T828 PolarHBondContact N-O 3.23Å; Y416-T828 VanDerWaalsContact N-N 3.16Å
829	S	22.3	Very low	26.3	Very low	47 Å²	47	109.5 Å²	109.5	33%	0.329	63%	0.625	S	S	.	*			cis	-164.1	127.9	-47	43.6	0	0	0	0	108.8	N415 Y416	N415-S829 WeakPolarHBondContact OD1-CA 3.38Å; Y416-S829 VanDerWaalsContact CZ-CB 3.44Å
830	N	24.8	Very low	26.4	Very low	102 Å²	102	108.6 Å²	108.6	55%	0.545	61%	0.61	S	S	.	*			trans	71	149.7	-179.8	-45.5	-58.8	0	0	0	115.2	P414 N415 Y416	P414-N830 VanDerWaalsContact CG-O 3.24Å; P414-N830 WeakPolarHBondContact CG-O 3.12Å; N415-N830 PolarHBondContact OD1-N 2.76Å; N415-N830 VanDerWaalsContact OD1-N 3.15Å; Y416-N830 PolarHBondContact OH-OD1 2.83Å
831	I	29.1	Very low	26.3	Very low	111 Å²	111	106.1 Å²	106.1	57%	0.569	60%	0.598	S	S	*	*			trans	152.5	49.2	-171.2	-30.2	158.9	0	0	0	114.8	F412	F412-I831 HydrophobicContact CD1-CB 4.14Å; F412-I831 HydrophobicContact CD1-CG2 4.01Å; F412-I831 HydrophobicContact CE1-CB 3.74Å; F412-I831 HydrophobicContact CE1-CD1 4.21Å; F412-I831 HydrophobicContact CE1-CG2 3.91Å; F412-I831 HydrophobicContact CZ-CB 4.47Å; F412-I831 HydrophobicContact CZ-CD1 4.18Å; F412-I831 HydrophobicContact CZ-CG2 4.45Å
832	L	29.1	Very low	26.3	Very low	138 Å²	138	106.7 Å²	106.7	72%	0.723	60%	0.597	S	S	*	*			trans	22.6	127.4	164.2	-89.2	71.8	0	0	0	122.6
833	N	28.4	Very low	26.3	Very low	122 Å²	122	108.9 Å²	108.9	65%	0.652	60%	0.601	S	S	*	*				56.3	131.1	124.1	-73.4	-33.1	0	0	0	121.1
834	N	29	Very low	26.5	Very low	141 Å²	141	110 Å²	110	75%	0.754	60%	0.598	S	S	*	*				57.9	145.8	82	-62.3	-55.8	0	0	0	113.1
835	V	30.5	Very low	26.3	Very low	98 Å²	98	110.6 Å²	110.6	59%	0.594	60%	0.596	S	S	*	*				-158.7	141.6	53.6	178.5	0	0	0	0	107.6	Y837	V835-Y837 HydrophobicContact CG1-CD2 3.67Å; V835-Y837 HydrophobicContact CG1-CE2 3.78Å
836	H	27.5	Very low	26.5	Very low	154 Å²	154	113.3 Å²	113.3	71%	0.713	60%	0.595	S	S	*	*	S	Bend		-161.6	148.6	74.6	-85.7	-96	0	0	0	108.9
837	Y	27.3	Very low	26.7	Very low	151 Å²	151	113 Å²	113	59%	0.592	59%	0.594	S	S	*	*			cis	-172.4	162.9	-2.1	-109.6	-175.4	0	0	0	105.1	V835	V835-Y837 HydrophobicContact CG1-CD2 3.67Å; V835-Y837 HydrophobicContact CG1-CE2 3.78Å
838	S	26.2	Very low	26.8	Very low	76 Å²	76	116.3 Å²	116.3	53%	0.531	61%	0.611	S	S	.	*			cis	-163.8	146.6	-9.4	-89.8	0	0	0	0	106.6
839	M	25	Very low	27	Very low	132 Å²	132	120.1 Å²	120.1	65%	0.65	63%	0.627	S	S	*	*				64.5	131.8	64.9	-69.1	178.5	152.5	0	0	113.8
840	E	25.8	Very low	27.2	Very low	91 Å²	91	124.5 Å²	124.5	43%	0.425	65%	0.646	S	S	.	*			cis	-163.1	-139.1	6.8	-128.8	163.6	174.8	0	0	116.9	K715 E716 L717	K715-E840 WeakPolarHBondContact CE-O 3.5Å; K715-E840 PolarHBondContact NZ-O 3.48Å; E716-E840 VanDerWaalsContact CD-N 3.34Å; E716-E840 HydrophobicContact CG-CB 4.11Å; E716-E840 PolarHBondContact OE1-N 2.84Å; L717-E840 WeakPolarHBondContact O-CB 3.38Å
841	S	26.5	Very low	27.1	Very low	68 Å²	68	126.5 Å²	126.5	48%	0.476	66%	0.656	S	S	.	*	B	Isolated β-bridge	trans	-133.5	-177.8	-164.3	73.3	0	0	0	0	114.5	E716 L717	E716-S841 WeakPolarHBondContact CA-O 3.47Å; L717-S841 PolarHBondContact N-O 2.67Å
842	N	26.8	Very low	27	Very low	128 Å²	128	126.2 Å²	126.2	68%	0.684	66%	0.664	S	S	*	*			cis	-133.2	-124.5	2	-158.4	-3.5	0	0	0	112.3
843	N	27.5	Very low	26.9	Very low	137 Å²	137	126.4 Å²	126.4	73%	0.733	67%	0.671	S	S	*	*			cis	-162.5	-176.3	3.3	-155.9	0.7	0	0	0	112.9
844	L	27.3	Very low	26.8	Very low	135 Å²	135	124.6 Å²	124.6	71%	0.707	67%	0.673	S	S	*	*			trans	-67.6	171.7	171.7	-94	65	0	0	0	114
845	D	26.5	Very low	26.8	Very low	118 Å²	118	125.2 Å²	125.2	63%	0.631	68%	0.682	S	S	*	*			cis	-155.1	-171.1	30.6	-143.9	-18.7	0	0	0	113.8
846	K	27.3	Very low	26.6	Very low	156 Å²	156	123.6 Å²	123.6	68%	0.678	69%	0.685	S	S	*	*			trans	-96	-172.4	-173.6	-17.7	94.4	-170.2	147.7	0	114.7
847	D	26.8	Very low	26.5	Very low	128 Å²	128	124.2 Å²	124.2	68%	0.684	69%	0.692	S	S	*	*			cis	-161	171.3	13.4	-133.9	-42.1	0	0	0	115.9
848	L	25.8	Very low	26.6	Very low	148 Å²	148	122.1 Å²	122.1	78%	0.775	70%	0.695	S	S	*	*			trans	29.2	150.3	148.6	-91.6	160.1	0	0	0	126.1
849	I	27.1	Very low	26.5	Very low	142 Å²	142	124 Å²	124	73%	0.728	70%	0.703	S	S	*	*			trans	108.3	97.3	154	-52.1	-153.7	0	0	0	120.5
850	I	26.3	Very low	26.7	Very low	139 Å²	139	123.7 Å²	123.7	71%	0.713	71%	0.705	S	S	*	*				57.2	124.5	129.5	-57.9	177.6	0	0	0	122.7
851	N	24.2	Very low	26.7	Very low	144 Å²	144	125.1 Å²	125.1	77%	0.77	72%	0.715	S	S	*	*			trans	27.8	150.7	139.4	-47.6	-15.7	0	0	0	121.6
852	S	26.7	Very low	26.6	Very low	105 Å²	105	128.3 Å²	128.3	73%	0.734	73%	0.727	S	S	*	*			cis	-168	143.1	22.9	-0.5	0	0	0	0	114.8
853	V	25.9	Very low	26.7	Very low	142 Å²	142	128 Å²	128	86%	0.861	73%	0.73	S	S	*	*				62	125.7	127.3	-178.2	0	0	0	0	123.2
854	A	25.8	Very low	26.5	Very low	84 Å²	84	126.4 Å²	126.4	69%	0.694	73%	0.729	S	S	*	*			trans	79.1	120.8	146.6	0	0	0	0	0	123.7
855	T	28.9	Very low	26.6	Very low	154 Å²	154	125.1 Å²	125.1	95%	0.945	73%	0.732	S	S	*	*				-168.4	142.6	110.2	22	0	0	0	0	108.5
856	G	26.8	Very low	26.6	Very low	63 Å²	63	124.3 Å²	124.3	65%	0.649	74%	0.736	S	S	*	*			cis	170.2	164.5	-13.4	0	0	0	0	0	112.3
857	L	26.6	Very low	26.7	Very low	168 Å²	168	122.4 Å²	122.4	88%	0.88	74%	0.742	S	S	*	*			trans	69.2	149.9	152.1	-53.5	174	0	0	0	117.8
858	T	27.7	Very low	26.7	Very low	106 Å²	106	122.7 Å²	122.7	65%	0.65	75%	0.748	S	S	*	*			cis	-154.6	134.3	-2.6	6.4	0	0	0	0	107.7
859	T	25.6	Very low	26.8	Very low	115 Å²	115	120.9 Å²	120.9	71%	0.706	75%	0.748	S	S	*	*				52.7	136.4	104.1	78.3	0	0	0	0	116.4
860	D	27.8	Very low	27.2	Very low	126 Å²	126	119.3 Å²	119.3	67%	0.674	75%	0.747	S	S	*	*				-174.4	149.7	78.7	-108.9	24.6	0	0	0	114.1
861	N	27.7	Very low	27.4	Very low	122 Å²	122	123.5 Å²	123.5	65%	0.652	75%	0.754	S	S	*	*			trans	43.5	147.6	130.6	-61.8	-41.7	0	0	0	123.1
862	N	24.3	Very low	27.7	Very low	135 Å²	135	122.7 Å²	122.7	72%	0.722	75%	0.748	S	S	*	*			cis	-173.5	-178.3	-17.9	-128.6	-46	0	0	0	112
863	T	27.3	Very low	27.8	Very low	120 Å²	120	124.1 Å²	124.1	74%	0.736	75%	0.746	S	S	*	*			trans	75.2	112.3	154	37.4	0	0	0	0	125.5
864	S	25	Very low	28	Very low	104 Å²	104	122.5 Å²	122.5	73%	0.727	74%	0.737	S	S	*	*				67.2	123.1	128.6	68.9	0	0	0	0	125.4
865	S	28.7	Very low	28	Very low	108 Å²	108	124.1 Å²	124.1	76%	0.755	74%	0.738	S	S	*	*				149.9	124.5	101.8	59.8	0	0	0	0	118.5
866	S	26.5	Very low	27.9	Very low	102 Å²	102	125 Å²	125	71%	0.713	73%	0.734	S	S	*	*			trans	51.1	129.4	143.7	57.7	0	0	0	0	126.1
867	S	28.4	Very low	27.8	Very low	115 Å²	115	126.7 Å²	126.7	80%	0.804	74%	0.736	S	S	*	*			trans	73.8	145.9	152.2	78.7	0	0	0	0	117.7
868	T	28.5	Very low	27.6	Very low	134 Å²	134	125.5 Å²	125.5	82%	0.822	73%	0.73	S	S	*	*			cis	-136.1	178.4	20.6	46.7	0	0	0	0	114
869	S	26.5	Very low	27.5	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	73%	0.733	S	S	*	*			trans	-69.6	164.1	165.2	-78.6	0	0	0	0	112.4
870	P	36.7	Very low	27.5	Very low	110 Å²	110	131.7 Å²	131.7	71%	0.714	74%	0.74	S	S	*	*			cis	-132.4	158.9	18.1	42.4	-27.3	0	0	0	117.8
871	R	30.2	Very low	27.3	Very low	226 Å²	226	134.8 Å²	134.8	85%	0.853	75%	0.748	S	S	*	*			trans	33.8	144.7	134.6	-68.2	-174.4	152.6	-164.7	-7.2	120.8
872	I	30.2	Very low	27.5	Very low	127 Å²	127	133.8 Å²	133.8	65%	0.651	75%	0.748	S	S	*	*			cis	-174.4	147.7	-1.6	-112.6	168.4	0	0	0	105.4
873	I	28.8	Very low	27.5	Very low	136 Å²	136	132.7 Å²	132.7	70%	0.697	75%	0.747	S	S	*	*			cis	-159.9	158	-11.1	-140.4	174.3	0	0	0	109.3
874	T	29.2	Very low	27.3	Very low	107 Å²	107	131 Å²	131	66%	0.656	73%	0.733	S	S	*	*			trans	31.8	122	167.1	60.1	0	0	0	0	121.4
875	T	26.2	Very low	27.2	Very low	118 Å²	118	130.7 Å²	130.7	72%	0.724	73%	0.727	S	S	*	*			cis	84.2	141.9	36.5	72.6	0	0	0	0	117.7
876	M	27	Very low	27.1	Very low	173 Å²	173	131.8 Å²	131.8	85%	0.852	73%	0.729	S	S	*	*			trans	85.3	149.4	155.6	-61.4	-146.3	174.8	0	0	119.3
877	S	24.9	Very low	26.9	Very low	99 Å²	99	135.4 Å²	135.4	69%	0.692	73%	0.732	S	S	*	*			cis	-169.2	159.2	-21	-94	0	0	0	0	110.3
878	N	23.3	Very low	27	Very low	143 Å²	143	135 Å²	135	77%	0.765	73%	0.727	S	S	*	*			trans	-97.7	162.2	-179.3	-66.9	-21.6	0	0	0	114.5
879	N	24.1	Very low	26.7	Very low	132 Å²	132	137.5 Å²	137.5	71%	0.706	73%	0.727	S	S	*	*			trans	71	140.5	158.9	-50.8	-30.5	0	0	0	116.9
880	Y	26.3	Very low	26.6	Very low	219 Å²	219	138.6 Å²	138.6	86%	0.859	72%	0.724	S	S	*	*				-166.2	172.6	62.7	-106.2	-82.4	0	0	0	115.3
881	F	23.1	Very low	26	Very low	190 Å²	190	138.2 Å²	138.2	83%	0.833	72%	0.724	S	S	*	*			trans	-83.9	-175.6	175.9	-82	-109	0	0	0	113.3
882	P	33.5	Very low	25.8	Very low	102 Å²	102	134.8 Å²	134.8	66%	0.662	72%	0.722	S	S	*	*			cis	-142.2	-158.1	-31.2	36	-13.3	0	0	0	115.6
883	T	23.7	Very low	25.5	Very low	112 Å²	112	135.1 Å²	135.1	69%	0.687	72%	0.723	S	S	*	*			trans	85.9	95	147.3	42.4	0	0	0	0	123
884	D	23.4	Very low	25.3	Very low	83 Å²	83	135.8 Å²	135.8	44%	0.444	73%	0.727	S	S	.	*				50.4	122.9	122.1	-48.6	-47.9	0	0	0	124.8	S688	S688-D884 WeakPolarHBondContact OG-CB 3.19Å; S688-D884 PolarHBondContact OG-OD1 3.41Å
885	T	23.4	Very low	25.3	Very low	98 Å²	98	135.6 Å²	135.6	60%	0.601	73%	0.727	S	S	*	*				154	152.8	109.5	50.1	0	0	0	0	116.2
886	V	25.7	Very low	25.3	Very low	132 Å²	132	137.5 Å²	137.5	80%	0.8	73%	0.733	S	S	*	*			trans	80.6	139.4	161.5	-155.1	0	0	0	0	121.5
887	F	22.4	Very low	25.1	Very low	178 Å²	178	133.8 Å²	133.8	78%	0.781	72%	0.724	S	S	*	*			trans	-73.7	-175.9	174.5	-68.2	-96.4	0	0	0	114.1
888	P	29.5	Very low	25	Very low	107 Å²	107	133.5 Å²	133.5	70%	0.695	72%	0.722	S	S	*	*			cis	-141.4	169.9	5.9	33.6	-9.6	0	0	0	120.2
889	F	22.8	Very low	25.2	Very low	186 Å²	186	135.2 Å²	135.2	82%	0.816	73%	0.725	S	S	*	*			trans	38.6	134.6	147	-76.9	-72.3	0	0	0	126.7
890	N	24.6	Very low	25.3	Very low	132 Å²	132	136.9 Å²	136.9	71%	0.706	73%	0.734	S	S	*	*			trans	72.4	100.2	139.7	-72.2	-10.5	0	0	0	124.2
891	S	24.7	Very low	25.3	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	72%	0.724	S	S	*	*				43.5	116.7	116.7	-50.9	0	0	0	0	122.8
892	L	24.6	Very low	25.6	Very low	154 Å²	154	131.2 Å²	131.2	81%	0.806	72%	0.72	S	S	*	*				168.9	145.6	113.2	-90.8	159.2	0	0	0	113.4
893	I	24.9	Very low	25.3	Very low	134 Å²	134	136 Å²	136	69%	0.687	73%	0.726	S	S	*	*			trans	60.6	105.2	151.4	-65.5	167.6	0	0	0	116.7
894	I	24.6	Very low	25.5	Very low	150 Å²	150	134 Å²	134	77%	0.769	73%	0.727	S	S	*	*				68.9	132.7	81.2	-68	168.7	0	0	0	112.7
895	P	29.8	Very low	25.7	Very low	102 Å²	102	136.5 Å²	136.5	66%	0.662	74%	0.74	S	S	*	*			cis	-135	-161.8	-1.6	38.5	-17.6	0	0	0	115.3
896	D	24.7	Very low	26	Very low	158 Å²	158	137.7 Å²	137.7	85%	0.845	75%	0.747	S	S	*	*			trans	97.3	156.9	143.8	-76.8	-5.6	0	0	0	122.1
897	S	24.1	Very low	26	Very low	95 Å²	95	137.6 Å²	137.6	66%	0.664	74%	0.742	S	S	*	*			trans	-111.1	-177.2	-154.4	62	0	0	0	0	113.5
898	S	23.1	Very low	26.2	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	74%	0.739	S	S	*	*			trans	66.6	120.7	147.9	50.2	0	0	0	0	119.6
899	Q	26.8	Very low	26	Very low	178 Å²	178	135.7 Å²	135.7	83%	0.832	74%	0.738	S	S	*	*			trans	72.2	120.2	143.5	-65.6	-178	-9.7	0	0	119.7	N901	Q899-N901 PolarHBondContact O-N 3.46Å
900	N	25.8	Very low	26.3	Very low	167 Å²	167	133 Å²	133	89%	0.893	73%	0.732	S	S	*	*			trans	-55	117.4	156.2	-65.7	-22.2	0	0	0	110.5
901	N	26.4	Very low	26.3	Very low	122 Å²	122	136.1 Å²	136.1	65%	0.652	73%	0.734	S	S	*	*			trans	-73.3	158.1	149.3	-83.7	-97.7	0	0	0	108.3	Q899	Q899-N901 PolarHBondContact O-N 3.46Å
902	K	29.5	Very low	26.4	Very low	169 Å²	169	138.5 Å²	138.5	74%	0.735	73%	0.731	S	S	*	*			cis	-160.3	150.3	17.2	-132.8	152.4	-170.3	176.2	0	110.4
903	Y	26.5	Very low	26.5	Very low	203 Å²	203	137.1 Å²	137.1	80%	0.796	73%	0.729	S	S	*	*			trans	25.2	143.4	138.7	-68.4	-114.4	0	0	0	120.3
904	G	28.9	Very low	26.6	Very low	68 Å²	68	136.2 Å²	136.2	70%	0.701	74%	0.735	S	S	*	*			cis	-168.6	-163	6.9	0	0	0	0	0	109.3
905	D	28	Very low	26.9	Very low	136 Å²	136	133.3 Å²	133.3	73%	0.727	73%	0.728	S	S	*	*			cis	-166.5	153.2	5.3	-98.7	-28.3	0	0	0	110.8
906	V	28.6	Very low	27	Very low	123 Å²	123	136.1 Å²	136.1	75%	0.745	73%	0.732	S	S	*	*			trans	59.3	132.2	138.1	174.2	0	0	0	0	119.7
907	N	26.9	Very low	27.2	Very low	130 Å²	130	138.8 Å²	138.8	70%	0.695	73%	0.732	S	S	*	*			cis	-162.2	154.8	7.7	-134.7	-10.2	0	0	0	115.6
908	L	25.3	Very low	27.6	Very low	137 Å²	137	137.2 Å²	137.2	72%	0.717	73%	0.731	S	S	*	*			trans	57.4	135.2	139.5	-121	75.2	0	0	0	126.5
909	T	25.3	Very low	27.8	Very low	109 Å²	109	139 Å²	139	67%	0.669	73%	0.733	S	S	*	*			trans	97.7	136.8	150	69.2	0	0	0	0	122.8
910	N	29.2	Very low	28	Very low	128 Å²	128	136 Å²	136	68%	0.684	72%	0.723	S	S	*	*			trans	71.1	143.8	161.9	-55.2	-26.9	0	0	0	118.3
911	W	25.9	Very low	28	Very low	198 Å²	198	134 Å²	134	75%	0.75	71%	0.712	S	S	*	*			cis	-165.9	157.2	-9.9	-114.5	9.5	0	0	0	110.2
912	K	26	Very low	28	Very low	154 Å²	154	135 Å²	135	67%	0.67	71%	0.713	S	S	*	*			trans	66	114.3	149.6	-76.7	176.1	-179.8	172.5	0	119.2
913	T	26.3	Very low	27.9	Very low	125 Å²	125	132.3 Å²	132.3	77%	0.767	71%	0.711	S	S	*	*				59.6	137.2	89.8	63.3	0	0	0	0	115
914	S	27.5	Very low	27.9	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	71%	0.705	S	S	*	*			cis	-172.2	175.5	-2.5	44	0	0	0	0	107.6
915	S	30.2	Very low	27.8	Very low	89 Å²	89	131.9 Å²	131.9	62%	0.622	70%	0.704	S	S	*	*			cis	-133.5	-166.4	9.9	59.2	0	0	0	0	109.7
916	E	31.7	Very low	27.9	Very low	160 Å²	160	131.6 Å²	131.6	75%	0.748	70%	0.702	S	S	*	*			cis	-151.9	164.8	3.2	-145.3	125.4	-149.2	0	0	111.6
917	Y	30	Very low	27.8	Very low	214 Å²	214	131.8 Å²	131.8	84%	0.839	70%	0.699	S	S	*	*			trans	-39.4	155.6	-179.6	-61.7	-103.4	0	0	0	117.8
918	G	31.1	Very low	27.8	Very low	63 Å²	63	131.7 Å²	131.7	65%	0.649	70%	0.697	S	S	*	*			cis	165.9	154.9	-5.9	0	0	0	0	0	115.6
919	D	28.6	Very low	27.9	Very low	130 Å²	130	132 Å²	132	70%	0.695	70%	0.699	S	S	*	*				60.3	110.5	128.9	-73.6	37.4	0	0	0	122.8
920	N	30	Very low	27.9	Very low	117 Å²	117	131.2 Å²	131.2	63%	0.626	70%	0.697	S	S	*	*				87.8	113.8	116.5	-61	-14.1	0	0	0	121.2
921	N	26.6	Very low	27.8	Very low	123 Å²	123	132.3 Å²	132.3	66%	0.658	70%	0.702	S	S	*	*				63.3	150.9	112.8	-62	21.8	0	0	0	120.3
922	E	26.1	Very low	27.8	Very low	143 Å²	143	128.4 Å²	128.4	67%	0.668	70%	0.7	S	S	*	*			cis	-169.5	149.2	-9.5	-114.4	174.4	131.9	0	0	109.2
923	T	27.1	Very low	27.9	Very low	114 Å²	114	125.8 Å²	125.8	70%	0.699	70%	0.701	S	S	*	*			trans	59.9	-174.4	148.4	71.5	0	0	0	0	116.6
924	I	26.8	Very low	27.8	Very low	129 Å²	129	125.1 Å²	125.1	66%	0.662	70%	0.701	S	S	*	*			cis	-145.7	118	-11.7	-134.4	146.6	0	0	0	104.7
925	I	27.6	Very low	28.3	Very low	133 Å²	133	124.7 Å²	124.7	68%	0.682	70%	0.696	S	S	*	*				106.2	160	79.1	-140.3	168.3	0	0	0	112.1
926	N	28.4	Very low	28.1	Very low	129 Å²	129	127.4 Å²	127.4	69%	0.69	70%	0.702	S	S	*	*			trans	74.3	140.8	164.5	-77.4	-11.1	0	0	0	120.8
927	N	27.3	Very low	27.7	Very low	128 Å²	128	126.5 Å²	126.5	68%	0.684	70%	0.702	S	S	*	*			cis	-171.2	177	-21.9	-143.1	-20.6	0	0	0	113.7
928	I	26.4	Very low	27.5	Very low	127 Å²	127	121 Å²	121	65%	0.651	70%	0.695	S	S	*	*			trans	83.9	130.6	143.4	-78.2	160.3	0	0	0	120.7
929	N	28.7	Very low	27.3	Very low	143 Å²	143	122.8 Å²	122.8	77%	0.765	70%	0.697	S	S	*	*			trans	69	157	157.2	-75.7	-6.9	0	0	0	120.6
930	C	24.8	Very low	27.2	Very low	93 Å²	93	121.6 Å²	121.6	63%	0.628	70%	0.699	S	S	*	*			cis	-177.9	159.8	-33.1	-112.1	0	0	0	0	109.7
931	I	26.8	Very low	27.1	Very low	152 Å²	152	121.2 Å²	121.2	78%	0.779	71%	0.706	S	S	*	*			trans	67.4	140.1	150.8	-69.3	163.6	0	0	0	117.6
932	T	26.7	Very low	27.3	Very low	115 Å²	115	121 Å²	121	71%	0.706	71%	0.714	S	S	*	*			cis	-163	159.7	-17.6	33.2	0	0	0	0	111.2
933	S	26.4	Very low	27.3	Very low	99 Å²	99	120.4 Å²	120.4	69%	0.692	72%	0.72	S	S	*	*			trans	53.6	110.5	144.4	63	0	0	0	0	123.6
934	S	24.3	Very low	27.3	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	72%	0.721	S	S	*	*				36.3	165.1	92.3	-48	0	0	0	0	121.6
935	P	38.7	Very low	27.4	Very low	107 Å²	107	123 Å²	123	70%	0.695	73%	0.728	S	S	*	*			cis	-151	-168.3	-45.8	45.4	-27.1	0	0	0	116.4
936	L	25.3	Very low	27.8	Very low	145 Å²	145	122.2 Å²	122.2	76%	0.759	73%	0.731	S	S	*	*			trans	80	128.3	149.1	-66.4	172.6	0	0	0	124.8
937	L	25	Very low	27.8	Very low	142 Å²	142	120.9 Å²	120.9	74%	0.743	73%	0.732	S	S	*	*				70.4	117.9	128.8	-71.2	172.7	0	0	0	126.4
938	S	24.5	Very low	27.8	Very low	97 Å²	97	120.5 Å²	120.5	68%	0.678	74%	0.735	S	S	*	*				74.4	121.7	122.4	72.3	0	0	0	0	124.9
939	S	26.4	Very low	28.2	Very low	101 Å²	101	120.2 Å²	120.2	71%	0.706	74%	0.739	S	S	*	*			trans	71.3	100.7	133.1	61.3	0	0	0	0	122.8
940	S	28	Very low	28.3	Very low	105 Å²	105	119 Å²	119	73%	0.734	74%	0.737	S	S	*	*				65.4	105.3	127.7	62.7	0	0	0	0	122.9
941	S	28	Very low	28.5	Very low	110 Å²	110	121.6 Å²	121.6	77%	0.769	74%	0.744	S	S	*	*				81.8	110.9	123.7	-52.4	0	0	0	0	122.1
942	S	29.1	Very low	28.7	Very low	119 Å²	119	119 Å²	119	83%	0.832	74%	0.735	S	S	*	*			trans	71.6	146.7	143.9	-54	0	0	0	0	120.8
943	V	26.1	Very low	28.8	Very low	130 Å²	130	121.7 Å²	121.7	79%	0.788	74%	0.74	S	S	*	*			cis	-177.1	162.2	-37.8	128.3	0	0	0	0	107.9
944	I	27.5	Very low	28.7	Very low	141 Å²	141	120.9 Å²	120.9	72%	0.723	74%	0.739	S	S	*	*			trans	85.2	85.9	175.1	-40.5	-168.2	0	0	0	119
945	I	29.3	Very low	28.9	Very low	155 Å²	155	121.7 Å²	121.7	80%	0.795	74%	0.739	S	S	*	*				30.4	119.2	109.7	-56.1	157.7	0	0	0	117.4
946	P	36.9	Very low	28.4	Very low	117 Å²	117	123.3 Å²	123.3	76%	0.76	75%	0.747	S	S	*	*				-142.9	168.5	105.8	42.1	-30	0	0	0	112
947	S	27.4	Very low	28.4	Very low	102 Å²	102	120.1 Å²	120.1	71%	0.713	74%	0.741	S	S	*	*			cis	-140.5	177.8	10.2	-44.3	0	0	0	0	108.6
948	T	28.4	Very low	28.4	Very low	120 Å²	120	121.6 Å²	121.6	74%	0.736	75%	0.747	S	S	*	*			cis	-159.6	170.7	6.6	-20.7	0	0	0	0	108.6
949	T	33.1	Very low	28.4	Very low	121 Å²	121	122.6 Å²	122.6	74%	0.742	75%	0.749	S	S	*	*			trans	63.4	165.6	161.7	36	0	0	0	0	116.4
950	T	30.7	Very low	28.4	Very low	118 Å²	118	126.7 Å²	126.7	72%	0.724	75%	0.753	S	S	*	*			cis	-149.6	152.1	-1.6	5.8	0	0	0	0	107.4
951	L	29.5	Very low	28.5	Very low	147 Å²	147	126.9 Å²	126.9	77%	0.77	75%	0.75	S	S	*	*			cis	-143.9	-83.9	-5.6	-174.1	69.5	0	0	0	110.6
952	T	30.8	Very low	28.6	Very low	96 Å²	96	126.4 Å²	126.4	59%	0.589	74%	0.743	S	S	*	*			trans	-158.9	160.5	-167	49.6	0	0	0	0	109.2
953	E	28.5	Very low	28.8	Very low	173 Å²	173	126.7 Å²	126.7	81%	0.808	74%	0.744	S	S	*	*			cis	-163	154.7	-10.4	-112.9	165.2	172	0	0	111
954	A	25.1	Very low	29.1	Very low	82 Å²	82	123.2 Å²	123.2	68%	0.678	74%	0.735	S	S	*	*			trans	40.7	163	141.1	0	0	0	0	0	125.6
955	T	29.2	Very low	29.3	Very low	128 Å²	128	121.1 Å²	121.1	79%	0.785	73%	0.733	S	S	*	*			trans	86.2	99.8	159	60.5	0	0	0	0	121.9
956	V	27.6	Very low	29	Very low	140 Å²	140	119.6 Å²	119.6	85%	0.848	73%	0.731	S	S	*	*				54.8	126.8	111.2	176.9	0	0	0	0	121
957	A	26.1	Very low	28.6	Very low	78 Å²	78	120.1 Å²	120.1	65%	0.645	73%	0.732	S	S	*	*			trans	77.9	119.8	150.8	0	0	0	0	0	121.5
958	M	24.7	Very low	28.4	Very low	173 Å²	173	119.3 Å²	119.3	85%	0.852	73%	0.731	S	S	*	*			trans	65.7	111.3	143	-67.9	-157.4	-71.4	0	0	119.2
959	V	24.4	Very low	28.5	Very low	119 Å²	119	119.9 Å²	119.9	72%	0.721	74%	0.735	S	S	*	*				97	137.7	55.3	156.6	0	0	0	0	111
960	K	26.8	Very low	28.2	Very low	186 Å²	186	120.7 Å²	120.7	81%	0.809	74%	0.74	S	S	*	*			trans	67.2	164.5	175.2	-84.2	172.6	178.7	178.3	0	113.6
961	V	29	Very low	28.2	Very low	110 Å²	110	124.3 Å²	124.3	67%	0.667	75%	0.745	S	S	*	*			cis	-135.6	129.2	6.4	98.3	0	0	0	0	107.4
962	T	29.8	Very low	28.2	Very low	100 Å²	100	127.8 Å²	127.8	61%	0.613	75%	0.748	S	S	*	*				43.7	148.9	102.3	78.1	0	0	0	0	115.1
963	S	33.9	Very low	28.1	Very low	124 Å²	124	128.7 Å²	128.7	87%	0.867	75%	0.754	S	S	*	*	S	Bend	cis	-94.8	147.7	37.6	53.3	0	0	0	0	115.5
964	G	32.4	Very low	27.9	Very low	57 Å²	57	128.6 Å²	128.6	59%	0.588	76%	0.755	S	S	*	*			cis	-174.3	123.8	-3.9	0	0	0	0	0	108.6
965	S	31.3	Very low	28.2	Very low	97 Å²	97	131.8 Å²	131.8	68%	0.678	76%	0.759	S	S	*	*				51.3	99.4	103.8	-160.6	0	0	0	0	112.8
966	T	24.5	Very low	28	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	76%	0.755	S	S	*	*				62.6	155.3	57.4	80.1	0	0	0	0	114.6
967	V	27.4	Very low	27.9	Very low	127 Å²	127	132.2 Å²	132.2	77%	0.77	75%	0.747	S	S	*	*			trans	72.6	90.4	-172.9	-167.2	0	0	0	0	111
968	A	24.2	Very low	28	Very low	85 Å²	85	134.5 Å²	134.5	70%	0.702	74%	0.743	S	S	*	*				66.4	109.8	50	0	0	0	0	0	114.3
969	T	30.2	Very low	28	Very low	133 Å²	133	133 Å²	133	82%	0.816	73%	0.727	S	S	*	*			trans	-163.4	110.2	137.1	19.6	0	0	0	0	112	K971	T969-K971 PolarHBondContact O-N 2.88Å
970	T	25.4	Very low	28.3	Very low	137 Å²	137	135 Å²	135	84%	0.84	73%	0.732	S	S	*	*				42.8	66.5	113.9	-36.6	0	0	0	0	118.5
971	K	30.9	Very low	28.5	Very low	194 Å²	194	131.9 Å²	131.9	84%	0.843	73%	0.725	S	S	*	*			trans	-141.7	136.8	144.9	-82.8	-171.4	-177.6	174.7	0	109	T969	T969-K971 PolarHBondContact O-N 2.88Å
972	R	30.5	Very low	28.7	Very low	221 Å²	221	131 Å²	131	83%	0.834	72%	0.717	S	S	*	*			cis	-153.6	165.8	-17.9	-156.1	177	-165.6	177.2	5.3	108.1
973	T	28.9	Very low	28.9	Very low	114 Å²	114	129.4 Å²	129.4	70%	0.699	70%	0.704	S	S	*	*			trans	-48.7	145.8	162.7	48.9	0	0	0	0	112.3
974	M	24.3	Very low	29	Very low	172 Å²	172	127.3 Å²	127.3	85%	0.847	68%	0.683	S	S	*	*			trans	15.4	125.9	146.1	-57.8	172.8	157.8	0	0	118.3
975	I	30.7	Very low	29.1	Very low	148 Å²	148	127.8 Å²	127.8	76%	0.759	67%	0.672	S	S	*	*				166.5	107	117.4	-84.7	158.3	0	0	0	110.1
976	E	25.6	Very low	29.2	Very low	150 Å²	150	129.2 Å²	129.2	70%	0.701	67%	0.672	S	S	*	*				45.3	142.9	129.6	-60.9	-164.8	101.8	0	0	125.1
977	N	26	Very low	29.7	Very low	127 Å²	127	131.2 Å²	131.2	68%	0.679	67%	0.67	S	S	*	*			trans	48.1	128.6	130.7	-53.2	-22.1	0	0	0	121.3
978	K	28	Very low	29.7	Very low	126 Å²	126	134 Å²	134	55%	0.548	68%	0.675	S	S	.	*				-164.6	142.6	92.9	-112.9	175	177.4	171.9	0	116	N1004	K978-N1004 PolarHBondContact NZ-OD1 2.73Å
979	R	24.9	Very low	30.2	Very low	141 Å²	141	134.5 Å²	134.5	53%	0.532	67%	0.671	S	S	.	*			trans	1.7	139	144	-57.7	174	-179.5	-178.3	-4.5	119.3	N1002	R979-N1002 PolarHBondContact NH1-OD1 2.86Å; R979-N1002 PolarHBondContact NH2-OD1 3.02Å; R979-N1002 VanDerWaalsContact NH2-OD1 3.16Å
980	I	30.4	Very low	29.9	Very low	161 Å²	161	133 Å²	133	83%	0.826	67%	0.666	S	S	*	*	S	Bend	trans	-126.4	121.6	133.7	-68.1	176.3	0	0	0	103.4
981	N	30.3	Very low	29.9	Very low	122 Å²	122	131.7 Å²	131.7	65%	0.652	66%	0.662	S	S	*	*			cis	-105.8	-176.4	19.4	-63.1	-4.8	0	0	0	113.3
982	N	32.6	Very low	29.9	Very low	92 Å²	92	130 Å²	130	49%	0.492	66%	0.662	S	S	.	*			cis	-163.2	-177	-35.6	-102.5	58	0	0	0	108.2	V1003	N982-V1003 CarbonylContact C-O 3.58Å; N982-V1003 PolarHBondContact O-N 3.28Å
983	N	34.1	Very low	29.6	Very low	66 Å²	66	126.8 Å²	126.8	35%	0.353	66%	0.661	S	S	.	*	B	Isolated β-bridge	trans	0.4	153.9	148	-59.5	84.3	0	0	0	119.7	Q1001 N1002 V1003	N983-Q1001 WeakPolarHBondContact O-CB 3.49Å; N983-N1002 VanDerWaalsContact C-N 3.34Å; N983-N1002 PolarHBondContact O-N 2.71Å; N983-V1003 VanDerWaalsContact C-N 3.29Å; N983-V1003 PolarHBondContact N-O 2.79Å; N983-V1003 PolarHBondContact O-N 2.83Å
984	D	36.4	Very low	29.5	Very low	80 Å²	80	127.9 Å²	127.9	43%	0.428	66%	0.662	S	S	.	*			cis	-154.5	103.4	-16	-88.2	-25.1	0	0	0	109.9
985	D	35.6	Very low	29.6	Very low	67 Å²	67	128.2 Å²	128.2	36%	0.358	66%	0.659	S	S	.	*				54.5	-157.4	126.2	-57.7	-5.6	0	0	0	123	V1003 N1004	D985-V1003 VanDerWaalsContact OD1-C 3.23Å; D985-V1003 WeakPolarHBondContact OD1-CA 3.41Å; D985-N1004 PolarHBondContact OD1-N 3.2Å
986	D	33	Very low	29.6	Very low	126 Å²	126	126 Å²	126	67%	0.674	65%	0.652	S	S	*	*				-155.4	159.2	-120.5	-168.6	14.7	0	0	0	115.8
987	K	34.3	Very low	29.9	Very low	166 Å²	166	126.8 Å²	126.8	72%	0.722	66%	0.655	S	S	*	*			trans	59.3	122.1	168	-59.4	-176	-176.8	69	0	123.5
988	Q	27.4	Very low	30.1	Very low	185 Å²	185	127.9 Å²	127.9	86%	0.864	66%	0.656	S	S	*	*			trans	36.3	163.3	133.1	-78.2	-154.3	10	0	0	124.1
989	P	35.1	Very low	30.3	Very low	97 Å²	97	130.1 Å²	130.1	63%	0.63	67%	0.668	S	S	*	*			cis	-132	175.7	-12	36.9	-18.4	0	0	0	115.9
990	S	24.2	Very low	30.4	Very low	101 Å²	101	131.8 Å²	131.8	71%	0.706	68%	0.682	S	S	*	*			trans	55.4	117.9	155.2	62.9	0	0	0	0	122.1
991	S	25.1	Very low	30.3	Very low	109 Å²	109	131.1 Å²	131.1	76%	0.762	68%	0.675	S	S	*	*			trans	62.5	113.2	138.6	-54.5	0	0	0	0	121.6
992	N	30.3	Very low	30.2	Very low	158 Å²	158	130 Å²	130	85%	0.845	67%	0.669	S	S	*	*			trans	54.3	80.6	140.3	-64.9	-17.2	0	0	0	119.2
993	L	25.3	Very low	29.9	Very low	155 Å²	155	126.9 Å²	126.9	81%	0.812	65%	0.654	S	S	*	*				-154	110.7	119.5	-106.1	173.4	0	0	0	111.3
994	I	25.4	Very low	29.5	Very low	137 Å²	137	128.3 Å²	128.3	70%	0.703	66%	0.661	S	S	*	*			trans	52	117.8	133.3	-76.3	-179.5	0	0	0	119.5
995	F	27.9	Very low	29	Very low	179 Å²	179	132.5 Å²	132.5	79%	0.785	68%	0.676	S	S	*	*			trans	92.6	109.4	148.3	-91	-124.9	0	0	0	122.1
996	T	30.7	Very low	28.7	Very low	100 Å²	100	134 Å²	134	61%	0.613	69%	0.692	S	S	*	*				74.2	114.2	129.5	52.2	0	0	0	0	123
997	E	31.2	Very low	28.4	Very low	167 Å²	167	133.9 Å²	133.9	78%	0.78	70%	0.696	S	S	*	*				87.3	93.2	128.6	-63	-177	160.5	0	0	121.8
998	H	31.2	Very low	28	Very low	151 Å²	151	133.6 Å²	133.6	70%	0.699	70%	0.701	S	S	*	*				71.9	96.1	127.6	-70.9	-65.5	0	0	0	122.9
999	H	31.4	Very low	28.2	Very low	172 Å²	172	130.2 Å²	130.2	80%	0.796	69%	0.689	S	S	*	*			trans	79.3	137.1	142	-58.9	-64.2	0	0	0	120.2
1000	H	27	Very low	28	Very low	177 Å²	177	131 Å²	131	82%	0.819	69%	0.688	S	S	*	*			trans	-83.6	154.5	-158.4	-85	-97.3	0	0	0	116.6
1001	Q	28.3	Very low	28.1	Very low	146 Å²	146	132.7 Å²	132.7	68%	0.682	69%	0.687	S	S	*	*			trans	-112.1	-169	162	-65.7	-172.8	-22.3	0	0	110.1	N983	N983-Q1001 WeakPolarHBondContact O-CB 3.49Å
1002	N	27.5	Very low	28.2	Very low	98 Å²	98	133.6 Å²	133.6	52%	0.524	68%	0.684	S	S	.	*	B	Isolated β-bridge	trans	-132.6	-37.1	-146.5	-154.8	-121.5	0	0	0	124.1	R979 N983	R979-N1002 PolarHBondContact NH1-OD1 2.86Å; R979-N1002 PolarHBondContact NH2-OD1 3.02Å; R979-N1002 VanDerWaalsContact NH2-OD1 3.16Å; N983-N1002 VanDerWaalsContact C-N 3.34Å; N983-N1002 PolarHBondContact O-N 2.71Å
1003	V	26.2	Very low	28.3	Very low	28 Å²	28	133.5 Å²	133.5	17%	0.17	68%	0.678	C	S	.	*			trans	-159.6	141.6	-167.3	98.8	0	0	0	0	122.2	N982 N983 D985	N982-V1003 CarbonylContact C-O 3.58Å; N982-V1003 PolarHBondContact O-N 3.28Å; N983-V1003 VanDerWaalsContact C-N 3.29Å; N983-V1003 PolarHBondContact N-O 2.79Å; N983-V1003 PolarHBondContact O-N 2.83Å; D985-V1003 VanDerWaalsContact OD1-C 3.23Å; D985-V1003 WeakPolarHBondContact OD1-CA 3.41Å
1004	N	26.1	Very low	28.2	Very low	96 Å²	96	132.6 Å²	132.6	51%	0.513	67%	0.674	S	S	.	*			trans	100.6	109.4	143.7	-102	41.9	0	0	0	120.5	K978 D985	K978-N1004 PolarHBondContact NZ-OD1 2.73Å; D985-N1004 PolarHBondContact OD1-N 3.2Å
1005	F	27	Very low	28.4	Very low	168 Å²	168	132 Å²	132	74%	0.737	67%	0.672	S	S	*	*			trans	-133.5	167.8	149.4	-95.8	-102.8	0	0	0	111.3
1006	S	27.4	Very low	28.5	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	67%	0.667	S	S	*	*				-158.5	176.3	-79.3	55.2	0	0	0	0	109.9
1007	T	26.7	Very low	28.2	Very low	123 Å²	123	132.4 Å²	132.4	76%	0.755	68%	0.678	S	S	*	*			trans	-64.1	151.3	-172.7	45.7	0	0	0	0	115.9
1008	L	27.5	Very low	28	Very low	160 Å²	160	130.5 Å²	130.5	84%	0.838	67%	0.671	S	S	*	*			trans	-114.8	126.2	143.8	-122.3	80.4	0	0	0	109.8
1009	N	31.7	Very low	28	Very low	114 Å²	114	129.5 Å²	129.5	61%	0.61	67%	0.671	S	S	*	*				41.1	145.2	120.2	-59.3	51.5	0	0	0	119.9
1010	D	29.5	Very low	27.9	Very low	114 Å²	114	128 Å²	128	61%	0.61	67%	0.668	S	S	*	*			cis	-158.9	138.6	-5.7	-108.4	-20.1	0	0	0	111.7
1011	I	26.1	Very low	28.1	Very low	135 Å²	135	124.6 Å²	124.6	69%	0.692	66%	0.66	S	S	*	*				41.3	135	114.5	-64.1	179	0	0	0	120.3
1012	N	27.9	Very low	28.1	Very low	128 Å²	128	123.5 Å²	123.5	68%	0.684	66%	0.659	S	S	*	*			trans	96.1	136.5	149.5	-89.1	-16.2	0	0	0	122.6
1013	Q	31.5	Very low	28	Very low	156 Å²	156	123.1 Å²	123.1	73%	0.729	66%	0.664	S	S	*	*			trans	70.8	153.9	145.3	-70.5	164.4	40.5	0	0	118.8
1014	L	23.5	Very low	28.1	Very low	136 Å²	136	127.1 Å²	127.1	71%	0.712	69%	0.693	S	S	*	*			cis	-168.7	-179.3	-36.2	-148.4	65.4	0	0	0	106.6
1015	D	29.1	Very low	28.1	Very low	126 Å²	126	130.2 Å²	130.2	67%	0.674	70%	0.704	S	S	*	*			trans	69.5	147.9	156.3	-52.8	-30.1	0	0	0	120.2
1016	D	30.2	Very low	28	Very low	127 Å²	127	128.5 Å²	128.5	68%	0.679	70%	0.702	S	S	*	*			trans	39.3	108.3	155.2	-55.2	-10	0	0	0	118.7
1017	L	24.5	Very low	28	Very low	159 Å²	159	130.6 Å²	130.6	83%	0.832	70%	0.704	S	S	*	*			cis	50.5	79.5	23.9	-159	-159.4	0	0	0	113.1
1018	I	28.3	Very low	28.1	Very low	127 Å²	127	132.2 Å²	132.2	65%	0.651	70%	0.703	S	S	*	*			trans	-165.3	128.3	158.1	-112.6	151.7	0	0	0	114
1019	L	30.4	Very low	28.2	Very low	131 Å²	131	131.4 Å²	131.4	69%	0.686	70%	0.695	S	S	*	*			trans	66.5	154.5	143.8	-68.8	-171.4	0	0	0	121.8
1020	L	30.4	Very low	28.1	Very low	140 Å²	140	133 Å²	133	73%	0.733	70%	0.699	S	S	*	*			cis	-133.5	162.1	-10.1	-76.9	108.5	0	0	0	107
1021	T	31.2	Very low	28.2	Very low	106 Å²	106	134.7 Å²	134.7	65%	0.65	70%	0.703	S	S	*	*			cis	-158.2	138.8	1.1	15.4	0	0	0	0	105.4
1022	D	27	Very low	28.5	Very low	123 Å²	123	132.9 Å²	132.9	66%	0.658	70%	0.702	S	S	*	*				62	144.9	70	-77.5	-56.7	0	0	0	114.4
1023	S	25.4	Very low	28.8	Very low	90 Å²	90	132.6 Å²	132.6	63%	0.629	71%	0.705	S	S	*	*			cis	-174.5	-168.4	-17.3	-113.6	0	0	0	0	107.4
1024	S	28.6	Very low	28.9	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	70%	0.7	S	S	*	*			trans	79.6	158.8	166.6	-47.8	0	0	0	0	115.7
1025	Q	25.4	Very low	29.2	Very low	161 Å²	161	131.4 Å²	131.4	75%	0.752	70%	0.7	S	S	*	*			cis	-176.9	158.3	-41.8	-119.7	-179.2	27.7	0	0	106.8
1026	L	26.5	Very low	29	Very low	131 Å²	131	132 Å²	132	69%	0.686	70%	0.702	S	S	*	*			trans	62.7	121.3	153.4	-62.9	163.6	0	0	0	120.6
1027	I	26.6	Very low	28.9	Very low	143 Å²	143	135 Å²	135	73%	0.733	71%	0.709	S	S	*	*				81.3	144.6	129.5	-67.3	175.8	0	0	0	119.9
1028	E	29.3	Very low	29.6	Very low	158 Å²	158	132.9 Å²	132.9	74%	0.738	71%	0.705	S	S	*	*			trans	77.7	111.1	165.4	-81.3	179.5	146.1	0	0	123.2
1029	Q	28.9	Very low	29.4	Very low	143 Å²	143	135.3 Å²	135.3	67%	0.668	72%	0.717	S	S	*	*			trans	78.6	115.9	132.6	-65	176.3	39.8	0	0	122.4
1030	Q	29.4	Very low	29.2	Very low	147 Å²	147	133.9 Å²	133.9	69%	0.687	72%	0.718	S	S	*	*			trans	70.6	131.4	142	-66.1	-170.9	-67.8	0	0	120
1031	E	31.4	Very low	29	Very low	150 Å²	150	136.7 Å²	136.7	70%	0.701	72%	0.724	S	S	*	*			cis	-162	138.5	-7.6	-143.8	156.9	-127.6	0	0	113.4
1032	S	34	Very low	28.8	Very low	96 Å²	96	136.4 Å²	136.4	67%	0.671	73%	0.727	S	S	*	*			trans	49.5	151.2	147.8	61.6	0	0	0	0	123
1033	T	34.1	Very low	28.9	Very low	123 Å²	123	137.9 Å²	137.9	76%	0.755	73%	0.733	S	S	*	*			cis	179.8	161.7	-17.3	36.4	0	0	0	0	105.4
1034	D	31.9	Very low	28.9	Very low	117 Å²	117	138.6 Å²	138.6	63%	0.626	74%	0.738	S	S	*	*			cis	-158.5	146.9	-2.7	-120.1	21.7	0	0	0	107.7
1035	Q	31.2	Very low	29.1	Very low	150 Å²	150	138.9 Å²	138.9	70%	0.701	74%	0.737	S	S	*	*				66	151.2	85.6	-62.4	-162.6	84.4	0	0	118.5
1036	L	25.3	Very low	29.4	Very low	138 Å²	138	136 Å²	136	72%	0.723	74%	0.735	S	S	*	*			cis	-170.9	146.6	-43.4	-115.2	175.3	0	0	0	111.4
1037	K	26.5	Very low	29.7	Very low	191 Å²	191	135.7 Å²	135.7	83%	0.83	74%	0.741	S	S	*	*			trans	21.3	155.7	157.3	-79.9	-179.8	176.9	176.9	0	125.6
1038	P	39.9	Very low	29.8	Very low	114 Å²	114	133.8 Å²	133.8	74%	0.74	74%	0.74	S	S	*	*			trans	-104.5	174.9	175.1	42.4	-36.7	0	0	0	115.4
1039	I	24.5	Very low	29.6	Very low	177 Å²	177	134.1 Å²	134.1	91%	0.908	75%	0.746	S	S	*	*			trans	-164.9	173.7	158.6	-109.9	156.8	0	0	0	112.4
1040	S	25.6	Very low	30	Very low	102 Å²	102	132 Å²	132	71%	0.713	75%	0.745	S	S	*	*			trans	-128.1	160.3	-159.9	59	0	0	0	0	117.1
1041	K	26.3	Very low	29.7	Very low	198 Å²	198	130.7 Å²	130.7	86%	0.861	75%	0.747	S	S	*	*			trans	176.7	155.9	137.7	-100.4	164.3	-175.5	177.7	0	117.1
1042	S	27.5	Very low	29.3	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	75%	0.75	S	S	*	*			trans	68.2	111.3	149.9	56.1	0	0	0	0	125.4
1043	I	27.7	Very low	28.9	Very low	154 Å²	154	130.9 Å²	130.9	79%	0.79	76%	0.755	S	S	*	*				73.8	98.9	123.7	-58.9	170.8	0	0	0	120.3
1044	S	25.5	Very low	28.6	Very low	104 Å²	104	131.7 Å²	131.7	73%	0.727	76%	0.76	S	S	*	*				32	167.3	128	76.2	0	0	0	0	123.3
1045	P	34.1	Very low	28.5	Very low	118 Å²	118	131.3 Å²	131.3	77%	0.766	77%	0.767	S	S	*	*			cis	-117.7	-169.1	-1.4	46.4	-33.5	0	0	0	111.1
1046	S	30.5	Very low	28.5	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	77%	0.772	S	S	*	*			cis	-166.2	164.6	16.3	46.5	0	0	0	0	108.6
1047	P	32.5	Very low	28.7	Very low	124 Å²	124	130.3 Å²	130.3	81%	0.805	77%	0.77	S	S	*	*			cis	-106.7	-137.9	-10.6	39.2	-23.8	0	0	0	108.3
1048	S	29.5	Very low	28.9	Very low	103 Å²	103	125.8 Å²	125.8	72%	0.72	76%	0.763	S	S	*	*			cis	-153.1	145.9	-8.5	32.2	0	0	0	0	110.3
1049	L	24.4	Very low	28.3	Very low	165 Å²	165	125.2 Å²	125.2	86%	0.864	76%	0.761	S	S	*	*			trans	-167.7	177.9	169.9	-142.5	72.4	0	0	0	107.2
1050	P	37.2	Very low	28.5	Very low	99 Å²	99	121.7 Å²	121.7	64%	0.643	75%	0.752	S	S	*	*				-110.3	-162.2	-77.7	33.6	-17.4	0	0	0	113.7
1051	T	24.2	Very low	28.4	Very low	118 Å²	118	121.5 Å²	121.5	72%	0.724	75%	0.751	S	S	*	*			trans	87.5	128.7	149.4	31.7	0	0	0	0	122.6
1052	T	23.6	Very low	28.2	Very low	124 Å²	124	119 Å²	119	76%	0.761	75%	0.752	S	S	*	*			trans	80.7	141.3	151.4	50.3	0	0	0	0	122.5
1053	T	25.2	Very low	28.1	Very low	127 Å²	127	118.6 Å²	118.6	78%	0.779	75%	0.749	S	S	*	*			trans	70.4	130.5	171.5	55.7	0	0	0	0	119.1
1054	T	27.7	Very low	28	Very low	139 Å²	139	115.5 Å²	115.5	85%	0.853	74%	0.741	S	S	*	*			trans	50.7	120.4	171.7	56.6	0	0	0	0	116.9
1055	S	29.3	Very low	28	Very low	110 Å²	110	115.2 Å²	115.2	77%	0.769	74%	0.739	S	S	*	*			cis	-164.1	170.1	3.5	62.6	0	0	0	0	108.5
1056	L	30.8	Very low	27.5	Very low	154 Å²	154	116.9 Å²	116.9	81%	0.806	74%	0.741	S	S	*	*			cis	-147.1	-138.1	-1.9	-138.6	173	0	0	0	109.1
1057	T	30.1	Very low	27.1	Very low	113 Å²	113	116.5 Å²	116.5	69%	0.693	74%	0.738	S	S	*	*			trans	-69	160.3	169.5	44.1	0	0	0	0	113
1058	S	31.1	Very low	26.8	Very low	96 Å²	96	115.1 Å²	115.1	67%	0.671	73%	0.731	S	S	*	*			cis	-177.1	124.4	-8.5	47.7	0	0	0	0	106.4
1059	S	25.9	Very low	26.5	Very low	102 Å²	102	116.3 Å²	116.3	71%	0.713	73%	0.734	S	S	*	*				58.1	153.2	106.8	80.4	0	0	0	0	118.4
1060	S	28.9	Very low	26.5	Very low	102 Å²	102	114.6 Å²	114.6	71%	0.713	73%	0.731	S	S	*	*			trans	63.8	131.7	171.9	30.5	0	0	0	0	115.9
1061	S	23.4	Very low	25.9	Very low	99 Å²	99	116.7 Å²	116.7	69%	0.692	74%	0.735	S	S	*	*			cis	75.2	120.3	33.3	84.6	0	0	0	0	114.7
1062	V	23.6	Very low	26.1	Very low	145 Å²	145	118.2 Å²	118.2	88%	0.879	74%	0.738	S	S	*	*			trans	58.6	155.4	175.3	-100.6	0	0	0	0	115.4
1063	S	25.4	Very low	26.2	Very low	92 Å²	92	123.2 Å²	123.2	64%	0.643	74%	0.743	S	S	*	*			cis	-156.3	178.5	-1	50.6	0	0	0	0	111.3
1064	S	24.9	Very low	26.3	Very low	90 Å²	90	123.6 Å²	123.6	63%	0.629	74%	0.74	S	S	*	*			trans	27	103.7	140.8	63.5	0	0	0	0	118.3
1065	S	24.6	Very low	26.2	Very low	97 Å²	97	123.6 Å²	123.6	68%	0.678	74%	0.735	S	S	*	*				82.2	146.3	79.8	71	0	0	0	0	115.7
1066	L	23.9	Very low	26.2	Very low	154 Å²	154	125.9 Å²	125.9	81%	0.806	74%	0.738	S	S	*	*			trans	70.6	146	173.9	-58.5	158.7	0	0	0	114.7
1067	S	23.7	Very low	26.2	Very low	93 Å²	93	123.5 Å²	123.5	65%	0.65	73%	0.734	S	S	*	*			cis	-164.1	175.5	-13.9	50.1	0	0	0	0	110.7
1068	S	24.5	Very low	26.1	Very low	96 Å²	96	129.1 Å²	129.1	67%	0.671	74%	0.742	S	S	*	*			trans	68.9	103	156.7	-55.5	0	0	0	0	118.8
1069	T	23.8	Very low	25.8	Very low	127 Å²	127	131.6 Å²	131.6	78%	0.779	75%	0.748	S	S	*	*				65.8	130.7	77.9	65.6	0	0	0	0	115.4
1070	T	24.5	Very low	25.9	Very low	130 Å²	130	133.2 Å²	133.2	80%	0.798	75%	0.754	S	S	*	*			cis	-136.8	-110.2	-6.5	-29.4	0	0	0	0	111.3
1071	I	25.8	Very low	25.7	Very low	142 Å²	142	135.5 Å²	135.5	73%	0.728	76%	0.757	S	S	*	*			cis	-157.9	165.5	-6.2	-20.4	171.7	0	0	0	109.9
1072	L	27.9	Very low	25.8	Very low	150 Å²	150	139.5 Å²	139.5	79%	0.785	77%	0.767	S	S	*	*			trans	78.1	140.2	172.9	-54.3	176.1	0	0	0	116.4
1073	R	26.2	Very low	25.7	Very low	230 Å²	230	137.1 Å²	137.1	87%	0.868	76%	0.756	S	S	*	*			cis	-141.5	140.3	13.9	-146.8	172.7	-163.4	159.4	3.8	112.8
1074	N	25.6	Very low	25.7	Very low	134 Å²	134	140 Å²	140	72%	0.717	76%	0.764	S	S	*	*			trans	-73.7	154.3	178.4	-48.4	-17.6	0	0	0	112
1075	N	26	Very low	25.8	Very low	140 Å²	140	142.3 Å²	142.3	75%	0.749	77%	0.769	S	S	*	*				161.2	158.6	97.1	-103.6	-28.5	0	0	0	114.9
1076	L	30.3	Very low	25.9	Very low	158 Å²	158	143.1 Å²	143.1	83%	0.827	77%	0.769	S	S	*	*			trans	62.1	155.1	172.7	-82.9	70.8	0	0	0	115
1077	S	29.4	Very low	26	Very low	103 Å²	103	139.9 Å²	139.9	72%	0.72	76%	0.76	S	S	*	*			cis	-176.2	175.3	-22.1	67.6	0	0	0	0	105.8
1078	R	29.3	Very low	26.1	Very low	231 Å²	231	143.2 Å²	143.2	87%	0.872	77%	0.77	S	S	*	*			cis	-158.2	159	-3	-161.1	178.2	176.6	118.9	-3.2	106.7
1079	N	24.6	Very low	26.2	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	77%	0.769	S	S	*	*			trans	-64	143	163.5	-64	-39.9	0	0	0	111.2
1080	T	28.4	Very low	26.3	Very low	136 Å²	136	140.9 Å²	140.9	83%	0.834	77%	0.769	S	S	*	*				-158.2	140	127.7	-34.2	0	0	0	0	109.8
1081	L	24.1	Very low	26.4	Very low	149 Å²	149	142.2 Å²	142.2	78%	0.78	77%	0.77	S	S	*	*			trans	-79.8	163.6	163	-59.5	90.7	0	0	0	109.7
1082	M	25.2	Very low	26.6	Very low	183 Å²	183	141.6 Å²	141.6	90%	0.901	77%	0.773	S	S	*	*				-154.9	138.1	124.9	-107.3	-52.7	172.7	0	0	111.3
1083	C	22.5	Very low	26.5	Very low	96 Å²	96	139.4 Å²	139.4	65%	0.649	77%	0.77	S	S	*	*			trans	-108	141.6	164.4	-71.9	0	0	0	0	108.5
1084	N	25.1	Very low	27	Very low	151 Å²	151	133.5 Å²	133.5	81%	0.807	76%	0.761	S	S	*	*			trans	64.8	132.3	163.6	-51.3	-28.5	0	0	0	117.3
1085	L	25.6	Very low	27.1	Very low	139 Å²	139	132.7 Å²	132.7	73%	0.728	76%	0.764	S	S	*	*				-166.8	125.1	106.8	-99	166.7	0	0	0	110.9
1086	V	27.2	Very low	27.5	Very low	114 Å²	114	133.1 Å²	133.1	69%	0.691	77%	0.765	S	S	*	*			trans	53.1	116.2	135.8	169	0	0	0	0	119.6
1087	S	26.4	Very low	27.4	Very low	87 Å²	87	131.1 Å²	131.1	61%	0.608	76%	0.76	S	S	*	*			trans	-26.1	143.2	148.3	49.5	0	0	0	0	115.3
1088	D	26.4	Very low	27.4	Very low	162 Å²	162	131 Å²	131	87%	0.866	76%	0.759	S	S	*	*				-170.1	178.2	78	-100.1	-39.4	0	0	0	111.6
1089	G	26.7	Very low	27.2	Very low	63 Å²	63	125 Å²	125	65%	0.649	75%	0.753	S	S	*	*			trans	93.9	64.1	146.5	0	0	0	0	0	118.1
1090	S	25.1	Very low	27.2	Very low	111 Å²	111	125.7 Å²	125.7	78%	0.776	76%	0.755	S	S	*	*				38	144.5	117.1	-53.5	0	0	0	0	122.4
1091	I	26.5	Very low	27.1	Very low	158 Å²	158	126.2 Å²	126.2	81%	0.81	75%	0.751	S	S	*	*			trans	93.5	114.8	141.4	-78.1	161.5	0	0	0	119.3
1092	V	29.2	Very low	27.2	Very low	130 Å²	130	128.4 Å²	128.4	79%	0.788	76%	0.755	S	S	*	*			trans	58.7	106.6	169.1	-115.8	0	0	0	0	122
1093	S	27.2	Very low	27.3	Very low	104 Å²	104	124.4 Å²	124.4	73%	0.727	75%	0.745	S	S	*	*				1.9	158.3	107.5	-111.5	0	0	0	0	118.5
1094	P	36.7	Very low	27.7	Very low	106 Å²	106	125.2 Å²	125.2	69%	0.688	75%	0.747	S	S	*	*				-153.5	175.6	53.5	44.3	-24.7	0	0	0	118.5
1095	C	28.1	Very low	27.9	Very low	116 Å²	116	125.4 Å²	125.4	78%	0.784	75%	0.748	S	S	*	*			trans	69.4	145.4	158.1	-64	0	0	0	0	116.4
1096	I	32.4	Very low	28	Very low	149 Å²	149	124.9 Å²	124.9	76%	0.764	75%	0.751	S	S	*	*			cis	-133.8	127.3	18.2	-75.1	-178.9	0	0	0	111.7
1097	T	29.4	Very low	28	Very low	116 Å²	116	124.6 Å²	124.6	71%	0.712	75%	0.754	S	S	*	*			trans	40.4	132.7	154.5	64.2	0	0	0	0	124.1
1098	S	28.3	Very low	28.2	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	76%	0.762	S	S	*	*				56.7	121.4	125.9	-50.2	0	0	0	0	119.5
1099	S	25.7	Very low	28.4	Very low	106 Å²	106	126.7 Å²	126.7	74%	0.741	76%	0.756	S	S	*	*			cis	64.9	131.1	37.7	-40.6	0	0	0	0	114.7
1100	L	25	Very low	29	Very low	162 Å²	162	129.1 Å²	129.1	85%	0.848	76%	0.76	S	S	*	*			trans	66.1	166.4	179.7	-49.7	168.1	0	0	0	112.2
1101	I	26.9	Very low	29.3	Very low	147 Å²	147	130.9 Å²	130.9	75%	0.754	76%	0.76	S	S	*	*			cis	-143.7	167.6	2.1	-142.1	151.9	0	0	0	111.1
1102	F	25.7	Very low	29.4	Very low	195 Å²	195	126.5 Å²	126.5	86%	0.855	76%	0.755	S	S	*	*			trans	-28.5	164	158.7	-96.6	-110.8	0	0	0	119.5
1103	S	28	Very low	29.3	Very low	100 Å²	100	128 Å²	128	70%	0.699	76%	0.758	S	S	*	*			trans	-76.7	152.3	-175.7	-49.8	0	0	0	0	116.3
1104	T	30.6	Very low	29.5	Very low	113 Å²	113	128 Å²	128	69%	0.693	75%	0.753	S	S	*	*			trans	56.9	115.6	142.3	50.9	0	0	0	0	121
1105	D	28.6	Very low	29.1	Very low	154 Å²	154	131 Å²	131	82%	0.824	76%	0.758	S	S	*	*			trans	76.6	163.8	132.6	-55.6	-22	0	0	0	120.4
1106	T	28.1	Very low	29.1	Very low	128 Å²	128	130.4 Å²	130.4	79%	0.785	76%	0.755	S	S	*	*			trans	-115.9	138.6	-157.6	40.5	0	0	0	0	114
1107	S	27.3	Very low	28.9	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	75%	0.752	S	S	*	*			trans	89.1	151	149.3	79.3	0	0	0	0	120.9
1108	I	30.5	Very low	28.9	Very low	151 Å²	151	130.9 Å²	130.9	77%	0.774	75%	0.753	S	S	*	*			trans	80.4	73.8	163.8	-45.5	178.6	0	0	0	118.2
1109	I	30.9	Very low	29.1	Very low	143 Å²	143	133.9 Å²	133.9	73%	0.733	76%	0.756	S	S	*	*				22.7	122.8	112.1	-65.7	174.3	0	0	0	115.5
1110	P	39.4	Very low	29.4	Very low	114 Å²	114	133 Å²	133	74%	0.74	75%	0.749	S	S	*	*				-148.3	163.1	77.2	40.5	-22.8	0	0	0	120
1111	N	30.7	Very low	29.9	Very low	147 Å²	147	131.8 Å²	131.8	79%	0.786	74%	0.744	S	S	*	*			trans	-20.9	154.1	157.1	-40.2	-24.3	0	0	0	117.7
1112	G	29.4	Very low	30.1	Very low	67 Å²	67	132.5 Å²	132.5	69%	0.691	75%	0.748	S	S	*	*			cis	129	165.5	-1.6	0	0	0	0	0	114.4
1113	L	26.9	Very low	30.3	Very low	162 Å²	162	128.4 Å²	128.4	85%	0.848	74%	0.742	S	S	*	*			trans	73.4	158.7	165.5	-55.2	175	0	0	0	116.8
1114	T	30	Very low	30.5	Very low	102 Å²	102	128.4 Å²	128.4	63%	0.626	74%	0.742	S	S	*	*			cis	-157.2	156.7	10	-11.2	0	0	0	0	112.4
1115	E	29	Very low	30.3	Very low	171 Å²	171	129.5 Å²	129.5	80%	0.799	74%	0.743	S	S	*	*			trans	66.5	156.6	148.5	-74.3	173.4	-143	0	0	120.4
1116	S	28	Very low	30.3	Very low	102 Å²	102	132.4 Å²	132.4	71%	0.713	74%	0.742	S	S	*	*			cis	-168.5	169.2	-5.5	-107.7	0	0	0	0	108.9
1117	C	27.5	Very low	29.9	Very low	105 Å²	105	131.8 Å²	131.8	71%	0.709	74%	0.743	S	S	*	*			cis	-177.7	167.8	-29	-171	0	0	0	0	108.9
1118	K	29.7	Very low	29.8	Very low	170 Å²	170	130 Å²	130	74%	0.739	73%	0.731	S	S	*	*			trans	74.8	142	171	-55.6	178.4	-177.7	173.3	0	116.3
1119	H	32.2	Very low	29.5	Very low	165 Å²	165	127.6 Å²	127.6	76%	0.764	73%	0.727	S	S	*	*			cis	-167.8	173.3	-2.3	-100.1	-26	0	0	0	107.4
1120	S	32.9	Very low	29.4	Very low	86 Å²	86	126.4 Å²	126.4	60%	0.601	73%	0.732	S	S	*	*			cis	-173.2	178.5	-7.2	46.5	0	0	0	0	109.8
1121	N	36.6	Very low	29	Very low	138 Å²	138	128.7 Å²	128.7	74%	0.738	74%	0.736	S	S	*	*			trans	74.9	111.4	169.6	-58.4	-17.1	0	0	0	116.6
1122	L	29.7	Very low	28.9	Very low	161 Å²	161	127.6 Å²	127.6	84%	0.843	73%	0.73	S	S	*	*				104.2	154.7	86.2	-106.4	72.2	0	0	0	112.8
1123	P	31.3	Very low	29	Very low	110 Å²	110	130.3 Å²	130.3	71%	0.714	73%	0.729	S	S	*	*			trans	-92	-175.6	-163.3	40.8	-40.2	0	0	0	113.8
1124	S	30.6	Very low	29	Very low	100 Å²	100	130.5 Å²	130.5	70%	0.699	73%	0.725	S	S	*	*			cis	-156.1	140.1	23.7	44.8	0	0	0	0	110.9
1125	L	27.2	Very low	28.8	Very low	136 Å²	136	132.5 Å²	132.5	71%	0.712	73%	0.731	S	S	*	*				60.7	133.4	75.2	-72.8	167.7	0	0	0	113.1
1126	W	27.8	Very low	28.5	Very low	214 Å²	214	129.6 Å²	129.6	81%	0.811	73%	0.726	S	S	*	*			cis	-123.8	165.7	20.7	-77	-28.3	0	0	0	113.6	S1128	W1126-S1128 VanDerWaalsContact CD1-CA 3.45Å
1127	S	20.8	Very low	28.4	Very low	116 Å²	116	131.5 Å²	131.5	81%	0.811	73%	0.726	S	S	*	*	S	Bend	cis	-53.2	143.5	34.2	53.7	0	0	0	0	117.7
1128	S	25	Very low	28.5	Very low	71 Å²	71	132.2 Å²	132.2	50%	0.497	73%	0.729	S	S	.	*			trans	-93.2	143.4	-172.7	53.5	0	0	0	0	112.8	W1126	W1126-S1128 VanDerWaalsContact CD1-CA 3.45Å
1129	S	24.8	Very low	28.3	Very low	100 Å²	100	130.4 Å²	130.4	70%	0.699	73%	0.726	S	S	*	*			trans	55.2	107.5	156.9	58.9	0	0	0	0	118.7
1130	S	28.1	Very low	28	Very low	118 Å²	118	129.4 Å²	129.4	83%	0.825	73%	0.725	S	S	*	*				-168.7	123.9	115.1	-80.7	0	0	0	0	111.6
1131	I	30.4	Very low	27.8	Very low	161 Å²	161	131.3 Å²	131.3	83%	0.826	73%	0.733	S	S	*	*			trans	-167.1	128.1	144.1	-105.7	160.2	0	0	0	109.5
1132	D	29.9	Very low	27.6	Very low	125 Å²	125	128.7 Å²	128.7	67%	0.668	73%	0.726	S	S	*	*			trans	50.4	94.1	156.7	-59.5	-41.2	0	0	0	124
1133	N	30.4	Very low	27.6	Very low	123 Å²	123	128.7 Å²	128.7	66%	0.658	72%	0.722	S	S	*	*				66.4	104.2	110	-76.7	-57.4	0	0	0	122
1134	Q	28.1	Very low	27.4	Very low	167 Å²	167	130.5 Å²	130.5	78%	0.78	72%	0.721	S	S	*	*			trans	70.4	140.3	143.8	-53	-178.7	31.6	0	0	116.9
1135	L	23.9	Very low	27.4	Very low	143 Å²	143	130.8 Å²	130.8	75%	0.749	71%	0.714	S	S	*	*			cis	-156.7	155	19.3	-139.4	155.8	0	0	0	110.9
1136	T	24.7	Very low	27.5	Very low	111 Å²	111	132 Å²	132	68%	0.681	72%	0.716	S	S	*	*			trans	87.8	93.4	158.8	-23.8	0	0	0	0	120.8
1137	I	24.8	Very low	27.5	Very low	142 Å²	142	126.2 Å²	126.2	73%	0.728	71%	0.708	S	S	*	*				15	121.8	125.2	-61.3	165.4	0	0	0	117.5	I1139	I1137-I1139 HydrophobicContact CG2-CD1 4.07Å; I1137-I1139 HydrophobicContact CG2-CG1 3.74Å
1138	P	30.4	Very low	27.6	Very low	119 Å²	119	125.1 Å²	125.1	77%	0.773	70%	0.7	S	S	*	*				-125.4	137.3	102	2.9	18.4	0	0	0	111.9
1139	I	25.1	Very low	27.7	Very low	132 Å²	132	129.5 Å²	129.5	68%	0.677	72%	0.717	S	S	*	*			cis	106.5	107.1	48.7	-85.2	166.8	0	0	0	111.4	I1137	I1137-I1139 HydrophobicContact CG2-CD1 4.07Å; I1137-I1139 HydrophobicContact CG2-CG1 3.74Å
1140	I	25.6	Very low	27.6	Very low	144 Å²	144	128.9 Å²	128.9	74%	0.738	71%	0.712	S	S	*	*			trans	47.5	118.1	149.4	-33.2	168	0	0	0	116.9
1141	T	29	Very low	27.4	Very low	126 Å²	126	128.4 Å²	128.4	77%	0.773	71%	0.705	S	S	*	*				-177.4	158.2	78.7	42.1	0	0	0	0	109.7
1142	S	32.2	Very low	27.3	Very low	83 Å²	83	130.3 Å²	130.3	58%	0.58	70%	0.703	S	S	*	*			cis	-180	143.2	-14.7	51.9	0	0	0	0	109.7
1143	Q	28.7	Very low	26.9	Very low	162 Å²	162	131.1 Å²	131.1	76%	0.757	71%	0.707	S	S	*	*			trans	63.2	170.6	154.6	-67.8	170.9	-26.9	0	0	115.7
1144	Q	28.9	Very low	26.6	Very low	148 Å²	148	131.5 Å²	131.5	69%	0.692	71%	0.709	S	S	*	*			cis	-164.7	163.4	-25.3	-98.7	168.9	-25.4	0	0	104.6
1145	N	29.3	Very low	26.4	Very low	106 Å²	106	128.8 Å²	128.8	57%	0.567	70%	0.704	S	S	*	*			cis	-160.5	156.8	0.3	-125.7	14.5	0	0	0	108
1146	E	28.8	Very low	26.3	Very low	160 Å²	160	126.7 Å²	126.7	75%	0.748	70%	0.701	S	S	*	*			trans	60.3	168.4	145.7	-66.2	-179.2	-119.1	0	0	119.1
1147	C	28.3	Very low	26.3	Very low	94 Å²	94	129.2 Å²	129.2	64%	0.635	71%	0.707	S	S	*	*			cis	-151.9	123.9	-25.8	-109.6	0	0	0	0	106.3
1148	S	24.5	Very low	26.3	Very low	93 Å²	93	127.2 Å²	127.2	65%	0.65	70%	0.698	S	S	*	*				74.1	129.6	92.9	84.9	0	0	0	0	116.8
1149	L	25.9	Very low	26	Very low	163 Å²	163	128.5 Å²	128.5	85%	0.853	69%	0.693	S	S	*	*			trans	66.7	163.3	162.1	-83.9	67.7	0	0	0	118.3
1150	S	22.4	Very low	25.9	Very low	86 Å²	86	127.2 Å²	127.2	60%	0.601	70%	0.696	S	S	*	*			cis	-177	160.2	-43.6	56	0	0	0	0	111.9
1151	T	25	Very low	26.1	Very low	109 Å²	109	127.3 Å²	127.3	67%	0.669	70%	0.697	S	S	*	*			trans	73	161.5	150.7	-10.4	0	0	0	0	121.3
1152	Y	27.1	Very low	26	Very low	200 Å²	200	129.3 Å²	129.3	78%	0.784	70%	0.698	S	S	*	*			trans	64.2	100.4	161.3	-73.2	-72.3	0	0	0	121.2
1153	L	22	Very low	25.8	Very low	142 Å²	142	130 Å²	130	74%	0.743	70%	0.702	S	S	*	*				35.1	149.3	112.5	-78.7	160.2	0	0	0	122
1154	N	23.4	Very low	25.6	Very low	132 Å²	132	128.4 Å²	128.4	71%	0.706	70%	0.697	S	S	*	*			trans	102.6	122.4	138.3	-89.3	-7.3	0	0	0	122.3
1155	T	23.7	Very low	25.5	Very low	110 Å²	110	126.6 Å²	126.6	68%	0.675	70%	0.701	S	S	*	*			trans	62.9	102.8	135.6	59.1	0	0	0	0	122.4
1156	S	23.2	Very low	25.2	Very low	99 Å²	99	128 Å²	128	69%	0.692	71%	0.705	S	S	*	*				78.9	167.3	114.7	80.1	0	0	0	0	120.5
1157	M	25.1	Very low	25.1	Very low	164 Å²	164	126.1 Å²	126.1	81%	0.808	70%	0.701	S	S	*	*			trans	65.8	160.8	170.5	-58.3	-63.6	-175.3	0	0	115.8
1158	N	23.3	Very low	25	Very low	100 Å²	100	126.3 Å²	126.3	54%	0.535	70%	0.696	S	S	.	*				-155.6	177.5	-52.5	-145.3	-26.2	0	0	0	107.7
1159	Q	24.9	Very low	25.2	Very low	145 Å²	145	129.6 Å²	129.6	68%	0.678	70%	0.7	S	S	*	*			trans	42.7	102.9	154.4	-68.9	161.6	-9.2	0	0	118
1160	S	23.9	Very low	25.3	Very low	105 Å²	105	128.8 Å²	128.8	73%	0.734	70%	0.697	S	S	*	*				55.8	97.5	80.2	78.2	0	0	0	0	115.5
1161	L	28.4	Very low	25.8	Very low	146 Å²	146	133 Å²	133	76%	0.764	71%	0.712	S	S	*	*			trans	-147.6	129.7	151.4	-97	160.4	0	0	0	107.2
1162	E	27.3	Very low	26.4	Very low	168 Å²	168	133.3 Å²	133.3	79%	0.785	72%	0.715	S	S	*	*				39.1	153.2	125.7	-70.1	-178.6	175.7	0	0	121.1
1163	C	27.2	Very low	26.6	Very low	97 Å²	97	132.2 Å²	132.2	66%	0.655	72%	0.722	S	S	*	*			cis	177.5	133	-22.8	-108.5	0	0	0	0	105.1
1164	I	25.1	Very low	27.6	Very low	129 Å²	129	135 Å²	135	66%	0.662	73%	0.728	S	S	*	*				37.1	113.7	117.5	-55.4	170	0	0	0	117.6	M1166	I1164-M1166 HydrophobicContact CG2-CB 4.46Å; I1164-M1166 HydrophobicContact CG2-CE 4.18Å; I1164-M1166 HydrophobicContact CG2-CG 3.93Å; I1164-M1166 HydrophobicContact CG2-SD 3.62Å
1165	S	26.4	Very low	28.3	Very low	110 Å²	110	132 Å²	132	77%	0.769	72%	0.715	S	S	*	*				-159.3	140.6	116.7	-151.7	0	0	0	0	109
1166	M	24.2	Very low	28.6	Very low	135 Å²	135	130.9 Å²	130.9	67%	0.665	71%	0.708	S	S	*	*			cis	74.1	142.1	27.6	-59.6	-169.7	174.6	0	0	112.6	I1164	I1164-M1166 HydrophobicContact CG2-CB 4.46Å; I1164-M1166 HydrophobicContact CG2-CE 4.18Å; I1164-M1166 HydrophobicContact CG2-CG 3.93Å; I1164-M1166 HydrophobicContact CG2-SD 3.62Å
1167	N	25.6	Very low	29.2	Very low	121 Å²	121	134 Å²	134	65%	0.647	71%	0.713	S	S	*	*			cis	-169.2	-178.7	5.9	-128.1	23.6	0	0	0	114.9
1168	N	26.8	Very low	29.2	Very low	99 Å²	99	131.1 Å²	131.1	53%	0.529	70%	0.702	S	S	.	*			trans	72.3	165.6	152.7	-55.9	-11.7	0	0	0	119.6
1169	H	28.4	Very low	29.3	Very low	161 Å²	161	130.3 Å²	130.3	75%	0.745	70%	0.704	S	S	*	*			cis	-141.2	166.3	11.2	-99.3	-63.4	0	0	0	114.1
1170	D	28.9	Very low	29.4	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	71%	0.71	S	S	*	*			trans	-113.4	168.3	-169.6	-50.3	-91	0	0	0	116.7
1171	L	31.1	Very low	29.2	Very low	174 Å²	174	128.9 Å²	128.9	91%	0.911	70%	0.697	S	S	*	*			trans	-165.1	139.5	166	-139	87.4	0	0	0	115.5
1172	P	39.1	Very low	28.9	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	68%	0.684	S	S	*	*			trans	-134.1	158.1	178.2	41	-27.8	0	0	0	118.2
1173	L	30.6	Very low	28.7	Very low	178 Å²	178	125.9 Å²	125.9	93%	0.932	69%	0.686	S	S	*	*			trans	177	164.2	162	-105.7	156.4	0	0	0	117.9
1174	K	42.2	Very low	28.5	Very low	200 Å²	200	127.6 Å²	127.6	87%	0.87	69%	0.689	S	S	*	*			trans	90.9	154.6	156.2	-106.2	-178.8	-178.3	179.8	0	123.8
1175	T	38.1	Very low	28.9	Very low	70 Å²	70	127.1 Å²	127.1	43%	0.429	70%	0.696	S	S	.	*			trans	-156.3	164.5	-173.1	-16.4	0	0	0	0	119.1	S1181 S1182	T1175-S1181 WeakPolarHBondContact CG2-O 3.43Å; T1175-S1182 VanDerWaalsContact CG2-CB 3.41Å
1176	T	30.4	Very low	29	Very low	86 Å²	86	126.6 Å²	126.6	53%	0.528	69%	0.69	S	S	.	*			trans	82.7	139.2	161.9	56.6	0	0	0	0	120.9	N1178	T1176-N1178 VanDerWaalsContact CA-OD1 3.28Å; T1176-N1178 WeakPolarHBondContact CA-OD1 3.25Å; T1176-N1178 PolarHBondContact N-OD1 3.28Å; T1176-N1178 PolarHBondContact O-ND2 3.09Å; T1176-N1178 VanDerWaalsContact O-ND2 3.11Å
1177	M	36.5	Very low	28.9	Very low	163 Å²	163	127.1 Å²	127.1	80%	0.803	70%	0.695	S	S	*	*	S	Bend	trans	48.2	73.2	-174.3	-124.4	-66.8	179.4	0	0	117.2
1178	N	24.9	Very low	29	Very low	105 Å²	105	127.5 Å²	127.5	56%	0.561	70%	0.697	S	S	*	*	S	Bend	cis	59.2	-166.4	0.3	-34.7	-174.5	0	0	0	113.1	T1176	T1176-N1178 VanDerWaalsContact CA-OD1 3.28Å; T1176-N1178 WeakPolarHBondContact CA-OD1 3.25Å; T1176-N1178 PolarHBondContact N-OD1 3.28Å; T1176-N1178 PolarHBondContact O-ND2 3.09Å; T1176-N1178 VanDerWaalsContact O-ND2 3.11Å
1179	S	26.1	Very low	29.1	Very low	82 Å²	82	127.4 Å²	127.4	57%	0.573	70%	0.701	S	S	*	*	S	Bend	trans	173.8	107.7	141.5	-78.7	0	0	0	0	107.5
1180	L	25.5	Very low	28.9	Very low	156 Å²	156	122.2 Å²	122.2	82%	0.817	68%	0.683	S	S	*	*	S	Bend	cis	-148.5	156	1.7	-71.9	99.9	0	0	0	107.8
1181	S	20.1	Very low	28.8	Very low	65 Å²	65	119.2 Å²	119.2	46%	0.455	67%	0.674	S	S	.	*			cis	-149.9	-102.6	-15.7	-86.3	0	0	0	0	110.7	T1175	T1175-S1181 WeakPolarHBondContact CG2-O 3.43Å
1182	S	22.5	Very low	28.6	Very low	70 Å²	70	116 Å²	116	49%	0.49	67%	0.666	S	S	.	*	S	Bend	trans	-123	-167.5	-171.5	46.7	0	0	0	0	112.3	T1175 L1184	T1175-S1182 VanDerWaalsContact CG2-CB 3.41Å; S1182-L1184 PolarHBondContact O-N 3.45Å
1183	E	24.2	Very low	28.1	Very low	180 Å²	180	117 Å²	117	84%	0.841	67%	0.669	S	S	*	*	S	Bend	trans	-47.1	110.3	138.4	-179.8	-176.5	-107.5	0	0	108.5
1184	L	22.3	Very low	27.8	Very low	134 Å²	134	112.5 Å²	112.5	70%	0.702	65%	0.653	S	S	*	*				-170.8	131.4	122.8	-100	168.8	0	0	0	107.7	S1182	S1182-L1184 PolarHBondContact O-N 3.45Å
1185	S	32.9	Very low	27.1	Very low	118 Å²	118	108.8 Å²	108.8	83%	0.825	64%	0.642	S	S	*	*			trans	-60.9	119.5	145.2	-58.2	0	0	0	0	106.3
1186	P	29.5	Very low	26.7	Very low	99 Å²	99	113.5 Å²	113.5	64%	0.643	66%	0.657	S	S	*	*				-145.1	-176.7	100	37.6	-21.2	0	0	0	113.2
1187	L	21.6	Very low	26.5	Very low	146 Å²	146	113.7 Å²	113.7	76%	0.764	66%	0.662	S	S	*	*			trans	74.2	113.4	174.2	-48.5	170.2	0	0	0	114
1188	L	28.4	Very low	26.2	Very low	130 Å²	130	110.9 Å²	110.9	68%	0.681	66%	0.658	S	S	*	*			cis	53.5	78.4	11.4	-76.9	166.3	0	0	0	112.3
1189	P	28.9	Very low	26.3	Very low	96 Å²	96	110.8 Å²	110.8	62%	0.623	67%	0.666	S	S	*	*				-93.6	136.7	96.3	24.5	-34.6	0	0	0	112.1
1190	S	24	Very low	26.5	Very low	52 Å²	52	112.1 Å²	112.1	36%	0.364	68%	0.675	S	S	.	*			cis	49.8	47.9	-0.4	73.3	0	0	0	0	115.5	E33	E33-S1190 PolarHBondContact OE1-N 3.43Å
1191	S	26.1	Very low	26.7	Very low	85 Å²	85	109.4 Å²	109.4	59%	0.594	67%	0.669	S	S	*	*			trans	-156.5	73.8	167.5	-67.2	0	0	0	0	111	V1193	S1191-V1193 PolarHBondContact O-N 3.29Å
1192	S	26.6	Very low	27.1	Very low	107 Å²	107	111.3 Å²	111.3	75%	0.748	68%	0.682	S	S	*	*			trans	23.5	92.8	130.4	49	0	0	0	0	118.2
1193	V	28	Very low	27.4	Very low	134 Å²	134	112.6 Å²	112.6	81%	0.812	69%	0.692	S	S	*	*			trans	-123.8	87.7	140.6	-175.5	0	0	0	0	108.5	S1191	S1191-V1193 PolarHBondContact O-N 3.29Å
1194	S	25.4	Very low	27.7	Very low	85 Å²	85	109.2 Å²	109.2	59%	0.594	69%	0.688	S	S	*	*			trans	-72	176.9	157.2	51.4	0	0	0	0	110.1
1195	L	27.2	Very low	28	Very low	121 Å²	121	108.3 Å²	108.3	63%	0.634	69%	0.693	S	S	*	*			trans	68.9	147.2	-176.3	-39.6	170	0	0	0	112.8
1196	F	29.6	Very low	27.7	Very low	169 Å²	169	108.5 Å²	108.5	74%	0.741	69%	0.694	S	S	*	*			cis	-109.1	146.3	-8.7	-76.5	-96.8	0	0	0	108.5
1197	S	26.8	Very low	27.6	Very low	91 Å²	91	109.5 Å²	109.5	64%	0.636	70%	0.703	S	S	*	*				62.6	136.5	80.3	-32.3	0	0	0	0	113.1
1198	S	29	Very low	27.8	Very low	104 Å²	104	107.2 Å²	107.2	73%	0.727	70%	0.699	S	S	*	*			cis	-152.3	162.7	21.2	-48.9	0	0	0	0	114.4
1199	S	28.6	Very low	27.7	Very low	103 Å²	103	105.9 Å²	105.9	72%	0.72	70%	0.701	S	S	*	*			trans	75.9	122.4	145	-51.2	0	0	0	0	122
1200	S	29.5	Very low	27.5	Very low	110 Å²	110	106.2 Å²	106.2	77%	0.769	71%	0.706	S	S	*	*			trans	47.1	145.2	130.9	64.7	0	0	0	0	122.3
1201	S	29	Very low	27.5	Very low	98 Å²	98	109 Å²	109	69%	0.685	73%	0.726	S	S	*	*			cis	-179.4	128.9	-15.1	47.4	0	0	0	0	108.9
1202	S	29	Very low	27.4	Very low	105 Å²	105	109.8 Å²	109.8	73%	0.734	73%	0.731	S	S	*	*			trans	20.4	148	135.2	53.3	0	0	0	0	122.4
1203	S	29.1	Very low	27.3	Very low	98 Å²	98	110.7 Å²	110.7	69%	0.685	73%	0.731	S	S	*	*			cis	179.5	137.5	-5.7	49.4	0	0	0	0	114.2
1204	S	30.1	Very low	27	Very low	108 Å²	108	108.9 Å²	108.9	76%	0.755	73%	0.725	S	S	*	*			trans	28.8	155.1	134.8	64.6	0	0	0	0	123.6
1205	S	29.6	Very low	26.9	Very low	116 Å²	116	111.9 Å²	111.9	81%	0.811	73%	0.733	S	S	*	*			cis	-176.1	172.4	-10.6	49.7	0	0	0	0	111
1206	S	25.6	Very low	26.8	Very low	122 Å²	122	117.5 Å²	117.5	85%	0.853	75%	0.745	S	S	*	*			trans	-115.3	-160.1	-172.2	61.9	0	0	0	0	115.8
1207	S	26.9	Very low	26.6	Very low	119 Å²	119	114.7 Å²	114.7	83%	0.832	75%	0.746	S	S	*	*			trans	-92.5	-135.6	-157.9	57.3	0	0	0	0	117.3
1208	S	26.5	Very low	26.7	Very low	98 Å²	98	117.3 Å²	117.3	69%	0.685	75%	0.753	S	S	*	*			trans	-108.7	161.3	-137.3	55.7	0	0	0	0	118.4
1209	S	25.7	Very low	26.6	Very low	102 Å²	102	120.6 Å²	120.6	71%	0.713	76%	0.756	S	S	*	*			trans	65.9	120.2	151.8	47.4	0	0	0	0	121.1
1210	S	25.5	Very low	26.4	Very low	103 Å²	103	122 Å²	122	72%	0.72	76%	0.755	S	S	*	*			trans	55.6	99.4	150.3	51.3	0	0	0	0	120.7
1211	S	24.9	Very low	26.1	Very low	112 Å²	112	124.3 Å²	124.3	78%	0.783	75%	0.754	S	S	*	*			trans	35.3	126.1	130.1	58.8	0	0	0	0	119.6
1212	S	23	Very low	25.8	Very low	101 Å²	101	126.5 Å²	126.5	71%	0.706	76%	0.757	S	S	*	*			cis	-168.8	171.8	29.3	60.5	0	0	0	0	114.4
1213	V	23.8	Very low	25.5	Very low	125 Å²	125	128.3 Å²	128.3	76%	0.758	76%	0.759	S	S	*	*			trans	68.8	101.4	163.6	-174	0	0	0	0	118.3
1214	S	22.1	Very low	25.1	Very low	97 Å²	97	129.8 Å²	129.8	68%	0.678	76%	0.763	S	S	*	*			trans	66.7	110.9	140.6	-64.4	0	0	0	0	123.8
1215	I	23.4	Very low	24.7	Very low	148 Å²	148	131.4 Å²	131.4	76%	0.759	76%	0.763	S	S	*	*				83.4	123.4	124.3	-63	169.2	0	0	0	119.4
1216	R	26.1	Very low	24.4	Very low	238 Å²	238	130.6 Å²	130.6	90%	0.898	76%	0.758	S	S	*	*			trans	85.3	157.5	166	-76.6	169.3	180	-173.1	-1.3	118.1
1217	C	25.3	Very low	24.2	Very low	111 Å²	111	131.6 Å²	131.6	75%	0.75	75%	0.752	S	S	*	*			trans	-137.1	151.6	-154.5	-46.4	0	0	0	0	112
1218	N	28.1	Very low	24.1	Very low	146 Å²	146	132.1 Å²	132.1	78%	0.781	75%	0.746	S	S	*	*				169.1	110.5	121.2	-87.3	14	0	0	0	113.6
1219	E	25.7	Very low	24	Very low	172 Å²	172	133.4 Å²	133.4	80%	0.804	74%	0.744	S	S	*	*				59.9	142.3	125.8	-111.2	164	-139.2	0	0	126.6
1220	L	25.8	Very low	24	Very low	134 Å²	134	133.8 Å²	133.8	70%	0.702	74%	0.743	S	S	*	*			trans	93.7	94.5	151.9	-62.3	171.9	0	0	0	124.5
1221	Q	22.8	Very low	24.1	Very low	158 Å²	158	133.7 Å²	133.7	74%	0.738	73%	0.734	S	S	*	*				57.3	118.8	125.3	-69.4	-175.4	-76.2	0	0	126.9
1222	L	22.2	Very low	24.1	Very low	143 Å²	143	136.5 Å²	136.5	75%	0.749	73%	0.729	S	S	*	*				84.1	147.9	125.6	-67.9	171.4	0	0	0	124.2
1223	D	22.3	Very low	24.4	Very low	144 Å²	144	139.5 Å²	139.5	77%	0.77	74%	0.735	S	S	*	*			trans	-97.7	172.8	-155.7	-47.5	-87.7	0	0	0	117.5
1224	V	21.3	Very low	24.8	Very low	128 Å²	128	139.3 Å²	139.3	78%	0.776	73%	0.729	S	S	*	*				165.6	126.8	122.3	156.3	0	0	0	0	114.8
1225	N	21.9	Very low	25	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	73%	0.729	S	S	*	*			trans	50.9	126.7	150.8	-66.8	-9.1	0	0	0	126.5
1226	S	23.3	Very low	24.9	Very low	99 Å²	99	138.5 Å²	138.5	69%	0.692	73%	0.728	S	S	*	*				93.9	125.7	120.7	-79.4	0	0	0	0	125.9
1227	I	22.7	Very low	24.7	Very low	143 Å²	143	133.9 Å²	133.9	73%	0.733	72%	0.721	S	S	*	*				97.2	115.9	126.7	-74.5	171.1	0	0	0	122.6
1228	N	23.7	Very low	24.6	Very low	130 Å²	130	135.4 Å²	135.4	70%	0.695	72%	0.721	S	S	*	*			trans	74.4	131.6	144.1	-75.6	-0.2	0	0	0	126.1
1229	N	24.5	Very low	24.4	Very low	124 Å²	124	134.6 Å²	134.6	66%	0.663	72%	0.717	S	S	*	*			trans	77.4	106.8	135.7	-70.9	-15.7	0	0	0	120.2
1230	T	26.1	Very low	24.5	Very low	110 Å²	110	132.7 Å²	132.7	68%	0.675	71%	0.712	S	S	*	*				81.4	139.1	69.1	61.4	0	0	0	0	113.4
1231	N	27.7	Very low	24.5	Very low	101 Å²	101	131.6 Å²	131.6	54%	0.54	71%	0.712	S	S	.	*			cis	-155.9	154	14.7	-117.2	-10.2	0	0	0	114.1
1232	Y	25	Very low	24.7	Very low	171 Å²	171	131.6 Å²	131.6	67%	0.671	72%	0.715	S	S	*	*	S	Bend	trans	38.8	130.1	153.3	-65	-61.1	0	0	0	122.1	I1234	Y1232-I1234 HydrophobicContact CD1-CD1 4.49Å; Y1232-I1234 HydrophobicContact CD1-CG1 4.5Å
1233	I	28.5	Very low	24.8	Very low	164 Å²	164	128.8 Å²	128.8	84%	0.841	71%	0.708	S	S	*	*	S	Bend	cis	-136.1	79.9	15.2	-49.1	166.5	0	0	0	111.9
1234	I	33.3	Very low	24.8	Very low	121 Å²	121	129.1 Å²	129.1	62%	0.621	71%	0.709	S	S	*	*				-119.8	122.2	-78.7	-0.6	-176.5	0	0	0	108.5	Y1232	Y1232-I1234 HydrophobicContact CD1-CD1 4.49Å; Y1232-I1234 HydrophobicContact CD1-CG1 4.5Å
1235	P	25.6	Very low	25	Very low	106 Å²	106	129 Å²	129	69%	0.688	70%	0.704	S	S	*	*			trans	-112.2	165.8	-179.4	40.8	-34.1	0	0	0	113.9
1236	V	21.5	Very low	25	Very low	122 Å²	122	130.5 Å²	130.5	74%	0.739	71%	0.707	S	S	*	*			trans	54.7	109.9	139	174.7	0	0	0	0	119.4
1237	D	22.1	Very low	25	Very low	141 Å²	141	129.5 Å²	129.5	75%	0.754	70%	0.7	S	S	*	*			trans	42.4	144.6	131.2	-62.4	-47.3	0	0	0	124.4
1238	L	23	Very low	25.2	Very low	144 Å²	144	131.6 Å²	131.6	75%	0.754	70%	0.703	S	S	*	*			trans	88.4	105.3	151.4	-65.9	144.2	0	0	0	121.2
1239	N	24.5	Very low	25.3	Very low	128 Å²	128	131.8 Å²	131.8	68%	0.684	70%	0.704	S	S	*	*				89.8	126.4	129.4	-64.9	-14.5	0	0	0	123.5
1240	N	28	Very low	25.1	Very low	132 Å²	132	132.8 Å²	132.8	71%	0.706	71%	0.708	S	S	*	*			trans	94.7	95.7	133.9	-69.6	-2.9	0	0	0	124
1241	T	25.9	Very low	24.8	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	71%	0.707	S	S	*	*				74	136.7	119.7	60.1	0	0	0	0	124.1
1242	L	25.2	Very low	24.7	Very low	157 Å²	157	137.4 Å²	137.4	82%	0.822	72%	0.723	S	S	*	*			trans	74.9	143.3	156.4	-57.6	145.6	0	0	0	116.8
1243	S	24.7	Very low	24.8	Very low	85 Å²	85	139.5 Å²	139.5	59%	0.594	73%	0.731	S	S	*	*			cis	-167.4	140.5	-8.7	-116.4	0	0	0	0	115.1
1244	L	22.4	Very low	24.7	Very low	150 Å²	150	137.3 Å²	137.3	79%	0.785	73%	0.727	S	S	*	*			trans	58.9	154.1	134	-74.1	167.6	0	0	0	125
1245	N	25.4	Very low	24.1	Very low	127 Å²	127	137.2 Å²	137.2	68%	0.679	73%	0.732	S	S	*	*			trans	79.4	122.8	163.5	-63.3	1.3	0	0	0	117.4
1246	E	23.2	Very low	23.9	Very low	174 Å²	174	137.8 Å²	137.8	81%	0.813	73%	0.728	S	S	*	*				76	139.1	59	-75.4	-167.7	178.9	0	0	113.8
1247	S	22.8	Very low	23.9	Very low	78 Å²	78	135.7 Å²	135.7	55%	0.545	72%	0.719	S	S	.	*			cis	-171	176.7	-8.6	57.6	0	0	0	0	110.5
1248	K	26	Very low	23.9	Very low	187 Å²	187	134.7 Å²	134.7	81%	0.813	71%	0.713	S	S	*	*			trans	68	163	157.9	-69.9	170.1	-177.4	173	0	116.7
1249	L	25.1	Very low	23.8	Very low	134 Å²	134	134 Å²	134	70%	0.702	71%	0.709	S	S	*	*			cis	-148.1	144.1	-18.8	-99.5	153.5	0	0	0	103.5
1250	L	20.5	Very low	23.8	Very low	144 Å²	144	133.8 Å²	133.8	75%	0.754	71%	0.708	S	S	*	*				53.9	137.3	70.7	-99.7	172.8	0	0	0	116.8
1251	D	21.4	Very low	23.5	Very low	122 Å²	122	131.2 Å²	131.2	65%	0.652	70%	0.701	S	S	*	*			trans	91.4	134.5	156.4	-58	-43.9	0	0	0	124.4
1252	E	23.8	Very low	23.3	Very low	186 Å²	186	131.8 Å²	131.8	87%	0.869	70%	0.699	S	S	*	*			trans	74.6	112.4	149.6	-71.5	173.2	-174.5	0	0	124.4
1253	Y	28.2	Very low	23.2	Very low	216 Å²	216	128.2 Å²	128.2	85%	0.847	68%	0.681	S	S	*	*			trans	-86	148.8	148.5	-76.6	-101.8	0	0	0	109.8
1254	P	25.3	Very low	23.3	Very low	118 Å²	118	128.2 Å²	128.2	77%	0.766	68%	0.675	S	S	*	*				-139.1	153.8	98.4	20	1.5	0	0	0	112.9
1255	V	21.7	Very low	23.6	Very low	118 Å²	118	125 Å²	125	72%	0.715	66%	0.658	S	S	*	*			cis	83.2	145.5	43	-175.4	0	0	0	0	113.6
1256	I	21.6	Very low	23.8	Very low	119 Å²	119	123.3 Å²	123.3	61%	0.61	65%	0.649	S	S	*	*			trans	82	101.3	-177.2	-48.1	-174.3	0	0	0	114
1257	S	21.8	Very low	24	Very low	78 Å²	78	117.9 Å²	117.9	55%	0.545	63%	0.625	S	S	.	*			cis	103.7	174.2	25.9	84.8	0	0	0	0	114.3
1258	L	21.8	Very low	24.3	Very low	119 Å²	119	119.5 Å²	119.5	62%	0.623	63%	0.628	S	S	*	*			trans	72.9	148.5	179.8	-56.4	172.1	0	0	0	115.8
1259	L	21.6	Very low	24.1	Very low	129 Å²	129	115.5 Å²	115.5	68%	0.675	62%	0.616	S	S	*	*			cis	-162.2	172.1	-29.6	-163.9	60.2	0	0	0	108.6
1260	D	23.2	Very low	24	Very low	125 Å²	125	113.4 Å²	113.4	67%	0.668	61%	0.612	S	S	*	*			trans	72.2	150.8	151.3	-78.9	-31.1	0	0	0	119.9
1261	S	22.1	Very low	24	Very low	78 Å²	78	113.6 Å²	113.6	55%	0.545	61%	0.614	S	S	.	*			cis	-172.2	154.7	-28.7	-118.4	0	0	0	0	111.8
1262	N	22.2	Very low	24	Very low	123 Å²	123	112.9 Å²	112.9	66%	0.658	62%	0.618	S	S	*	*			trans	66.4	141.3	142.6	-67.5	-29.3	0	0	0	123
1263	N	23.5	Very low	23.8	Very low	82 Å²	82	108.6 Å²	108.6	44%	0.439	61%	0.609	S	S	.	*			trans	82.1	159.3	133.5	-76.6	-12.6	0	0	0	119.3	N295 N296	N295-N1263 PolarHBondContact O-OD1 2.73Å; N295-N1263 VanDerWaalsContact O-OD1 3.13Å; N296-N1263 WeakPolarHBondContact O-CA 3.3Å; N296-N1263 PolarHBondContact O-N 3.49Å; N296-N1263 VanDerWaalsContact O-N 3.15Å
1264	N	26	Very low	23.5	Very low	86 Å²	86	104.4 Å²	104.4	46%	0.46	61%	0.606	S	S	.	*			cis	-153.1	137.1	10.6	-128.1	12.1	0	0	0	112.7	N295 N296	N295-N1264 WeakPolarHBondContact CB-OD1 3.37Å; N295-N1264 VanDerWaalsContact ND2-CG 3.29Å; N295-N1264 PolarHBondContact ND2-OD1 3.2Å; N296-N1264 VanDerWaalsContact CB-C 3.4Å; N296-N1264 VanDerWaalsContact CG-C 3.41Å; N296-N1264 PolarHBondContact ND2-O 3.08Å
1265	N	28.6	Very low	23.4	Very low	82 Å²	82	106.4 Å²	106.4	44%	0.439	61%	0.61	S	S	.	*			trans	66.8	138.2	171.8	-33.9	-96.5	0	0	0	121.6	N295 N296	N295-N1265 VanDerWaalsContact CG-N 3.26Å; N295-N1265 PolarHBondContact ND2-OD1 3.47Å; N295-N1265 WeakPolarHBondContact OD1-CA 3.4Å; N295-N1265 WeakPolarHBondContact OD1-CB 3.25Å; N295-N1265 PolarHBondContact OD1-N 3.11Å; N295-N1265 PolarHBondContact OD1-OD1 3.42Å; N296-N1265 VanDerWaalsContact CG-N 3.31Å; N296-N1265 PolarHBondContact ND2-N 2.87Å; N296-N1265 PolarHBondContact ND2-O 3.42Å; N296-N1265 PolarHBondContact OD1-O 2.91Å; N296-N1265 VanDerWaalsContact OD1-O 3.06Å
1266	N	28.7	Very low	23.4	Very low	91 Å²	91	105.6 Å²	105.6	49%	0.487	61%	0.609	S	S	.	*			cis	-177.7	169.9	-0.1	-110.4	20.4	0	0	0	109.7	N294 N295 N296	N294-N1266 VanDerWaalsContact OD1-CG 3.32Å; N294-N1266 PolarHBondContact OD1-ND2 3.29Å; N294-N1266 PolarHBondContact OD1-OD1 3.44Å; N295-N1266 PolarHBondContact OD1-OD1 3.2Å; N296-N1266 PolarHBondContact OD1-N 3.43Å
1267	N	28.5	Very low	23.5	Very low	60 Å²	60	111.1 Å²	111.1	32%	0.321	62%	0.622	S	S	.	*			cis	-172.5	166.5	-20.3	-114.5	19.3	0	0	0	112.1	V293 N294	V293-N1267 WeakPolarHBondContact CG1-OD1 3.33Å; V293-N1267 PolarHBondContact O-ND2 2.7Å; N294-N1267 WeakPolarHBondContact CA-OD1 3.33Å; N294-N1267 PolarHBondContact OD1-ND2 3.26Å
1268	N	28	Very low	23.7	Very low	112 Å²	112	113.4 Å²	113.4	60%	0.599	64%	0.635	S	S	*	*			trans	63.4	161.4	157.3	-61.6	1.9	0	0	0	119	V293	V293-N1268 WeakPolarHBondContact CB-OD1 3.33Å; V293-N1268 WeakPolarHBondContact CG2-OD1 3.28Å
1269	N	23.1	Very low	23.8	Very low	104 Å²	104	113.6 Å²	113.6	56%	0.556	64%	0.637	S	S	*	*			cis	175.7	153.4	-43.4	-116.5	19.1	0	0	0	107.6
1270	S	22.4	Very low	24	Very low	89 Å²	89	114.1 Å²	114.1	62%	0.622	64%	0.639	S	S	*	*			trans	55.2	106.7	156.8	59.1	0	0	0	0	121.9
1271	D	20.9	Very low	24.1	Very low	149 Å²	149	114.6 Å²	114.6	80%	0.797	64%	0.642	S	S	*	*				76	148.5	116.8	-51.2	-34.1	0	0	0	125.4
1272	S	20.4	Very low	24.2	Very low	106 Å²	106	118.8 Å²	118.8	74%	0.741	65%	0.653	S	S	*	*			trans	82	90.4	152.6	69.1	0	0	0	0	121.4
1273	S	20.8	Very low	24.2	Very low	97 Å²	97	120.4 Å²	120.4	68%	0.678	66%	0.656	S	S	*	*				51.1	129.3	120.6	61.7	0	0	0	0	123.6
1274	T	21.5	Very low	24.2	Very low	128 Å²	128	124.2 Å²	124.2	79%	0.785	67%	0.674	S	S	*	*			trans	78.4	163	141.1	58	0	0	0	0	121.9
1275	L	23.1	Very low	24	Very low	160 Å²	160	128 Å²	128	84%	0.838	69%	0.688	S	S	*	*			trans	86.3	137.6	175.2	-55.3	170.1	0	0	0	116.8
1276	S	20.9	Very low	23.7	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	70%	0.699	S	S	*	*			cis	-171.6	166.5	-28.9	42.9	0	0	0	0	108.9
1277	W	25.1	Very low	23.4	Very low	236 Å²	236	132.9 Å²	132.9	89%	0.894	71%	0.709	S	S	*	*			trans	-73	167.8	-177.5	-59.6	-9.8	0	0	0	114.8
1278	P	26.4	Very low	23.1	Very low	125 Å²	125	135 Å²	135	81%	0.812	72%	0.724	S	S	*	*				-126.4	139.1	103.5	14	4.7	0	0	0	112.4
1279	N	23.1	Very low	22.9	Very low	123 Å²	123	138 Å²	138	66%	0.658	73%	0.732	S	S	*	*			cis	85.9	109.8	44.2	-176.4	20.5	0	0	0	114
1280	L	26.3	Very low	22.8	Very low	140 Å²	140	143 Å²	143	73%	0.733	75%	0.745	S	S	*	*			trans	-173.1	142.5	132.6	-123.1	70.4	0	0	0	114.9
1281	N	25.3	Very low	22.8	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	75%	0.752	S	S	*	*			trans	56.7	86.4	147.8	-63.3	-2.3	0	0	0	123.4
1282	H	24.2	Very low	23	Very low	166 Å²	166	143.6 Å²	143.6	77%	0.769	75%	0.753	S	S	*	*				32	138.1	100.3	-132.9	45.5	0	0	0	122.7
1283	Q	21.9	Very low	23.1	Very low	157 Å²	157	144.4 Å²	144.4	73%	0.734	75%	0.747	S	S	*	*			trans	103.3	146	132	-115.6	-179.8	-7.7	0	0	124
1284	M	22.9	Very low	23.3	Very low	162 Å²	162	148.8 Å²	148.8	80%	0.798	75%	0.754	S	S	*	*			trans	74.3	77.6	158.6	-71.6	-175.4	61.9	0	0	122.1
1285	E	22.6	Very low	23.3	Very low	164 Å²	164	147.5 Å²	147.5	77%	0.766	75%	0.747	S	S	*	*				-19.8	168.7	120	-158.8	-174.2	-154.2	0	0	118.9
1286	L	22.1	Very low	23.4	Very low	128 Å²	128	146.6 Å²	146.6	67%	0.67	74%	0.743	S	S	*	*			trans	85.5	150.4	166.8	-50.8	175.7	0	0	0	115.7
1287	Q	22.5	Very low	23.5	Very low	148 Å²	148	150 Å²	150	69%	0.692	75%	0.752	S	S	*	*			cis	-160.3	145.3	11.8	-146.8	170.6	48.4	0	0	114.8
1288	T	22.6	Very low	23.4	Very low	105 Å²	105	144.4 Å²	144.4	64%	0.644	74%	0.74	S	S	*	*			trans	65.5	163.8	151.7	42.3	0	0	0	0	119.8
1289	K	23.5	Very low	23.2	Very low	174 Å²	174	146.1 Å²	146.1	76%	0.757	74%	0.737	S	S	*	*			cis	-154.6	129.1	22.9	-147.9	165.9	-178.3	174.7	0	115.9
1290	Y	20.4	Very low	23.2	Very low	211 Å²	211	145.5 Å²	145.5	83%	0.827	73%	0.733	S	S	*	*			trans	43	126.3	142.7	-75.9	-115.2	0	0	0	123.7
1291	G	22.9	Very low	22.9	Very low	74 Å²	74	144 Å²	144	76%	0.763	73%	0.726	S	S	*	*				96.6	156.5	124.5	0	0	0	0	0	118.5
1292	Q	24	Very low	22.8	Very low	176 Å²	176	143.5 Å²	143.5	82%	0.822	72%	0.723	S	S	*	*			cis	-168.2	163	-8.9	-153	179.8	-5.8	0	0	110.3
1293	I	24.2	Very low	22.6	Very low	123 Å²	123	143.2 Å²	143.2	63%	0.631	72%	0.723	S	S	*	*			trans	73.1	134.9	168.5	-50.3	152.3	0	0	0	113.3
1294	F	23.8	Very low	22.8	Very low	188 Å²	188	141.9 Å²	141.9	83%	0.825	72%	0.719	S	S	*	*			cis	-92.5	167.9	1.3	-64.3	-97	0	0	0	111.1
1295	T	22.2	Very low	22.8	Very low	102 Å²	102	140.8 Å²	140.8	63%	0.626	72%	0.716	S	S	*	*			cis	59.2	85.2	-10.2	67.1	0	0	0	0	119.5
1296	D	25.2	Very low	22.8	Very low	140 Å²	140	137 Å²	137	75%	0.749	71%	0.705	S	S	*	*				-167.5	90.3	114	-94.2	-8.4	0	0	0	112.9
1297	L	22.8	Very low	22.9	Very low	171 Å²	171	138 Å²	138	90%	0.895	71%	0.708	S	S	*	*			trans	-78.6	129	144.6	-88.4	165.1	0	0	0	107
1298	N	22.4	Very low	23	Very low	120 Å²	120	133 Å²	133	64%	0.642	69%	0.688	S	S	*	*			trans	-158.3	120	159.5	-95.5	-43.7	0	0	0	111.1
1299	H	22.6	Very low	23.1	Very low	160 Å²	160	128.3 Å²	128.3	74%	0.741	66%	0.662	S	S	*	*				52.4	139.2	129.1	-66.1	-48.3	0	0	0	120.3
1300	N	22.3	Very low	23.2	Very low	110 Å²	110	124.6 Å²	124.6	59%	0.588	65%	0.649	S	S	*	*			cis	-160.5	169.2	19.9	-133	13.2	0	0	0	116.4
1301	D	21.3	Very low	23.6	Very low	108 Å²	108	121.7 Å²	121.7	58%	0.578	65%	0.647	S	S	*	*			trans	67	109.2	142.7	-63	-23.1	0	0	0	122
1302	N	21.7	Very low	23.7	Very low	126 Å²	126	123.5 Å²	123.5	67%	0.674	64%	0.635	S	S	*	*				88.8	128	112.5	-65.1	-11.5	0	0	0	123.5
1303	E	21.8	Very low	23.9	Very low	161 Å²	161	121.3 Å²	121.3	75%	0.752	63%	0.629	S	S	*	*				90.7	120.9	129.1	-78.1	-178.4	150.3	0	0	123.2
1304	I	24.9	Very low	24.1	Very low	129 Å²	129	125.1 Å²	125.1	66%	0.662	64%	0.641	S	S	*	*				85.3	87.6	127.3	-65.8	170.8	0	0	0	119
1305	D	23	Very low	24.2	Very low	139 Å²	139	121 Å²	121	74%	0.743	64%	0.636	S	S	*	*				78.3	123.5	110.3	-75.5	4.2	0	0	0	125.7
1306	V	23.3	Very low	24.4	Very low	85 Å²	85	125.2 Å²	125.2	52%	0.515	65%	0.649	S	S	.	*				66.2	102.5	122.9	-177.6	0	0	0	0	120.1
1307	M	24.6	Very low	24.3	Very low	149 Å²	149	125.3 Å²	125.3	73%	0.734	65%	0.649	S	S	*	*				-171.4	50.2	116.7	-98.4	-53.1	168.1	0	0	115.3	Y702	Y702-M1307 HydrophobicContact CD1-SD 4.33Å; Y702-M1307 HydrophobicContact CE1-SD 4.2Å
1308	S	24.4	Very low	24.2	Very low	41 Å²	41	127.4 Å²	127.4	29%	0.287	65%	0.646	S	S	.	*				43.4	108.8	96.4	-152.1	0	0	0	0	116.1	K701 Y702 R703	K701-S1308 CarbonylContact O-C 3.55Å; K701-S1308 WeakPolarHBondContact O-CA 2.88Å; K701-S1308 VanDerWaalsContact O-CB 3.25Å; K701-S1308 WeakPolarHBondContact O-CB 3.23Å; K701-S1308 PolarHBondContact O-OG 3.41Å; Y702-S1308 WeakPolarHBondContact CA-OG 3.27Å; Y702-S1308 WeakPolarHBondContact CD1-O 3.35Å; Y702-S1308 WeakPolarHBondContact CE1-O 3.44Å; R703-S1308 PolarHBondContact N-OG 3.22Å
1309	G	24.1	Very low	24.4	Very low	8 Å²	8	129 Å²	129	8%	0.082	66%	0.655	C	S	.	*			trans	161.7	113.4	156.2	0	0	0	0	0	127.4	M700 Y702	M700-G1309 VanDerWaalsContact CE-O 3.31Å; M700-G1309 WeakPolarHBondContact CE-O 3.3Å; M700-G1309 WeakPolarHBondContact CG-O 3.5Å; Y702-G1309 VanDerWaalsContact N-CA 3.27Å
1310	I	26.3	Very low	24.6	Very low	95 Å²	95	130 Å²	130	49%	0.487	66%	0.657	S	S	.	*				-177.6	148.1	127.6	-101.1	173.5	0	0	0	113.4	M700 Y702	M700-I1310 HydrophobicContact CE-CB 4.41Å; M700-I1310 HydrophobicContact CE-CD1 4.3Å; M700-I1310 HydrophobicContact SD-CB 4.12Å; Y702-I1310 HydrophobicContact CE2-CG1 4.05Å
1311	L	26.9	Very low	24.8	Very low	151 Å²	151	132.8 Å²	132.8	79%	0.791	67%	0.671	S	S	*	*			trans	44.3	122.2	167.8	-81	165.2	0	0	0	122.2
1312	Q	26.2	Very low	25.2	Very low	111 Å²	111	132.2 Å²	132.2	52%	0.519	68%	0.676	S	S	.	*			trans	-161.3	144.5	155.4	-170.9	-167.7	22.2	0	0	109	R703	R703-Q1312 PolarHBondContact NH2-O 2.77Å
1313	N	27.6	Very low	26.1	Very low	130 Å²	130	130.2 Å²	130.2	70%	0.695	67%	0.665	S	S	*	*			trans	70.6	119.6	175	-67.7	-3.1	0	0	0	119
1314	K	28.6	Very low	27.5	Very low	203 Å²	203	127.5 Å²	127.5	88%	0.883	66%	0.659	S	S	*	*	S	Bend		-123.6	130	111.9	-97.8	-169.7	173.5	-175.3	0	109.6
1315	S	27	Very low	29.3	Very low	103 Å²	103	122.1 Å²	122.1	72%	0.72	63%	0.631	S	S	*	*			trans	41.5	86.3	161.3	55.6	0	0	0	0	118.8
1316	Q	24.6	Very low	31.2	Very low	190 Å²	190	120 Å²	120	89%	0.888	63%	0.625	S	S	*	*				-69.4	133.4	118.9	-78.4	179.9	-31	0	0	107.5
1317	L	23	Very low	33.4	Very low	142 Å²	142	116.1 Å²	116.1	74%	0.743	60%	0.601	S	S	*	*			trans	-165.4	129.1	153.5	-105.2	174	0	0	0	107.7
1318	Y	22.6	Very low	36.1	Very low	215 Å²	215	112.5 Å²	112.5	84%	0.843	59%	0.585	S	S	*	*			trans	56.3	98	178.2	-57.3	-76.8	0	0	0	117.6
1319	N	25.5	Very low	39	Very low	154 Å²	154	111.8 Å²	111.8	82%	0.824	58%	0.578	S	S	*	*				-148.5	157.3	89.9	-146.3	-13.7	0	0	0	110.8
1320	K	26.3	Very low	41.8	Very low	181 Å²	181	117.5 Å²	117.5	79%	0.787	61%	0.607	S	S	*	*			trans	-82.3	161.4	169.1	-82	-171.8	173.2	-174.7	0	109.7
1321	N	26.3	Very low	44.5	Very low	167 Å²	167	114.5 Å²	114.5	89%	0.893	59%	0.59	S	S	*	*			trans	70.1	59.9	171.8	-51.9	1.9	0	0	0	115.8
1322	S	31.5	Very low	47.2	Very low	96 Å²	96	107.3 Å²	107.3	67%	0.671	55%	0.552	S	S	*	*			trans	-126.8	101.6	165.1	62.8	0	0	0	0	112.5	T1324	S1322-T1324 PolarHBondContact O-N 2.77Å; S1322-T1324 PolarHBondContact O-OG1 3.31Å
1323	I	40.8	Very low	49.9	Very low	85 Å²	85	104.5 Å²	104.5	44%	0.436	54%	0.541	S	S	.	.			trans	-56.4	129.5	167.5	-72.3	170.1	0	0	0	109.1	L1463	I1323-L1463 HydrophobicContact CD1-CD1 3.84Å; I1323-L1463 HydrophobicContact CG1-CD1 4.07Å; I1323-L1463 HydrophobicContact CG2-CD1 3.89Å; I1323-L1463 HydrophobicContact CG2-CD2 3.94Å; I1323-L1463 HydrophobicContact CG2-CG 3.61Å
1324	T	50.1	Low	52.5	Low	104 Å²	104	103.4 Å²	103.4	64%	0.638	53%	0.53	S	S	*	.			trans	-111.8	106	-175.4	-57.3	0	0	0	0	110.5	S1322	S1322-T1324 PolarHBondContact O-N 2.77Å; S1322-T1324 PolarHBondContact O-OG1 3.31Å
1325	I	63.2	Low	55.1	Low	16 Å²	16	93.8 Å²	93.8	8%	0.082	49%	0.488	C	S	.	.			trans	-76.8	135.8	174.6	-58.6	178.8	0	0	0	108.5	I1327 L1392 L1703 Y1706	I1325-I1327 VanDerWaalsContact C-N 3.29Å; I1325-I1327 HydrophobicContact CG2-CG1 4.2Å; I1325-I1327 PolarHBondContact O-N 2.65Å; I1325-I1327 VanDerWaalsContact O-N 3.16Å; I1325-L1392 HydrophobicContact CG2-CD1 3.7Å; I1325-L1392 HydrophobicContact CG2-CD2 4.04Å; I1325-L1703 HydrophobicContact CD1-CB 4.48Å; I1325-L1703 HydrophobicContact CD1-CD1 3.95Å; I1325-L1703 HydrophobicContact CG2-CD1 4.33Å; I1325-Y1706 HydrophobicContact CB-CD1 3.84Å; I1325-Y1706 HydrophobicContact CB-CD2 4.26Å; I1325-Y1706 HydrophobicContact CB-CE1 3.97Å; I1325-Y1706 HydrophobicContact CB-CE2 4.4Å; I1325-Y1706 HydrophobicContact CB-CG 4.01Å; I1325-Y1706 HydrophobicContact CD1-CG 4.19Å; I1325-Y1706 HydrophobicContact CG1-CG 4.45Å; I1325-Y1706 HydrophobicContact CG2-CD1 4.06Å; I1325-Y1706 HydrophobicContact CG2-CE1 4.22Å; I1325-Y1706 WeakPolarHBondContact O-CE1 3.41Å; I1325-Y1706 PolarHBondContact O-OH 3.34Å
1326	P	63	Low	57.8	Low	95 Å²	95	89.5 Å²	89.5	62%	0.617	46%	0.456	S	S	*	.			trans	-80.7	15.8	-170.4	30.7	-37.6	0	0	0	116.5	L1392	P1326-L1392 HydrophobicContact CG-CD2 3.84Å
1327	I	69.5	Low	60.2	Low	2 Å²	2	82.3 Å²	82.3	1%	0.01	43%	0.427	C	S	.	.			trans	-85.3	145.7	-176.9	-61	-173.1	0	0	0	111	I1325 K1331 I1332 L1388 L1389 L1392 Y1706 F1707 I1710	I1325-I1327 VanDerWaalsContact C-N 3.29Å; I1325-I1327 HydrophobicContact CG2-CG1 4.2Å; I1325-I1327 PolarHBondContact O-N 2.65Å; I1325-I1327 VanDerWaalsContact O-N 3.16Å; I1327-K1331 HydrophobicContact CB-CD 4.49Å; I1327-K1331 HydrophobicContact CG1-CD 4.03Å; I1327-K1331 HydrophobicContact CG2-CB 4.39Å; I1327-K1331 HydrophobicContact CG2-CD 4.24Å; I1327-I1332 HydrophobicContact CG2-CG1 4.28Å; I1327-L1388 HydrophobicContact CD1-CD1 4.35Å; I1327-L1388 WeakPolarHBondContact CD1-O 3.35Å; I1327-L1388 HydrophobicContact CG2-CD1 3.98Å; I1327-L1389 HydrophobicContact CD1-CD2 4.22Å; I1327-L1392 HydrophobicContact CD1-CD1 3.52Å; I1327-L1392 HydrophobicContact CD1-CG 4.03Å; I1327-L1392 HydrophobicContact CG1-CD1 4.16Å; I1327-L1392 HydrophobicContact CG1-CD2 4.49Å; I1327-L1392 HydrophobicContact CG1-CG 4.42Å; I1327-Y1706 HydrophobicContact CB-CE1 4.09Å; I1327-Y1706 VanDerWaalsContact O-CE1 3.32Å; I1327-Y1706 WeakPolarHBondContact O-CE1 3.48Å; I1327-Y1706 PolarHBondContact O-OH 3.25Å; I1327-F1707 HydrophobicContact CD1-CE1 4.48Å; I1327-F1707 HydrophobicContact CD1-CZ 3.74Å; I1327-F1707 HydrophobicContact CG2-CE1 3.9Å; I1327-F1707 HydrophobicContact CG2-CZ 4.18Å; I1327-I1710 HydrophobicContact CB-CD1 4.18Å; I1327-I1710 HydrophobicContact CG2-CD1 3.75Å
1328	N	81.1	Confident	62.6	Low	74 Å²	74	76.1 Å²	76.1	40%	0.396	40%	0.395	S	S	.	.			trans	-146.7	173.8	176.7	61.4	58.9	0	0	0	112	N1330 K1331 I1332	N1328-N1330 PolarHBondContact O-N 3.16Å; N1328-N1330 VanDerWaalsContact O-N 3.16Å; N1328-N1330 WeakPolarHBondContact OD1-CA 3.08Å; N1328-N1330 VanDerWaalsContact OD1-CB 3.31Å; N1328-N1330 WeakPolarHBondContact OD1-CB 3.21Å; N1328-N1330 PolarHBondContact OD1-N 3.5Å; N1328-K1331 WeakPolarHBondContact O-CB 3.27Å; N1328-K1331 PolarHBondContact O-N 3.13Å; N1328-K1331 PolarHBondContact OD1-N 3.27Å; N1328-K1331 VanDerWaalsContact OD1-N 3.13Å; N1328-I1332 PolarHBondContact O-N 2.57Å
1329	L	84.8	Confident	65.2	Low	26 Å²	26	66.1 Å²	66.1	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-53.3	-33.4	179.3	-67.3	173.8	0	0	0	114	N1333 I1648 I1710 E1713 A1714 Y1717	L1329-N1333 VanDerWaalsContact O-CB 3.26Å; L1329-N1333 WeakPolarHBondContact O-CB 3.46Å; L1329-N1333 PolarHBondContact O-N 3.49Å; L1329-I1648 HydrophobicContact CB-CG2 4.45Å; L1329-I1648 HydrophobicContact CD2-CG2 3.77Å; L1329-I1710 HydrophobicContact CD2-CG2 3.49Å; L1329-I1710 VanDerWaalsContact CD2-CG2 3.49Å; L1329-I1710 HydrophobicContact CG-CG2 4Å; L1329-E1713 HydrophobicContact CD1-CB 4.13Å; L1329-E1713 HydrophobicContact CG-CB 4.5Å; L1329-A1714 HydrophobicContact CD2-CB 3.63Å; L1329-Y1717 HydrophobicContact CD1-CG 4.32Å
1330	N	82.3	Confident	67.1	Low	128 Å²	128	62.2 Å²	62.2	68%	0.684	33%	0.329	S	S	*	.	H	α-helix	trans	-71.6	-36.7	176.8	-62.5	-39.2	0	0	0	111.5	N1328 N1333 K1334	N1328-N1330 PolarHBondContact O-N 3.16Å; N1328-N1330 VanDerWaalsContact O-N 3.16Å; N1328-N1330 WeakPolarHBondContact OD1-CA 3.08Å; N1328-N1330 VanDerWaalsContact OD1-CB 3.31Å; N1328-N1330 WeakPolarHBondContact OD1-CB 3.21Å; N1328-N1330 PolarHBondContact OD1-N 3.5Å; N1330-N1333 PolarHBondContact O-N 2.95Å; N1330-K1334 WeakPolarHBondContact O-CB 3.25Å; N1330-K1334 PolarHBondContact O-N 2.92Å
1331	K	83	Confident	68.5	Low	31 Å²	31	59.9 Å²	59.9	14%	0.135	32%	0.322	C	S	.	.	H	α-helix	trans	-66.4	-43.9	173.8	-164.5	-172.6	-173.5	-175.3	0	111.2	I1327 N1328 K1334 A1335 L1388 D1391	I1327-K1331 HydrophobicContact CB-CD 4.49Å; I1327-K1331 HydrophobicContact CG1-CD 4.03Å; I1327-K1331 HydrophobicContact CG2-CB 4.39Å; I1327-K1331 HydrophobicContact CG2-CD 4.24Å; N1328-K1331 WeakPolarHBondContact O-CB 3.27Å; N1328-K1331 PolarHBondContact O-N 3.13Å; N1328-K1331 PolarHBondContact OD1-N 3.27Å; N1328-K1331 VanDerWaalsContact OD1-N 3.13Å; K1331-K1334 PolarHBondContact O-N 3.03Å; K1331-A1335 WeakPolarHBondContact O-CB 3.24Å; K1331-A1335 PolarHBondContact O-N 3.25Å; K1331-L1388 WeakPolarHBondContact CE-O 3.48Å; K1331-L1388 PolarHBondContact NZ-O 3.03Å; K1331-D1391 WeakPolarHBondContact CE-OD2 3.18Å; K1331-D1391 IonicContact NZ-OD2 3.6Å; K1331-D1391 PolarHBondContact NZ-OD2 2.94Å
1332	I	84.7	Confident	69.5	Low	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.3	-49	173.6	-71	-174	0	0	0	110.8	I1327 N1328 K1334 A1335 W1336 L1388 S1651 A1652 F1707 I1710	I1327-I1332 HydrophobicContact CG2-CG1 4.28Å; N1328-I1332 PolarHBondContact O-N 2.57Å; I1332-K1334 VanDerWaalsContact C-N 3.32Å; I1332-K1334 PolarHBondContact O-N 3.02Å; I1332-A1335 PolarHBondContact O-N 3.35Å; I1332-W1336 PolarHBondContact O-N 3.41Å; I1332-L1388 HydrophobicContact CG1-CD1 3.75Å; I1332-S1651 WeakPolarHBondContact CG2-OG 3.35Å; I1332-A1652 HydrophobicContact CD1-CB 4.16Å; I1332-A1652 HydrophobicContact CG2-CB 4.49Å; I1332-F1707 HydrophobicContact CD1-CD1 3.97Å; I1332-F1707 HydrophobicContact CD1-CE1 3.85Å; I1332-F1707 HydrophobicContact CG1-CE1 4.23Å; I1332-I1710 HydrophobicContact CD1-CB 4.16Å; I1332-I1710 HydrophobicContact CD1-CD1 4.14Å; I1332-I1710 HydrophobicContact CD1-CG2 3.45Å; I1332-I1710 VanDerWaalsContact CD1-CG2 3.45Å
1333	N	81.9	Confident	69.8	Low	53 Å²	53	52.5 Å²	52.5	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-64.5	-34.9	178.6	-168.2	32.2	0	0	0	112.4	L1329 N1330 S1337 I1648	L1329-N1333 VanDerWaalsContact O-CB 3.26Å; L1329-N1333 WeakPolarHBondContact O-CB 3.46Å; L1329-N1333 PolarHBondContact O-N 3.49Å; N1330-N1333 PolarHBondContact O-N 2.95Å; N1333-S1337 VanDerWaalsContact O-CB 3.24Å; N1333-S1337 WeakPolarHBondContact O-CB 3Å; N1333-S1337 PolarHBondContact O-N 2.79Å; N1333-S1337 PolarHBondContact O-OG 3.15Å; N1333-I1648 HydrophobicContact CB-CD1 4.34Å; N1333-I1648 HydrophobicContact CB-CG1 4.02Å
1334	K	82.4	Confident	69.7	Low	107 Å²	107	54.6 Å²	54.6	47%	0.465	30%	0.297	S	S	.	.	H	α-helix	trans	-65.4	-48.4	171.9	-173.1	-170.2	174.8	-165.5	0	111	N1330 K1331 I1332 W1336 S1337 N1338 T1827	N1330-K1334 WeakPolarHBondContact O-CB 3.25Å; N1330-K1334 PolarHBondContact O-N 2.92Å; K1331-K1334 PolarHBondContact O-N 3.03Å; I1332-K1334 VanDerWaalsContact C-N 3.32Å; I1332-K1334 PolarHBondContact O-N 3.02Å; K1334-W1336 VanDerWaalsContact C-N 3.33Å; K1334-W1336 PolarHBondContact O-N 2.89Å; K1334-S1337 CarbonylContact O-C 3.49Å; K1334-S1337 WeakPolarHBondContact O-CB 3.12Å; K1334-S1337 PolarHBondContact O-N 2.72Å; K1334-S1337 VanDerWaalsContact O-N 3.11Å; K1334-N1338 WeakPolarHBondContact O-CB 3.38Å; K1334-N1338 PolarHBondContact O-N 2.88Å; K1334-N1338 PolarHBondContact O-OD1 2.61Å; K1334-T1827 VanDerWaalsContact NZ-CG2 3.32Å
1335	A	84.4	Confident	69	Low	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61	-41.7	179.1	0	0	0	0	0	112.4	K1331 I1332 N1338 M1339 F1384 L1388	K1331-A1335 WeakPolarHBondContact O-CB 3.24Å; K1331-A1335 PolarHBondContact O-N 3.25Å; I1332-A1335 PolarHBondContact O-N 3.35Å; A1335-N1338 PolarHBondContact O-N 3.26Å; A1335-M1339 PolarHBondContact O-N 2.74Å; A1335-M1339 VanDerWaalsContact O-N 3.1Å; A1335-F1384 HydrophobicContact CB-CD2 4.01Å; A1335-F1384 HydrophobicContact CB-CE2 3.94Å; A1335-L1388 HydrophobicContact CB-CB 3.95Å
1336	W	82.9	Confident	67.5	Low	13 Å²	13	53.7 Å²	53.7	5%	0.049	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-44.7	171.6	-173.5	-95	0	0	0	111.9	I1332 K1334 N1338 M1339 W1340 F1384 L1650 M1654	I1332-W1336 PolarHBondContact O-N 3.41Å; K1334-W1336 VanDerWaalsContact C-N 3.33Å; K1334-W1336 PolarHBondContact O-N 2.89Å; W1336-N1338 VanDerWaalsContact C-N 3.35Å; W1336-N1338 PolarHBondContact O-N 3.22Å; W1336-M1339 HydrophobicContact CD2-CE 4.18Å; W1336-M1339 HydrophobicContact CE3-CE 3.65Å; W1336-M1339 HydrophobicContact CH2-CE 3.82Å; W1336-M1339 HydrophobicContact CZ2-CE 4.29Å; W1336-M1339 HydrophobicContact CZ3-CE 3.47Å; W1336-M1339 VanDerWaalsContact CZ3-CE 3.47Å; W1336-M1339 WeakPolarHBondContact O-CB 3.42Å; W1336-M1339 PolarHBondContact O-N 3.36Å; W1336-W1340 AromaticContact CD1-CD1 3.74Å; W1336-W1340 AromaticContact CD2-CD1 3.99Å; W1336-W1340 AromaticContact CD2-NE1 3.91Å; W1336-W1340 AromaticContact CE2-CD1 3.52Å; W1336-W1340 AromaticContact CE2-NE1 3.22Å; W1336-W1340 AromaticContact CH2-NE1 3.81Å; W1336-W1340 AromaticContact CZ2-CD1 3.97Å; W1336-W1340 AromaticContact CZ2-NE1 3.17Å; W1336-W1340 AromaticContact NE1-CD1 3.31Å; W1336-W1340 VanDerWaalsContact NE1-CD1 3.31Å; W1336-W1340 AromaticContact NE1-NE1 3.46Å; W1336-W1340 VanDerWaalsContact O-CD1 3.26Å; W1336-W1340 PolarHBondContact O-N 2.89Å; W1336-F1384 HydrophobicContact CB-CE2 4.14Å; W1336-F1384 HydrophobicContact CE3-CD2 4.36Å; W1336-F1384 HydrophobicContact CE3-CE2 4.14Å; W1336-L1650 HydrophobicContact CH2-CD2 3.76Å; W1336-L1650 HydrophobicContact CH2-CG 3.81Å; W1336-L1650 HydrophobicContact CZ2-CD2 3.88Å; W1336-L1650 HydrophobicContact CZ2-CG 4.26Å; W1336-L1650 HydrophobicContact CZ3-CG 4.37Å; W1336-M1654 HydrophobicContact CE3-SD 4.32Å; W1336-M1654 HydrophobicContact CZ3-SD 3.81Å
1337	S	75.9	Confident	65.9	Low	39 Å²	39	54 Å²	54	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-43.7	176.7	-62.3	0	0	0	0	111.5	N1333 K1334 M1339 W1340 Q1341	N1333-S1337 VanDerWaalsContact O-CB 3.24Å; N1333-S1337 WeakPolarHBondContact O-CB 3Å; N1333-S1337 PolarHBondContact O-N 2.79Å; N1333-S1337 PolarHBondContact O-OG 3.15Å; K1334-S1337 CarbonylContact O-C 3.49Å; K1334-S1337 WeakPolarHBondContact O-CB 3.12Å; K1334-S1337 PolarHBondContact O-N 2.72Å; K1334-S1337 VanDerWaalsContact O-N 3.11Å; S1337-M1339 PolarHBondContact O-N 2.78Å; S1337-W1340 CarbonylContact O-C 3.34Å; S1337-W1340 PolarHBondContact O-N 2.74Å; S1337-W1340 VanDerWaalsContact O-N 3.11Å; S1337-Q1341 VanDerWaalsContact O-CB 3.27Å; S1337-Q1341 WeakPolarHBondContact O-CB 2.89Å; S1337-Q1341 WeakPolarHBondContact O-CG 3.39Å; S1337-Q1341 PolarHBondContact O-N 3.29Å
1338	N	72.8	Confident	64.1	Low	13 Å²	13	54.6 Å²	54.6	7%	0.07	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-45	175.8	-76	13.6	0	0	0	111.7	K1334 A1335 W1336 W1340 Q1341 S1387	K1334-N1338 WeakPolarHBondContact O-CB 3.38Å; K1334-N1338 PolarHBondContact O-N 2.88Å; K1334-N1338 PolarHBondContact O-OD1 2.61Å; A1335-N1338 PolarHBondContact O-N 3.26Å; W1336-N1338 VanDerWaalsContact C-N 3.35Å; W1336-N1338 PolarHBondContact O-N 3.22Å; N1338-W1340 PolarHBondContact O-N 3.07Å; N1338-Q1341 PolarHBondContact O-N 3.16Å; N1338-S1387 PolarHBondContact ND2-OG 3.37Å
1339	M	76.2	Confident	61.5	Low	4 Å²	4	58.4 Å²	58.4	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-59.2	-28.2	177.2	-169.9	-176.5	72.1	0	0	113.1	A1335 W1336 S1337 R1380 F1384 L1485 M1654	A1335-M1339 PolarHBondContact O-N 2.74Å; A1335-M1339 VanDerWaalsContact O-N 3.1Å; W1336-M1339 HydrophobicContact CD2-CE 4.18Å; W1336-M1339 HydrophobicContact CE3-CE 3.65Å; W1336-M1339 HydrophobicContact CH2-CE 3.82Å; W1336-M1339 HydrophobicContact CZ2-CE 4.29Å; W1336-M1339 HydrophobicContact CZ3-CE 3.47Å; W1336-M1339 VanDerWaalsContact CZ3-CE 3.47Å; W1336-M1339 WeakPolarHBondContact O-CB 3.42Å; W1336-M1339 PolarHBondContact O-N 3.36Å; S1337-M1339 PolarHBondContact O-N 2.78Å; M1339-R1380 HydrophobicContact CG-CB 4.43Å; M1339-R1380 WeakPolarHBondContact CG-O 3.46Å; M1339-F1384 HydrophobicContact CB-CB 4.19Å; M1339-F1384 HydrophobicContact CG-CB 4.19Å; M1339-F1384 HydrophobicContact SD-CB 3.68Å; M1339-F1384 HydrophobicContact SD-CD2 4.49Å; M1339-F1384 HydrophobicContact SD-CG 4.28Å; M1339-L1485 HydrophobicContact CE-CD1 4.47Å; M1339-L1485 HydrophobicContact CE-CD2 4Å; M1339-L1485 HydrophobicContact CE-CG 4.12Å; M1339-L1485 HydrophobicContact SD-CD1 4.01Å; M1339-L1485 HydrophobicContact SD-CD2 4.46Å; M1339-L1485 HydrophobicContact SD-CG 4.3Å; M1339-M1654 HydrophobicContact SD-CE 4.07Å; M1339-M1654 HydrophobicContact SD-SD 4.42Å
1340	W	66.6	Low	59	Low	72 Å²	72	66.4 Å²	66.4	27%	0.273	34%	0.343	S	S	.	.	H	α-helix	trans	-102.2	-26.7	-178.7	-75.5	105.1	0	0	0	115.1	W1336 S1337 N1338 T1342 G1343 L1485 S1488	W1336-W1340 AromaticContact CD1-CD1 3.74Å; W1336-W1340 AromaticContact CD2-CD1 3.99Å; W1336-W1340 AromaticContact CD2-NE1 3.91Å; W1336-W1340 AromaticContact CE2-CD1 3.52Å; W1336-W1340 AromaticContact CE2-NE1 3.22Å; W1336-W1340 AromaticContact CH2-NE1 3.81Å; W1336-W1340 AromaticContact CZ2-CD1 3.97Å; W1336-W1340 AromaticContact CZ2-NE1 3.17Å; W1336-W1340 AromaticContact NE1-CD1 3.31Å; W1336-W1340 VanDerWaalsContact NE1-CD1 3.31Å; W1336-W1340 AromaticContact NE1-NE1 3.46Å; W1336-W1340 VanDerWaalsContact O-CD1 3.26Å; W1336-W1340 PolarHBondContact O-N 2.89Å; S1337-W1340 CarbonylContact O-C 3.34Å; S1337-W1340 PolarHBondContact O-N 2.74Å; S1337-W1340 VanDerWaalsContact O-N 3.11Å; N1338-W1340 PolarHBondContact O-N 3.07Å; W1340-T1342 PolarHBondContact O-N 2.86Å; W1340-G1343 PolarHBondContact O-N 2.95Å; W1340-G1343 VanDerWaalsContact O-N 3.09Å; W1340-L1485 HydrophobicContact CH2-CD2 4.36Å; W1340-L1485 HydrophobicContact CZ2-CD2 3.93Å; W1340-S1488 VanDerWaalsContact CZ2-OG 3.31Å; W1340-S1488 WeakPolarHBondContact CZ2-OG 3.26Å
1341	Q	56	Low	56.8	Low	133 Å²	133	63.9 Å²	63.9	62%	0.621	33%	0.329	S	S	*	.	H	α-helix	trans	-64.2	-28.3	-175.8	-88.5	174.9	15	0	0	112.9	S1337 N1338 G1343	S1337-Q1341 VanDerWaalsContact O-CB 3.27Å; S1337-Q1341 WeakPolarHBondContact O-CB 2.89Å; S1337-Q1341 WeakPolarHBondContact O-CG 3.39Å; S1337-Q1341 PolarHBondContact O-N 3.29Å; N1338-Q1341 PolarHBondContact O-N 3.16Å; Q1341-G1343 PolarHBondContact O-N 2.84Å
1342	T	47.1	Very low	54.2	Low	47 Å²	47	70.9 Å²	70.9	29%	0.288	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-19.1	177.2	53.3	0	0	0	0	112.7	W1340 F1344 R1380	W1340-T1342 PolarHBondContact O-N 2.86Å; T1342-F1344 WeakPolarHBondContact O-CD2 3.46Å; T1342-F1344 PolarHBondContact O-N 3.1Å; T1342-R1380 PolarHBondContact OG1-NH1 3.44Å; T1342-R1380 PolarHBondContact OG1-NH2 2.85Å
1343	G	38.3	Very low	52.2	Low	60 Å²	60	72.3 Å²	72.3	62%	0.619	37%	0.37	S	S	*	.			trans	67.7	-29.4	162.1	0	0	0	0	0	117.5	W1340 Q1341	W1340-G1343 PolarHBondContact O-N 2.95Å; W1340-G1343 VanDerWaalsContact O-N 3.09Å; Q1341-G1343 PolarHBondContact O-N 2.84Å
1344	F	37.7	Very low	50.5	Low	130 Å²	130	76.2 Å²	76.2	57%	0.57	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-101.9	121	-177.3	-70.4	-93.1	0	0	0	109.8	T1342 R1380	T1342-F1344 WeakPolarHBondContact O-CD2 3.46Å; T1342-F1344 PolarHBondContact O-N 3.1Å; F1344-R1380 PolarHBondContact O-NH2 3.04Å
1345	I	36.5	Very low	49.2	Very low	41 Å²	41	72.8 Å²	72.8	21%	0.21	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-71.4	127.6	158.2	-70.2	164.8	0	0	0	105.7	N1347 L1376 F1573	I1345-N1347 PolarHBondContact O-N 3.07Å; I1345-L1376 HydrophobicContact CG2-CD1 3.77Å; I1345-L1376 HydrophobicContact CG2-CD2 3.75Å; I1345-L1376 HydrophobicContact CG2-CG 3.94Å; I1345-F1573 HydrophobicContact CD1-CB 3.61Å
1346	P	31.5	Very low	48	Very low	60 Å²	60	75.5 Å²	75.5	39%	0.39	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-60.4	140.3	-170.4	23.8	-33.2	0	0	0	111.1	P1348 L1376	P1346-P1348 VanDerWaalsContact O-CD 3.3Å; P1346-P1348 WeakPolarHBondContact O-CD 3.26Å; P1346-L1376 HydrophobicContact CG-CD1 3.74Å
1347	N	28.9	Very low	47.1	Very low	101 Å²	101	77.5 Å²	77.5	54%	0.54	40%	0.403	S	S	.	.			trans	-50.1	112.5	-159.2	-178.9	5.3	0	0	0	114.3	I1345 E1349	I1345-N1347 PolarHBondContact O-N 3.07Å; N1347-E1349 PolarHBondContact ND2-OE2 2.87Å; N1347-E1349 WeakPolarHBondContact OD1-CB 3.49Å; N1347-E1349 VanDerWaalsContact OD1-CG 3.25Å; N1347-E1349 WeakPolarHBondContact OD1-CG 3.38Å; N1347-E1349 PolarHBondContact OD1-N 3.15Å
1348	P	32.2	Very low	46.1	Very low	14 Å²	14	81.2 Å²	81.2	9%	0.091	42%	0.424	C	S	.	.			trans	-96.2	36.6	175.5	38.4	-31.6	0	0	0	113.1	P1346 Q1350 I1351 T1575	P1346-P1348 VanDerWaalsContact O-CD 3.3Å; P1346-P1348 WeakPolarHBondContact O-CD 3.26Å; P1348-Q1350 PolarHBondContact O-N 3.24Å; P1348-I1351 HydrophobicContact CB-CB 4.01Å; P1348-I1351 HydrophobicContact CB-CD1 4.1Å; P1348-I1351 HydrophobicContact CB-CG1 4.03Å; P1348-I1351 PolarHBondContact O-N 2.68Å; P1348-T1575 HydrophobicContact CG-CG2 3.35Å
1349	E	25.8	Very low	45.3	Very low	155 Å²	155	84.4 Å²	84.4	72%	0.724	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-13.9	169.5	-93.7	177.4	147.2	0	0	114	N1347	N1347-E1349 PolarHBondContact ND2-OE2 2.87Å; N1347-E1349 WeakPolarHBondContact OD1-CB 3.49Å; N1347-E1349 VanDerWaalsContact OD1-CG 3.25Å; N1347-E1349 WeakPolarHBondContact OD1-CG 3.38Å; N1347-E1349 PolarHBondContact OD1-N 3.15Å
1350	Q	33.1	Very low	44.1	Very low	194 Å²	194	91.6 Å²	91.6	91%	0.907	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	4	172.6	-61.3	-173.1	-1.6	0	0	114.4	P1348	P1348-Q1350 PolarHBondContact O-N 3.24Å
1351	I	34.1	Very low	43.7	Very low	74 Å²	74	92 Å²	92	38%	0.379	48%	0.477	S	S	.	.			trans	-128.1	75	-172.2	-34.5	-179.3	0	0	0	111.5	P1348 L1353	P1348-I1351 HydrophobicContact CB-CB 4.01Å; P1348-I1351 HydrophobicContact CB-CD1 4.1Å; P1348-I1351 HydrophobicContact CB-CG1 4.03Å; P1348-I1351 PolarHBondContact O-N 2.68Å; I1351-L1353 HydrophobicContact CG2-CD1 4.45Å; I1351-L1353 HydrophobicContact CG2-CD2 3.51Å; I1351-L1353 HydrophobicContact CG2-CG 3.73Å; I1351-L1353 PolarHBondContact O-N 3.2Å
1352	E	29.3	Very low	44.5	Very low	178 Å²	178	86 Å²	86	83%	0.832	45%	0.451	S	S	*	.			trans	-69.6	92.8	168.7	-170.3	178.6	-134	0	0	110	N1354	E1352-N1354 PolarHBondContact O-N 3.25Å
1353	L	43.7	Very low	45.9	Very low	31 Å²	31	84.2 Å²	84.2	16%	0.162	44%	0.439	C	S	.	.			trans	-75.6	54.5	-174.9	-72.1	178.6	0	0	0	114.6	I1351 L1355 T1368 I1372 F1573	I1351-L1353 HydrophobicContact CG2-CD1 4.45Å; I1351-L1353 HydrophobicContact CG2-CD2 3.51Å; I1351-L1353 HydrophobicContact CG2-CG 3.73Å; I1351-L1353 PolarHBondContact O-N 3.2Å; L1353-L1355 VanDerWaalsContact C-N 3.26Å; L1353-L1355 PolarHBondContact O-N 3.11Å; L1353-L1355 VanDerWaalsContact O-N 3.08Å; L1353-T1368 HydrophobicContact CD2-CG2 3.92Å; L1353-I1372 HydrophobicContact CD1-CD1 3.78Å; L1353-I1372 HydrophobicContact CD1-CG1 4.27Å; L1353-I1372 HydrophobicContact CD2-CD1 3.43Å; L1353-I1372 VanDerWaalsContact CD2-CD1 3.43Å; L1353-I1372 HydrophobicContact CD2-CG1 4.03Å; L1353-I1372 HydrophobicContact CG-CD1 4.27Å; L1353-F1573 HydrophobicContact CD1-CE2 3.99Å; L1353-F1573 HydrophobicContact CD1-CZ 3.71Å
1354	N	46.1	Very low	47.5	Very low	135 Å²	135	86.5 Å²	86.5	72%	0.722	43%	0.432	S	S	*	.			trans	-82.4	72.9	169.2	-153.7	-2	0	0	0	109.6	E1352 D1356	E1352-N1354 PolarHBondContact O-N 3.25Å; N1354-D1356 VanDerWaalsContact C-N 3.33Å; N1354-D1356 PolarHBondContact O-N 3.09Å
1355	L	54.6	Low	49.2	Very low	34 Å²	34	80.8 Å²	80.8	18%	0.178	41%	0.407	C	S	.	.			trans	-64.8	88.5	178.9	-74.8	170	0	0	0	110.7	L1353 I1357 W1365 T1368	L1353-L1355 VanDerWaalsContact C-N 3.26Å; L1353-L1355 PolarHBondContact O-N 3.11Å; L1353-L1355 VanDerWaalsContact O-N 3.08Å; L1355-I1357 PolarHBondContact O-N 2.86Å; L1355-W1365 HydrophobicContact CD2-CB 4.08Å; L1355-T1368 HydrophobicContact CD2-CG2 3.74Å
1356	D	57.9	Low	51.1	Low	58 Å²	58	78.9 Å²	78.9	31%	0.31	40%	0.397	S	S	.	.			trans	-72	81.4	172.1	-175.3	8.4	0	0	0	111	N1354 T1358 Q1359	N1354-D1356 VanDerWaalsContact C-N 3.33Å; N1354-D1356 PolarHBondContact O-N 3.09Å; D1356-T1358 PolarHBondContact O-N 3.1Å; D1356-T1358 WeakPolarHBondContact OD1-CA 3.2Å; D1356-T1358 WeakPolarHBondContact OD1-CB 3.34Å; D1356-T1358 PolarHBondContact OD1-N 3.4Å; D1356-T1358 PolarHBondContact OD1-OG1 3.41Å; D1356-Q1359 HydrophobicContact CB-CB 4.32Å; D1356-Q1359 WeakPolarHBondContact O-CB 3.43Å; D1356-Q1359 PolarHBondContact O-N 2.91Å; D1356-Q1359 VanDerWaalsContact O-N 3.11Å; D1356-Q1359 PolarHBondContact OD1-N 3.38Å; D1356-Q1359 PolarHBondContact OD2-NE2 3.36Å
1357	I	65	Low	53.4	Low	54 Å²	54	76.3 Å²	76.3	28%	0.277	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-0.7	170.8	55.7	162.1	0	0	0	114.3	L1355 W1365 K1587 A1591	L1355-I1357 PolarHBondContact O-N 2.86Å; I1357-W1365 HydrophobicContact CG2-CD2 4.09Å; I1357-W1365 HydrophobicContact CG2-CE3 4.06Å; I1357-W1365 HydrophobicContact CG2-CH2 4.46Å; I1357-W1365 HydrophobicContact CG2-CZ2 4.48Å; I1357-W1365 HydrophobicContact CG2-CZ3 4.25Å; I1357-K1587 HydrophobicContact CD1-CB 3.81Å; I1357-K1587 HydrophobicContact CD1-CG 4.5Å; I1357-A1591 HydrophobicContact CB-CB 3.6Å; I1357-A1591 HydrophobicContact CD1-CB 3.95Å; I1357-A1591 HydrophobicContact CG1-CB 4.39Å; I1357-A1591 HydrophobicContact CG2-CB 3.57Å
1358	T	54.7	Low	55.5	Low	118 Å²	118	74 Å²	74	72%	0.724	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-9.9	173.7	73.1	0	0	0	0	113.1	D1356	D1356-T1358 PolarHBondContact O-N 3.1Å; D1356-T1358 WeakPolarHBondContact OD1-CA 3.2Å; D1356-T1358 WeakPolarHBondContact OD1-CB 3.34Å; D1356-T1358 PolarHBondContact OD1-N 3.4Å; D1356-T1358 PolarHBondContact OD1-OG1 3.41Å
1359	Q	55.3	Low	57.6	Low	79 Å²	79	73.4 Å²	73.4	37%	0.369	37%	0.366	S	S	.	.	S	Bend	trans	-74.1	134	174.1	-124.9	163.5	94.9	0	0	110.8	D1356	D1356-Q1359 HydrophobicContact CB-CB 4.32Å; D1356-Q1359 WeakPolarHBondContact O-CB 3.43Å; D1356-Q1359 PolarHBondContact O-N 2.91Å; D1356-Q1359 VanDerWaalsContact O-N 3.11Å; D1356-Q1359 PolarHBondContact OD1-N 3.38Å; D1356-Q1359 PolarHBondContact OD2-NE2 3.36Å
1360	R	52.3	Low	60.1	Low	155 Å²	155	66 Å²	66	59%	0.585	33%	0.331	S	S	*	.	S	Bend	trans	-115.6	144.6	170	-73.2	-179.5	170.8	-138	3.7	109.5	E1598	R1360-E1598 WeakPolarHBondContact CD-OE1 3.33Å; R1360-E1598 WeakPolarHBondContact CG-OE1 3.26Å; R1360-E1598 VanDerWaalsContact CZ-CD 3.41Å; R1360-E1598 IonicContact CZ-OE1 2.83Å; R1360-E1598 IonicContact NE-OE1 2.67Å; R1360-E1598 PolarHBondContact NE-OE1 3.21Å; R1360-E1598 IonicContact NH1-OE1 2.75Å; R1360-E1598 PolarHBondContact NH1-OE1 3.09Å; R1360-E1598 IonicContact NH2-OE1 3.07Å
1361	P	58.1	Low	62.1	Low	81 Å²	81	58.3 Å²	58.3	53%	0.526	30%	0.296	S	S	.	.	S	Bend	cis	-68.2	145.2	-2.1	29.7	-35.8	0	0	0	112.4	L1363	P1361-L1363 PolarHBondContact O-N 3.13Å; P1361-L1363 VanDerWaalsContact O-N 3.09Å
1362	A	72	Confident	64	Low	8 Å²	8	55.9 Å²	55.9	7%	0.066	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-21	-176.3	0	0	0	0	0	114.4	K1364 W1365 C1366 I1595	A1362-K1364 PolarHBondContact O-N 2.83Å; A1362-W1365 HydrophobicContact CB-CZ2 4.04Å; A1362-W1365 PolarHBondContact O-N 2.68Å; A1362-W1365 VanDerWaalsContact O-N 3.14Å; A1362-C1366 PolarHBondContact O-N 3Å; A1362-C1366 VanDerWaalsContact O-N 3.08Å; A1362-C1366 PolarHBondContact O-SG 2.63Å; A1362-I1595 HydrophobicContact CB-CD1 4.15Å; A1362-I1595 HydrophobicContact CB-CG1 3.92Å
1363	L	76.1	Confident	66.3	Low	9 Å²	9	48.2 Å²	48.2	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-44.5	-42.4	-179.2	-176.2	61.6	0	0	0	113.2	P1361 W1365 C1366 L1367 I1777 E1780 Y1788	P1361-L1363 PolarHBondContact O-N 3.13Å; P1361-L1363 VanDerWaalsContact O-N 3.09Å; L1363-W1365 PolarHBondContact O-N 2.89Å; L1363-C1366 PolarHBondContact O-N 3.11Å; L1363-L1367 VanDerWaalsContact O-CB 3.29Å; L1363-L1367 WeakPolarHBondContact O-CB 3.26Å; L1363-L1367 PolarHBondContact O-N 3Å; L1363-I1777 HydrophobicContact CD1-CD1 4.09Å; L1363-I1777 HydrophobicContact CD1-CG2 4.4Å; L1363-E1780 HydrophobicContact CD1-CB 3.74Å; L1363-E1780 HydrophobicContact CD2-CB 4.27Å; L1363-Y1788 HydrophobicContact CD2-CD2 4.25Å; L1363-Y1788 HydrophobicContact CD2-CE2 4.13Å
1364	K	71.6	Confident	67.8	Low	107 Å²	107	46.8 Å²	46.8	47%	0.465	24%	0.24	S	C	.	.	H	α-helix	trans	-57.9	-50.1	-178.1	-176.1	178.3	175	-176.5	0	113.2	A1362 T1368 Y1788	A1362-K1364 PolarHBondContact O-N 2.83Å; K1364-T1368 WeakPolarHBondContact O-CB 3.46Å; K1364-T1368 PolarHBondContact O-N 3.19Å; K1364-T1368 VanDerWaalsContact O-N 3.12Å; K1364-T1368 PolarHBondContact O-OG1 3.04Å; K1364-Y1788 HydrophobicContact CB-CE1 3.99Å; K1364-Y1788 HydrophobicContact CG-CE1 4.3Å
1365	W	74.5	Confident	68.9	Low	11 Å²	11	43.7 Å²	43.7	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-82.3	-25.5	-178.9	67.7	-104	0	0	0	111.9	L1355 I1357 A1362 L1363 T1368 L1369 L1588 A1591 L1592 I1595	L1355-W1365 HydrophobicContact CD2-CB 4.08Å; I1357-W1365 HydrophobicContact CG2-CD2 4.09Å; I1357-W1365 HydrophobicContact CG2-CE3 4.06Å; I1357-W1365 HydrophobicContact CG2-CH2 4.46Å; I1357-W1365 HydrophobicContact CG2-CZ2 4.48Å; I1357-W1365 HydrophobicContact CG2-CZ3 4.25Å; A1362-W1365 HydrophobicContact CB-CZ2 4.04Å; A1362-W1365 PolarHBondContact O-N 2.68Å; A1362-W1365 VanDerWaalsContact O-N 3.14Å; L1363-W1365 PolarHBondContact O-N 2.89Å; W1365-T1368 PolarHBondContact O-N 3Å; W1365-L1369 PolarHBondContact O-N 3.05Å; W1365-L1588 HydrophobicContact CE3-CD1 4.42Å; W1365-L1588 HydrophobicContact CZ3-CD1 3.88Å; W1365-A1591 HydrophobicContact CH2-CB 3.68Å; W1365-A1591 HydrophobicContact CZ2-CB 3.97Å; W1365-A1591 HydrophobicContact CZ3-CB 4.36Å; W1365-L1592 HydrophobicContact CH2-CB 4.07Å; W1365-L1592 HydrophobicContact CH2-CD2 3.65Å; W1365-L1592 HydrophobicContact CH2-CG 3.56Å; W1365-L1592 HydrophobicContact CZ3-CD2 3.44Å; W1365-L1592 VanDerWaalsContact CZ3-CD2 3.44Å; W1365-L1592 HydrophobicContact CZ3-CG 3.65Å; W1365-I1595 HydrophobicContact CH2-CD1 3.74Å; W1365-I1595 HydrophobicContact CH2-CG1 4.37Å; W1365-I1595 HydrophobicContact CZ2-CD1 3.86Å; W1365-I1595 HydrophobicContact CZ2-CG1 4.14Å
1366	C	77.1	Confident	69.6	Low	1 Å²	1	43.6 Å²	43.6	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-68.5	-43.6	171.3	-62.1	0	0	0	0	112.8	A1362 L1363 T1368 L1369 A1370 I1595 F1773 I1777	A1362-C1366 PolarHBondContact O-N 3Å; A1362-C1366 VanDerWaalsContact O-N 3.08Å; A1362-C1366 PolarHBondContact O-SG 2.63Å; L1363-C1366 PolarHBondContact O-N 3.11Å; C1366-T1368 VanDerWaalsContact C-N 3.34Å; C1366-L1369 WeakPolarHBondContact O-CB 3.43Å; C1366-L1369 PolarHBondContact O-N 3.38Å; C1366-A1370 PolarHBondContact O-N 2.57Å; C1366-I1595 WeakPolarHBondContact SG-CD1 3.41Å; C1366-F1773 HydrophobicContact CB-CE2 4.27Å; C1366-F1773 HydrophobicContact CB-CZ 4.07Å; C1366-I1777 HydrophobicContact CB-CD1 3.43Å; C1366-I1777 VanDerWaalsContact CB-CD1 3.43Å; C1366-I1777 HydrophobicContact CB-CG1 3.94Å; C1366-I1777 HydrophobicContact CB-CG2 4.41Å
1367	L	78.1	Confident	70.4	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-41	172.4	178.7	63.4	0	0	0	110.8	L1363 L1369 A1370 N1371 I1777 Y1788 I1790 L1794	L1363-L1367 VanDerWaalsContact O-CB 3.29Å; L1363-L1367 WeakPolarHBondContact O-CB 3.26Å; L1363-L1367 PolarHBondContact O-N 3Å; L1367-L1369 VanDerWaalsContact C-N 3.28Å; L1367-L1369 PolarHBondContact O-N 3.35Å; L1367-A1370 PolarHBondContact O-N 3.27Å; L1367-N1371 VanDerWaalsContact CD1-OD1 3.31Å; L1367-N1371 WeakPolarHBondContact CD1-OD1 3.46Å; L1367-N1371 VanDerWaalsContact O-CB 3.25Å; L1367-N1371 WeakPolarHBondContact O-CB 3.31Å; L1367-N1371 PolarHBondContact O-N 3.08Å; L1367-I1777 HydrophobicContact CB-CG2 4.01Å; L1367-I1777 HydrophobicContact CD1-CG2 4.19Å; L1367-Y1788 HydrophobicContact CD2-CG 4.45Å; L1367-I1790 HydrophobicContact CD1-CG1 4.28Å; L1367-I1790 HydrophobicContact CD2-CG1 4.34Å; L1367-L1794 HydrophobicContact CD1-CD2 3.56Å
1368	T	74.2	Confident	71	Confident	52 Å²	52	39.4 Å²	39.4	32%	0.319	20%	0.201	S	C	.	.	H	α-helix	trans	-56.5	-44.2	172.9	-56.2	0	0	0	0	110.8	L1353 L1355 K1364 W1365 C1366 I1372	L1353-T1368 HydrophobicContact CD2-CG2 3.92Å; L1355-T1368 HydrophobicContact CD2-CG2 3.74Å; K1364-T1368 WeakPolarHBondContact O-CB 3.46Å; K1364-T1368 PolarHBondContact O-N 3.19Å; K1364-T1368 VanDerWaalsContact O-N 3.12Å; K1364-T1368 PolarHBondContact O-OG1 3.04Å; W1365-T1368 PolarHBondContact O-N 3Å; C1366-T1368 VanDerWaalsContact C-N 3.34Å; T1368-I1372 HydrophobicContact CG2-CD1 4.39Å; T1368-I1372 VanDerWaalsContact O-CD1 3.26Å; T1368-I1372 WeakPolarHBondContact O-CD1 3.29Å; T1368-I1372 WeakPolarHBondContact O-CG1 3.1Å; T1368-I1372 PolarHBondContact O-N 3.18Å
1369	L	76.2	Confident	72.1	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-50.4	174.4	-173.8	72.7	0	0	0	112.2	W1365 C1366 L1367 N1371 I1372 W1373 L1588 L1592 W1770 F1773	W1365-L1369 PolarHBondContact O-N 3.05Å; C1366-L1369 WeakPolarHBondContact O-CB 3.43Å; C1366-L1369 PolarHBondContact O-N 3.38Å; L1367-L1369 VanDerWaalsContact C-N 3.28Å; L1367-L1369 PolarHBondContact O-N 3.35Å; L1369-N1371 PolarHBondContact O-N 2.9Å; L1369-I1372 PolarHBondContact O-N 2.82Å; L1369-W1373 PolarHBondContact O-N 2.86Å; L1369-L1588 HydrophobicContact CD1-CD2 3.92Å; L1369-L1588 HydrophobicContact CD2-CD1 4.24Å; L1369-L1588 HydrophobicContact CD2-CD2 4.21Å; L1369-L1592 HydrophobicContact CD2-CD1 4.47Å; L1369-L1592 HydrophobicContact CD2-CD2 4.11Å; L1369-W1770 HydrophobicContact CD2-CH2 4.12Å; L1369-W1770 HydrophobicContact CD2-CZ3 4.31Å; L1369-W1770 HydrophobicContact CG-CH2 4.36Å; L1369-F1773 HydrophobicContact CD2-CE1 4.18Å; L1369-F1773 HydrophobicContact CD2-CZ 4.26Å
1370	A	78.6	Confident	73.2	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-42.8	-178.3	0	0	0	0	0	112	C1366 L1367 I1372 W1373 S1374 I1777 L1794	C1366-A1370 PolarHBondContact O-N 2.57Å; L1367-A1370 PolarHBondContact O-N 3.27Å; A1370-I1372 PolarHBondContact O-N 3.37Å; A1370-W1373 PolarHBondContact O-N 3.36Å; A1370-S1374 PolarHBondContact O-N 3.13Å; A1370-S1374 PolarHBondContact O-OG 3.24Å; A1370-S1374 VanDerWaalsContact O-OG 3.13Å; A1370-I1777 HydrophobicContact CB-CG2 4.12Å; A1370-L1794 HydrophobicContact CB-CD1 4.05Å; A1370-L1794 HydrophobicContact CB-CD2 3.73Å
1371	N	75.1	Confident	74.8	Confident	31 Å²	31	28.7 Å²	28.7	17%	0.166	14%	0.144	C	C	.	.	H	α-helix	trans	-59.1	-43.1	175.8	-75.2	-6.8	0	0	0	112.6	L1367 L1369 W1373 S1374 D1375 K1789 S1791 L1794	L1367-N1371 VanDerWaalsContact CD1-OD1 3.31Å; L1367-N1371 WeakPolarHBondContact CD1-OD1 3.46Å; L1367-N1371 VanDerWaalsContact O-CB 3.25Å; L1367-N1371 WeakPolarHBondContact O-CB 3.31Å; L1367-N1371 PolarHBondContact O-N 3.08Å; L1369-N1371 PolarHBondContact O-N 2.9Å; N1371-W1373 VanDerWaalsContact C-N 3.34Å; N1371-W1373 PolarHBondContact O-N 2.83Å; N1371-S1374 PolarHBondContact O-N 3.47Å; N1371-D1375 PolarHBondContact O-N 3.1Å; N1371-K1789 PolarHBondContact ND2-O 3.49Å; N1371-S1791 WeakPolarHBondContact CA-OG 3.23Å; N1371-S1791 VanDerWaalsContact CG-CB 3.48Å; N1371-S1791 WeakPolarHBondContact OD1-CB 3.42Å; N1371-S1791 PolarHBondContact OD1-N 2.82Å; N1371-S1791 PolarHBondContact OD1-OG 3.16Å; N1371-L1794 WeakPolarHBondContact OD1-CD2 3.45Å
1372	I	74.3	Confident	76.2	Confident	24 Å²	24	24.8 Å²	24.8	12%	0.123	12%	0.119	C	C	.	.	I	π-helix	trans	-60.9	-45.5	177.1	-63	154.7	0	0	0	110.5	L1353 T1368 L1369 A1370 S1374 L1376 L1377	L1353-I1372 HydrophobicContact CD1-CD1 3.78Å; L1353-I1372 HydrophobicContact CD1-CG1 4.27Å; L1353-I1372 HydrophobicContact CD2-CD1 3.43Å; L1353-I1372 VanDerWaalsContact CD2-CD1 3.43Å; L1353-I1372 HydrophobicContact CD2-CG1 4.03Å; L1353-I1372 HydrophobicContact CG-CD1 4.27Å; T1368-I1372 HydrophobicContact CG2-CD1 4.39Å; T1368-I1372 VanDerWaalsContact O-CD1 3.26Å; T1368-I1372 WeakPolarHBondContact O-CD1 3.29Å; T1368-I1372 WeakPolarHBondContact O-CG1 3.1Å; T1368-I1372 PolarHBondContact O-N 3.18Å; L1369-I1372 PolarHBondContact O-N 2.82Å; A1370-I1372 PolarHBondContact O-N 3.37Å; I1372-S1374 VanDerWaalsContact C-N 3.32Å; I1372-S1374 PolarHBondContact O-N 2.69Å; I1372-L1376 HydrophobicContact CG2-CB 4.41Å; I1372-L1376 HydrophobicContact CG2-CD2 4.17Å; I1372-L1376 VanDerWaalsContact O-CB 3.23Å; I1372-L1376 WeakPolarHBondContact O-CB 3.19Å; I1372-L1376 PolarHBondContact O-N 3.46Å; I1372-L1376 VanDerWaalsContact O-N 3.07Å; I1372-L1377 PolarHBondContact O-N 3.41Å
1373	W	76.6	Confident	76.8	Confident	16 Å²	16	24.6 Å²	24.6	6%	0.061	12%	0.116	C	C	.	.	I	π-helix	trans	-66.5	-38.7	-177.3	-73.4	48.7	0	0	0	110.9	L1369 A1370 N1371 L1377 L1378 V1482 P1483 L1486 W1770	L1369-W1373 PolarHBondContact O-N 2.86Å; A1370-W1373 PolarHBondContact O-N 3.36Å; N1371-W1373 VanDerWaalsContact C-N 3.34Å; N1371-W1373 PolarHBondContact O-N 2.83Å; W1373-L1377 HydrophobicContact CG-CD1 4.43Å; W1373-L1378 PolarHBondContact O-N 3.27Å; W1373-V1482 HydrophobicContact CB-CG1 4.03Å; W1373-V1482 HydrophobicContact CD2-CB 4.31Å; W1373-V1482 HydrophobicContact CD2-CG1 3.49Å; W1373-V1482 VanDerWaalsContact CD2-CG1 3.49Å; W1373-V1482 HydrophobicContact CE3-CB 3.5Å; W1373-V1482 HydrophobicContact CE3-CG1 3.17Å; W1373-V1482 HydrophobicContact CE3-CG2 4.38Å; W1373-V1482 HydrophobicContact CG-CG1 3.86Å; W1373-V1482 HydrophobicContact CZ3-CB 3.98Å; W1373-V1482 HydrophobicContact CZ3-CG1 3.9Å; W1373-P1483 HydrophobicContact CH2-CG 4.33Å; W1373-P1483 HydrophobicContact CZ3-CG 3.85Å; W1373-L1486 HydrophobicContact CD2-CD1 4.09Å; W1373-L1486 VanDerWaalsContact CE2-CD1 3.4Å; W1373-L1486 HydrophobicContact CE3-CD1 4.5Å; W1373-L1486 HydrophobicContact CH2-CD1 3.78Å; W1373-L1486 HydrophobicContact CZ2-CD1 3.24Å; W1373-L1486 HydrophobicContact CZ3-CD1 4.37Å; W1373-W1770 HydrophobicContact CB-CZ2 4.04Å; W1373-W1770 AromaticContact CD2-CE2 3.89Å; W1373-W1770 AromaticContact CD2-CH2 3.52Å; W1373-W1770 HydrophobicContact CD2-CH2 3.52Å; W1373-W1770 AromaticContact CD2-CZ2 3.23Å; W1373-W1770 HydrophobicContact CD2-CZ2 3.23Å; W1373-W1770 HydrophobicContact CD2-CZ3 4.4Å; W1373-W1770 AromaticContact CE2-CH2 3.62Å; W1373-W1770 AromaticContact CE2-CZ2 3.87Å; W1373-W1770 AromaticContact CE3-CD2 3.93Å; W1373-W1770 HydrophobicContact CE3-CD2 3.93Å; W1373-W1770 AromaticContact CE3-CE2 3.15Å; W1373-W1770 HydrophobicContact CE3-CE3 4.4Å; W1373-W1770 AromaticContact CE3-CH2 3.62Å; W1373-W1770 HydrophobicContact CE3-CH2 3.62Å; W1373-W1770 AromaticContact CE3-CZ2 3.02Å; W1373-W1770 HydrophobicContact CE3-CZ2 3.02Å; W1373-W1770 HydrophobicContact CE3-CZ3 4.26Å; W1373-W1770 AromaticContact CE3-NE1 3.48Å; W1373-W1770 HydrophobicContact CG-CH2 4.06Å; W1373-W1770 AromaticContact CG-CZ2 3.71Å; W1373-W1770 HydrophobicContact CG-CZ2 3.71Å; W1373-W1770 HydrophobicContact CH2-CD2 4.11Å; W1373-W1770 AromaticContact CH2-CE3 3.94Å; W1373-W1770 HydrophobicContact CH2-CE3 3.94Å; W1373-W1770 AromaticContact CH2-CH2 3.93Å; W1373-W1770 HydrophobicContact CH2-CH2 3.93Å; W1373-W1770 HydrophobicContact CH2-CZ2 4.11Å; W1373-W1770 AromaticContact CH2-CZ3 3.83Å; W1373-W1770 HydrophobicContact CH2-CZ3 3.83Å; W1373-W1770 AromaticContact CZ2-CH2 3.83Å; W1373-W1770 HydrophobicContact CZ2-CH2 3.83Å; W1373-W1770 HydrophobicContact CZ2-CZ2 4.27Å; W1373-W1770 AromaticContact CZ2-CZ3 3.97Å; W1373-W1770 HydrophobicContact CZ2-CZ3 3.97Å; W1373-W1770 AromaticContact CZ3-CD2 3.55Å; W1373-W1770 HydrophobicContact CZ3-CD2 3.55Å; W1373-W1770 AromaticContact CZ3-CE2 3.3Å; W1373-W1770 AromaticContact CZ3-CE3 3.86Å; W1373-W1770 HydrophobicContact CZ3-CE3 3.86Å; W1373-W1770 HydrophobicContact CZ3-CG 4.24Å; W1373-W1770 AromaticContact CZ3-CH2 3.82Å; W1373-W1770 HydrophobicContact CZ3-CH2 3.82Å; W1373-W1770 AromaticContact CZ3-CZ2 3.51Å; W1373-W1770 HydrophobicContact CZ3-CZ2 3.51Å; W1373-W1770 AromaticContact CZ3-CZ3 3.98Å; W1373-W1770 HydrophobicContact CZ3-CZ3 3.98Å; W1373-W1770 AromaticContact CZ3-NE1 3.71Å
1374	S	75.2	Confident	77.4	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.014	11%	0.114	C	C	.	.	I	π-helix	trans	-84.5	-22	-176.4	-55.9	0	0	0	0	116.1	A1370 N1371 I1372 L1378 Q1774 G1793 L1794	A1370-S1374 PolarHBondContact O-N 3.13Å; A1370-S1374 PolarHBondContact O-OG 3.24Å; A1370-S1374 VanDerWaalsContact O-OG 3.13Å; N1371-S1374 PolarHBondContact O-N 3.47Å; I1372-S1374 VanDerWaalsContact C-N 3.32Å; I1372-S1374 PolarHBondContact O-N 2.69Å; S1374-L1378 VanDerWaalsContact O-CB 3.27Å; S1374-L1378 WeakPolarHBondContact O-CB 3.03Å; S1374-L1378 WeakPolarHBondContact O-CD1 3.48Å; S1374-Q1774 PolarHBondContact OG-NE2 3.49Å; S1374-G1793 WeakPolarHBondContact O-CA 3.04Å; S1374-L1794 WeakPolarHBondContact OG-CD1 3.13Å
1375	D	69.9	Low	78.4	Confident	70 Å²	70	19 Å²	19	37%	0.374	9%	0.092	S	C	.	.	I	π-helix	trans	-105.1	-45.6	177.5	-74.9	38	0	0	0	111.8	N1371 S1791 K1792 G1793	N1371-D1375 PolarHBondContact O-N 3.1Å; D1375-S1791 VanDerWaalsContact CG-CB 3.42Å; D1375-S1791 WeakPolarHBondContact OD1-CB 3.13Å; D1375-S1791 PolarHBondContact OD1-OG 3.18Å; D1375-S1791 WeakPolarHBondContact OD2-CB 3.39Å; D1375-K1792 PolarHBondContact OD2-N 2.87Å; D1375-G1793 VanDerWaalsContact OD1-CA 3.26Å; D1375-G1793 WeakPolarHBondContact OD1-CA 3.1Å; D1375-G1793 PolarHBondContact OD1-N 3.11Å
1376	L	68.7	Low	79.1	Confident	31 Å²	31	18.9 Å²	18.9	16%	0.162	9%	0.092	C	C	.	.	I	π-helix	trans	-82.9	-42.4	-169.6	-166.1	67.2	0	0	0	112.8	I1345 P1346 I1372	I1345-L1376 HydrophobicContact CG2-CD1 3.77Å; I1345-L1376 HydrophobicContact CG2-CD2 3.75Å; I1345-L1376 HydrophobicContact CG2-CG 3.94Å; P1346-L1376 HydrophobicContact CG-CD1 3.74Å; I1372-L1376 HydrophobicContact CG2-CB 4.41Å; I1372-L1376 HydrophobicContact CG2-CD2 4.17Å; I1372-L1376 VanDerWaalsContact O-CB 3.23Å; I1372-L1376 WeakPolarHBondContact O-CB 3.19Å; I1372-L1376 PolarHBondContact O-N 3.46Å; I1372-L1376 VanDerWaalsContact O-N 3.07Å
1377	L	73.8	Confident	79.6	Confident	16 Å²	16	19.5 Å²	19.5	8%	0.084	10%	0.096	C	C	.	.	I	π-helix	trans	-89.4	-32.6	-173.8	-60.6	174.2	0	0	0	111.6	I1372 W1373 R1379 R1380 I1381 V1482 L1486	I1372-L1377 PolarHBondContact O-N 3.41Å; W1373-L1377 HydrophobicContact CG-CD1 4.43Å; L1377-R1379 VanDerWaalsContact C-N 3.35Å; L1377-R1379 PolarHBondContact O-N 2.7Å; L1377-R1380 PolarHBondContact O-N 2.85Å; L1377-R1380 VanDerWaalsContact O-N 3.15Å; L1377-I1381 WeakPolarHBondContact O-CG1 3.41Å; L1377-I1381 PolarHBondContact O-N 2.92Å; L1377-I1381 VanDerWaalsContact O-N 3.15Å; L1377-V1482 HydrophobicContact CB-CG1 3.74Å; L1377-V1482 HydrophobicContact CD1-CG1 3.36Å; L1377-V1482 HydrophobicContact CG-CG1 4.17Å; L1377-L1486 HydrophobicContact CD1-CD1 4.05Å; L1377-L1486 HydrophobicContact CD1-CD2 3.85Å; L1377-L1486 HydrophobicContact CD1-CG 3.88Å
1378	L	77.9	Confident	80.2	Confident	8 Å²	8	19.3 Å²	19.3	4%	0.042	10%	0.095	C	C	.	.	H	α-helix	trans	-51.6	-48.4	172.8	-110.5	178.1	0	0	0	112.3	W1373 S1374 R1380 I1381 S1382 F1478 L1797	W1373-L1378 PolarHBondContact O-N 3.27Å; S1374-L1378 VanDerWaalsContact O-CB 3.27Å; S1374-L1378 WeakPolarHBondContact O-CB 3.03Å; S1374-L1378 WeakPolarHBondContact O-CD1 3.48Å; L1378-R1380 VanDerWaalsContact C-N 3.33Å; L1378-R1380 PolarHBondContact O-N 3.26Å; L1378-I1381 WeakPolarHBondContact O-CB 3.44Å; L1378-I1381 PolarHBondContact O-N 3.45Å; L1378-I1381 VanDerWaalsContact O-N 3.11Å; L1378-S1382 PolarHBondContact O-N 3.24Å; L1378-S1382 PolarHBondContact O-OG 3.41Å; L1378-S1382 VanDerWaalsContact O-OG 3.11Å; L1378-F1478 HydrophobicContact CD2-CB 3.42Å; L1378-F1478 VanDerWaalsContact CD2-CB 3.42Å; L1378-F1478 HydrophobicContact CD2-CD2 3.44Å; L1378-F1478 VanDerWaalsContact CD2-CD2 3.44Å; L1378-F1478 HydrophobicContact CD2-CG 3.92Å; L1378-L1797 HydrophobicContact CD1-CD1 3.86Å; L1378-L1797 HydrophobicContact CD1-CD2 4.39Å; L1378-L1797 HydrophobicContact CD1-CG 4.17Å
1379	R	78.6	Confident	80.9	Confident	94 Å²	94	16.8 Å²	16.8	36%	0.355	8%	0.08	S	C	.	.	H	α-helix	trans	-58.7	-38.5	178.5	-174.2	179	179.2	128.2	13.6	113.4	L1377 S1382 V1383 D1818 E1822	L1377-R1379 VanDerWaalsContact C-N 3.35Å; L1377-R1379 PolarHBondContact O-N 2.7Å; R1379-S1382 WeakPolarHBondContact O-CB 3.06Å; R1379-S1382 PolarHBondContact O-N 2.87Å; R1379-V1383 PolarHBondContact O-N 2.99Å; R1379-D1818 IonicContact CZ-OD2 3.8Å; R1379-D1818 IonicContact NH1-OD2 2.63Å; R1379-D1818 PolarHBondContact NH1-OD2 3.01Å; R1379-D1818 IonicContact NH2-OD2 3.59Å; R1379-D1818 PolarHBondContact NH2-OD2 3.16Å; R1379-E1822 IonicContact NE-OE2 2.75Å; R1379-E1822 IonicContact NH2-OE2 3.15Å
1380	R	78.3	Confident	81.3	Confident	33 Å²	33	17.3 Å²	17.3	13%	0.125	9%	0.086	C	C	.	.	H	α-helix	trans	-70.8	-33.4	178.2	-74.4	-79.4	165.1	-115.2	4.6	111.7	M1339 T1342 F1344 L1377 L1378 V1383 F1384 L1485 E1822	M1339-R1380 HydrophobicContact CG-CB 4.43Å; M1339-R1380 WeakPolarHBondContact CG-O 3.46Å; T1342-R1380 PolarHBondContact OG1-NH1 3.44Å; T1342-R1380 PolarHBondContact OG1-NH2 2.85Å; F1344-R1380 PolarHBondContact O-NH2 3.04Å; L1377-R1380 PolarHBondContact O-N 2.85Å; L1377-R1380 VanDerWaalsContact O-N 3.15Å; L1378-R1380 VanDerWaalsContact C-N 3.33Å; L1378-R1380 PolarHBondContact O-N 3.26Å; R1380-V1383 PolarHBondContact O-N 2.89Å; R1380-F1384 PolarHBondContact O-N 3.16Å; R1380-L1485 HydrophobicContact CB-CD1 4.25Å; R1380-E1822 IonicContact CZ-OE1 2.71Å; R1380-E1822 IonicContact NH1-OE1 2.72Å; R1380-E1822 PolarHBondContact NH1-OE1 3.48Å; R1380-E1822 IonicContact NH1-OE2 2.69Å; R1380-E1822 IonicContact NH2-OE1 2.85Å
1381	I	86.7	Confident	81.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-66.9	-42.3	173.2	-61.5	166.3	0	0	0	110.4	L1377 L1378 V1383 F1384 A1385 F1478 C1481 V1482 L1485 M1654 L1658	L1377-I1381 WeakPolarHBondContact O-CG1 3.41Å; L1377-I1381 PolarHBondContact O-N 2.92Å; L1377-I1381 VanDerWaalsContact O-N 3.15Å; L1378-I1381 WeakPolarHBondContact O-CB 3.44Å; L1378-I1381 PolarHBondContact O-N 3.45Å; L1378-I1381 VanDerWaalsContact O-N 3.11Å; I1381-V1383 VanDerWaalsContact C-N 3.34Å; I1381-V1383 PolarHBondContact O-N 2.96Å; I1381-F1384 PolarHBondContact O-N 2.96Å; I1381-A1385 VanDerWaalsContact O-CB 3.32Å; I1381-A1385 WeakPolarHBondContact O-CB 3.49Å; I1381-A1385 PolarHBondContact O-N 3.48Å; I1381-F1478 HydrophobicContact CB-CG 4.41Å; I1381-F1478 VanDerWaalsContact CD1-O 3.25Å; I1381-F1478 WeakPolarHBondContact CD1-O 3.5Å; I1381-F1478 HydrophobicContact CG2-CB 3.9Å; I1381-F1478 HydrophobicContact CG2-CD1 3.56Å; I1381-F1478 HydrophobicContact CG2-CD2 4.09Å; I1381-F1478 HydrophobicContact CG2-CE1 4.02Å; I1381-F1478 HydrophobicContact CG2-CG 3.58Å; I1381-F1478 HydrophobicContact CG2-CZ 4.47Å; I1381-C1481 HydrophobicContact CD1-CB 3.96Å; I1381-C1481 HydrophobicContact CG1-CB 4.32Å; I1381-C1481 HydrophobicContact CG2-CB 4.16Å; I1381-V1482 HydrophobicContact CD1-CB 4.34Å; I1381-V1482 HydrophobicContact CD1-CG2 3.54Å; I1381-L1485 HydrophobicContact CD1-CD1 4.19Å; I1381-L1485 HydrophobicContact CG1-CD1 3.51Å; I1381-M1654 HydrophobicContact CB-CE 4.25Å; I1381-M1654 HydrophobicContact CG1-CE 3.88Å; I1381-M1654 HydrophobicContact CG2-CE 4.02Å; I1381-L1658 HydrophobicContact CG2-CD2 4.2Å
1382	S	86.8	Confident	81.7	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-56.1	-44.5	173.4	-52.9	0	0	0	0	112.6	L1378 R1379 A1385 M1386 F1478 I1815	L1378-S1382 PolarHBondContact O-N 3.24Å; L1378-S1382 PolarHBondContact O-OG 3.41Å; L1378-S1382 VanDerWaalsContact O-OG 3.11Å; R1379-S1382 WeakPolarHBondContact O-CB 3.06Å; R1379-S1382 PolarHBondContact O-N 2.87Å; S1382-A1385 PolarHBondContact O-N 2.95Å; S1382-M1386 WeakPolarHBondContact O-CB 3.48Å; S1382-M1386 WeakPolarHBondContact O-CG 3.33Å; S1382-M1386 PolarHBondContact O-N 3.43Å; S1382-F1478 WeakPolarHBondContact OG-CE2 3.26Å; S1382-I1815 WeakPolarHBondContact OG-CG2 3.36Å
1383	V	85.1	Confident	82.1	Confident	3 Å²	3	21.5 Å²	21.5	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-63.3	-42	177.4	172.7	0	0	0	0	112.1	R1379 R1380 I1381 S1387 A1819 E1822 C1823	R1379-V1383 PolarHBondContact O-N 2.99Å; R1380-V1383 PolarHBondContact O-N 2.89Å; I1381-V1383 VanDerWaalsContact C-N 3.34Å; I1381-V1383 PolarHBondContact O-N 2.96Å; V1383-S1387 VanDerWaalsContact O-CB 3.32Å; V1383-S1387 WeakPolarHBondContact O-CB 3.19Å; V1383-S1387 PolarHBondContact O-N 3.13Å; V1383-S1387 PolarHBondContact O-OG 3.05Å; V1383-A1819 HydrophobicContact CG2-CB 3.97Å; V1383-E1822 HydrophobicContact CG2-CB 4.36Å; V1383-E1822 HydrophobicContact CG2-CG 4.36Å; V1383-C1823 PolarHBondContact O-SG 3.43Å; V1383-C1823 VanDerWaalsContact O-SG 3.41Å
1384	F	89.1	Confident	81.5	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.2	-48.1	174.1	176.2	-98.8	0	0	0	111.8	A1335 W1336 M1339 R1380 I1381 S1387 L1388 M1654 L1658	A1335-F1384 HydrophobicContact CB-CD2 4.01Å; A1335-F1384 HydrophobicContact CB-CE2 3.94Å; W1336-F1384 HydrophobicContact CB-CE2 4.14Å; W1336-F1384 HydrophobicContact CE3-CD2 4.36Å; W1336-F1384 HydrophobicContact CE3-CE2 4.14Å; M1339-F1384 HydrophobicContact CB-CB 4.19Å; M1339-F1384 HydrophobicContact CG-CB 4.19Å; M1339-F1384 HydrophobicContact SD-CB 3.68Å; M1339-F1384 HydrophobicContact SD-CD2 4.49Å; M1339-F1384 HydrophobicContact SD-CG 4.28Å; R1380-F1384 PolarHBondContact O-N 3.16Å; I1381-F1384 PolarHBondContact O-N 2.96Å; F1384-S1387 PolarHBondContact O-N 3.21Å; F1384-L1388 HydrophobicContact CE1-CD2 3.84Å; F1384-L1388 HydrophobicContact CZ-CD2 3.94Å; F1384-L1388 VanDerWaalsContact O-CB 3.32Å; F1384-L1388 WeakPolarHBondContact O-CB 3.48Å; F1384-L1388 PolarHBondContact O-N 3.44Å; F1384-M1654 HydrophobicContact CB-CE 4.09Å; F1384-M1654 HydrophobicContact CD1-CE 3.67Å; F1384-M1654 HydrophobicContact CD1-CG 4.07Å; F1384-M1654 HydrophobicContact CD1-SD 3.7Å; F1384-M1654 HydrophobicContact CD2-SD 4.47Å; F1384-M1654 HydrophobicContact CE1-CB 4.09Å; F1384-M1654 HydrophobicContact CE1-CE 4.36Å; F1384-M1654 HydrophobicContact CE1-CG 3.8Å; F1384-M1654 HydrophobicContact CE1-SD 3.86Å; F1384-M1654 HydrophobicContact CG-CE 3.98Å; F1384-M1654 HydrophobicContact CG-SD 4.03Å; F1384-M1654 HydrophobicContact CZ-CB 4.36Å; F1384-M1654 HydrophobicContact CZ-CG 4.47Å; F1384-M1654 HydrophobicContact CZ-SD 4.33Å; F1384-L1658 HydrophobicContact CD1-CD1 3.89Å; F1384-L1658 HydrophobicContact CE1-CD1 3.98Å
1385	A	91.1	Very high	80.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-43.5	-177.5	0	0	0	0	0	111.4	I1381 S1382 L1388 L1389 M1470 F1478 L1658	I1381-A1385 VanDerWaalsContact O-CB 3.32Å; I1381-A1385 WeakPolarHBondContact O-CB 3.49Å; I1381-A1385 PolarHBondContact O-N 3.48Å; S1382-A1385 PolarHBondContact O-N 2.95Å; A1385-L1388 PolarHBondContact O-N 2.76Å; A1385-L1389 WeakPolarHBondContact O-CB 3.31Å; A1385-L1389 PolarHBondContact O-N 3.31Å; A1385-M1470 HydrophobicContact CB-CE 3.49Å; A1385-M1470 VanDerWaalsContact CB-CE 3.49Å; A1385-F1478 HydrophobicContact CB-CE1 3.68Å; A1385-F1478 HydrophobicContact CB-CZ 3.65Å; A1385-L1658 HydrophobicContact CB-CD1 3.87Å
1386	M	89.7	Confident	79.2	Confident	7 Å²	7	30 Å²	30	3%	0.034	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-40.8	173.5	-70.1	-53.4	-53.9	0	0	112.6	S1382 L1388 G1390 I1393 W1467 M1470 L1816 A1819 K1820	S1382-M1386 WeakPolarHBondContact O-CB 3.48Å; S1382-M1386 WeakPolarHBondContact O-CG 3.33Å; S1382-M1386 PolarHBondContact O-N 3.43Å; M1386-L1388 PolarHBondContact O-N 2.79Å; M1386-G1390 VanDerWaalsContact O-CA 3.26Å; M1386-G1390 WeakPolarHBondContact O-CA 3.38Å; M1386-G1390 PolarHBondContact O-N 3.42Å; M1386-I1393 HydrophobicContact CE-CD1 3.96Å; M1386-I1393 HydrophobicContact SD-CD1 4.28Å; M1386-W1467 HydrophobicContact CE-CH2 3.87Å; M1386-W1467 HydrophobicContact CE-CZ2 4.49Å; M1386-W1467 HydrophobicContact CE-CZ3 4.44Å; M1386-W1467 HydrophobicContact SD-CH2 4.37Å; M1386-W1467 HydrophobicContact SD-CZ3 4.41Å; M1386-M1470 HydrophobicContact CG-CE 4.45Å; M1386-M1470 HydrophobicContact SD-CE 3.73Å; M1386-M1470 HydrophobicContact SD-CG 4.23Å; M1386-L1816 HydrophobicContact CG-CD2 4.42Å; M1386-L1816 HydrophobicContact SD-CD2 4.28Å; M1386-A1819 HydrophobicContact CB-CB 4.23Å; M1386-A1819 HydrophobicContact CG-CB 3.77Å; M1386-K1820 HydrophobicContact CE-CB 3.97Å; M1386-K1820 HydrophobicContact CE-CD 4.15Å; M1386-K1820 HydrophobicContact CE-CG 3.98Å
1387	S	87.3	Confident	77.7	Confident	15 Å²	15	35 Å²	35	11%	0.105	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-26.4	174.2	-76.4	0	0	0	0	113.5	N1338 V1383 F1384 C1823	N1338-S1387 PolarHBondContact ND2-OG 3.37Å; V1383-S1387 VanDerWaalsContact O-CB 3.32Å; V1383-S1387 WeakPolarHBondContact O-CB 3.19Å; V1383-S1387 PolarHBondContact O-N 3.13Å; V1383-S1387 PolarHBondContact O-OG 3.05Å; F1384-S1387 PolarHBondContact O-N 3.21Å; S1387-C1823 PolarHBondContact OG-SG 3.36Å
1388	L	90.7	Very high	76	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-91.9	-49.9	-177.4	-179.6	59.7	0	0	0	112.5	I1327 K1331 I1332 A1335 F1384 A1385 M1386 A1655 F1707	I1327-L1388 HydrophobicContact CD1-CD1 4.35Å; I1327-L1388 WeakPolarHBondContact CD1-O 3.35Å; I1327-L1388 HydrophobicContact CG2-CD1 3.98Å; K1331-L1388 WeakPolarHBondContact CE-O 3.48Å; K1331-L1388 PolarHBondContact NZ-O 3.03Å; I1332-L1388 HydrophobicContact CG1-CD1 3.75Å; A1335-L1388 HydrophobicContact CB-CB 3.95Å; F1384-L1388 HydrophobicContact CE1-CD2 3.84Å; F1384-L1388 HydrophobicContact CZ-CD2 3.94Å; F1384-L1388 VanDerWaalsContact O-CB 3.32Å; F1384-L1388 WeakPolarHBondContact O-CB 3.48Å; F1384-L1388 PolarHBondContact O-N 3.44Å; A1385-L1388 PolarHBondContact O-N 2.76Å; M1386-L1388 PolarHBondContact O-N 2.79Å; L1388-A1655 HydrophobicContact CD2-CB 3.57Å; L1388-F1707 HydrophobicContact CD1-CE1 4.02Å; L1388-F1707 HydrophobicContact CD1-CZ 4.01Å; L1388-F1707 HydrophobicContact CD2-CE1 3.98Å; L1388-F1707 HydrophobicContact CD2-CZ 3.76Å; L1388-F1707 HydrophobicContact CG-CE1 4.3Å; L1388-F1707 HydrophobicContact CG-CZ 3.91Å
1389	L	89.8	Confident	74	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-101.7	-15.2	-170.8	-57.2	-179.1	0	0	0	113.5	I1327 A1385 D1391 L1392 I1393 L1465 M1470 I1473 L1703 F1707	I1327-L1389 HydrophobicContact CD1-CD2 4.22Å; A1385-L1389 WeakPolarHBondContact O-CB 3.31Å; A1385-L1389 PolarHBondContact O-N 3.31Å; L1389-D1391 PolarHBondContact O-N 2.71Å; L1389-L1392 WeakPolarHBondContact O-CA 3.27Å; L1389-L1392 WeakPolarHBondContact O-CB 3.45Å; L1389-L1392 PolarHBondContact O-N 2.55Å; L1389-I1393 PolarHBondContact O-N 3.32Å; L1389-L1465 HydrophobicContact CB-CD1 4.05Å; L1389-L1465 HydrophobicContact CD1-CD1 4.22Å; L1389-L1465 HydrophobicContact CD2-CD1 4.36Å; L1389-L1465 HydrophobicContact CG-CD1 4.44Å; L1389-M1470 HydrophobicContact CB-SD 4.25Å; L1389-M1470 HydrophobicContact CD1-SD 4.15Å; L1389-I1473 HydrophobicContact CD1-CD1 4.02Å; L1389-L1703 HydrophobicContact CD2-CD1 4.48Å; L1389-L1703 HydrophobicContact CD2-CD2 4.08Å; L1389-F1707 HydrophobicContact CD2-CE2 3.85Å; L1389-F1707 HydrophobicContact CD2-CZ 3.93Å
1390	G	84.6	Confident	71.8	Confident	14 Å²	14	48.5 Å²	48.5	14%	0.144	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-52.8	-48.2	-175.1	0	0	0	0	0	113.9	M1386 L1392 I1393	M1386-G1390 VanDerWaalsContact O-CA 3.26Å; M1386-G1390 WeakPolarHBondContact O-CA 3.38Å; M1386-G1390 PolarHBondContact O-N 3.42Å; G1390-L1392 PolarHBondContact O-N 3.33Å; G1390-L1392 VanDerWaalsContact O-N 3.09Å; G1390-I1393 WeakPolarHBondContact O-CB 3.24Å; G1390-I1393 PolarHBondContact O-N 3.02Å
1391	D	80.3	Confident	69.5	Low	122 Å²	122	49.7 Å²	49.7	65%	0.652	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-70.8	0.3	177	-25.8	-41.7	0	0	0	114.5	K1331 L1389	K1331-D1391 WeakPolarHBondContact CE-OD2 3.18Å; K1331-D1391 IonicContact NZ-OD2 3.6Å; K1331-D1391 PolarHBondContact NZ-OD2 2.94Å; L1389-D1391 PolarHBondContact O-N 2.71Å
1392	L	82.1	Confident	66.9	Low	6 Å²	6	57.5 Å²	57.5	3%	0.031	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-100.1	-5.6	167.4	-60.7	-172.2	0	0	0	112.6	I1325 P1326 I1327 L1389 G1390 Y1464 L1465 L1703	I1325-L1392 HydrophobicContact CG2-CD1 3.7Å; I1325-L1392 HydrophobicContact CG2-CD2 4.04Å; P1326-L1392 HydrophobicContact CG-CD2 3.84Å; I1327-L1392 HydrophobicContact CD1-CD1 3.52Å; I1327-L1392 HydrophobicContact CD1-CG 4.03Å; I1327-L1392 HydrophobicContact CG1-CD1 4.16Å; I1327-L1392 HydrophobicContact CG1-CD2 4.49Å; I1327-L1392 HydrophobicContact CG1-CG 4.42Å; L1389-L1392 WeakPolarHBondContact O-CA 3.27Å; L1389-L1392 WeakPolarHBondContact O-CB 3.45Å; L1389-L1392 PolarHBondContact O-N 2.55Å; G1390-L1392 PolarHBondContact O-N 3.33Å; G1390-L1392 VanDerWaalsContact O-N 3.09Å; L1392-Y1464 WeakPolarHBondContact O-CB 3.11Å; L1392-Y1464 WeakPolarHBondContact O-CD1 3.42Å; L1392-L1465 HydrophobicContact CB-CD1 4.31Å; L1392-L1465 PolarHBondContact O-N 3.41Å; L1392-L1703 HydrophobicContact CD1-CD1 3.72Å
1393	I	81.2	Confident	64.3	Low	15 Å²	15	60.3 Å²	60.3	8%	0.077	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-82	128.8	177	-57.6	175	0	0	0	108.3	M1386 L1389 G1390 D1395 L1465 W1467 M1470	M1386-I1393 HydrophobicContact CE-CD1 3.96Å; M1386-I1393 HydrophobicContact SD-CD1 4.28Å; L1389-I1393 PolarHBondContact O-N 3.32Å; G1390-I1393 WeakPolarHBondContact O-CB 3.24Å; G1390-I1393 PolarHBondContact O-N 3.02Å; I1393-D1395 PolarHBondContact O-N 2.86Å; I1393-L1465 VanDerWaalsContact CA-O 3.3Å; I1393-L1465 WeakPolarHBondContact CA-O 3.36Å; I1393-L1465 HydrophobicContact CG1-CB 4.33Å; I1393-W1467 HydrophobicContact CG2-CD2 4.11Å; I1393-W1467 HydrophobicContact CG2-CG 3.89Å; I1393-M1470 HydrophobicContact CD1-CB 4Å; I1393-M1470 HydrophobicContact CD1-CG 3.84Å; I1393-M1470 HydrophobicContact CD1-SD 4.18Å
1394	Q	65.4	Low	61.6	Low	74 Å²	74	64.8 Å²	64.8	35%	0.346	34%	0.342	S	S	.	.			trans	-70.8	117.5	164.5	-83.2	170.7	-8.2	0	0	108.8	D1396 Y1464 L1465	Q1394-D1396 PolarHBondContact O-N 3.08Å; Q1394-Y1464 HydrophobicContact CG-CD2 4.41Å; Q1394-Y1464 HydrophobicContact CG-CG 3.97Å; Q1394-L1465 PolarHBondContact N-O 3.18Å
1395	D	53.5	Low	58.6	Low	105 Å²	105	72.5 Å²	72.5	56%	0.561	38%	0.384	S	S	*	.			trans	-75.5	73.9	168.9	-85.9	-28.8	0	0	0	108.8	I1393 D1397 W1467 K1820	I1393-D1395 PolarHBondContact O-N 2.86Å; D1395-D1397 PolarHBondContact O-N 3.06Å; D1395-W1467 PolarHBondContact OD1-NE1 2.95Å; D1395-K1820 IonicContact OD1-NZ 2.78Å; D1395-K1820 PolarHBondContact OD1-NZ 3.13Å; D1395-K1820 IonicContact OD2-NZ 3.8Å; D1395-K1820 PolarHBondContact OD2-NZ 3.15Å
1396	D	42.9	Very low	55.5	Low	87 Å²	87	77.4 Å²	77.4	47%	0.465	42%	0.417	S	S	.	.			trans	-65.3	120.3	172.2	-72.9	-46.1	0	0	0	110.3	Q1394 Y1398	Q1394-D1396 PolarHBondContact O-N 3.08Å; D1396-Y1398 PolarHBondContact O-N 3.11Å
1397	D	37.8	Very low	52.5	Low	137 Å²	137	85.9 Å²	85.9	73%	0.733	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	11.5	-179.7	-92.9	-40.3	0	0	0	115	D1395 T1400	D1395-D1397 PolarHBondContact O-N 3.06Å; D1397-T1400 PolarHBondContact O-OG1 2.85Å
1398	Y	36.4	Very low	49.6	Very low	214 Å²	214	91.2 Å²	91.2	84%	0.839	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-8.5	-171.1	-76.9	-82.7	0	0	0	116.1	D1396	D1396-Y1398 PolarHBondContact O-N 3.11Å
1399	K	37	Very low	46.5	Very low	98 Å²	98	98.7 Å²	98.7	43%	0.426	53%	0.533	S	S	.	.	S	Bend	trans	-104.4	0.4	171	-95	-170.7	175.5	-176	0	115.6	G1401 D1468	K1399-G1401 PolarHBondContact O-N 3.17Å; K1399-D1468 IonicContact NZ-OD1 3.67Å; K1399-D1468 PolarHBondContact NZ-OD1 3.36Å; K1399-D1468 IonicContact NZ-OD2 3.67Å; K1399-D1468 PolarHBondContact NZ-OD2 3.4Å
1400	T	32.7	Very low	43.4	Very low	89 Å²	89	104.8 Å²	104.8	55%	0.546	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.4	-14.9	170.6	49.2	0	0	0	0	113.8	D1397 Y1402	D1397-T1400 PolarHBondContact O-OG1 2.85Å; T1400-Y1402 PolarHBondContact O-N 3.13Å
1401	G	29	Very low	40.6	Very low	58 Å²	58	110.6 Å²	110.6	60%	0.598	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-34	179.9	0	0	0	0	0	115.3	K1399	K1399-G1401 PolarHBondContact O-N 3.17Å
1402	Y	32.3	Very low	38.1	Very low	163 Å²	163	112.3 Å²	112.3	64%	0.639	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-27.3	-174.8	-77.3	-87.8	0	0	0	113.9	T1400 S1404	T1400-Y1402 PolarHBondContact O-N 3.13Å; Y1402-S1404 VanDerWaalsContact C-N 3.31Å; Y1402-S1404 PolarHBondContact O-N 3.06Å
1403	L	32.1	Very low	35.6	Very low	59 Å²	59	118.3 Å²	118.3	31%	0.309	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-81.8	-5.3	178.1	-75.5	167.6	0	0	0	114.1	N1405 L1813	L1403-N1405 VanDerWaalsContact C-N 3.28Å; L1403-N1405 PolarHBondContact O-N 3.45Å; L1403-L1813 HydrophobicContact CD1-CD2 4.04Å; L1403-L1813 HydrophobicContact CG-CD2 4.43Å
1404	S	29.2	Very low	33.1	Very low	98 Å²	98	125.4 Å²	125.4	69%	0.685	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-73.4	-14.4	-177.7	-160	0	0	0	0	114.3	Y1402 C1406	Y1402-S1404 VanDerWaalsContact C-N 3.31Å; Y1402-S1404 PolarHBondContact O-N 3.06Å; S1404-C1406 PolarHBondContact O-N 3.2Å
1405	N	26.4	Very low	31.3	Very low	162 Å²	162	129.3 Å²	129.3	87%	0.866	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-88.9	8.5	-172.3	-110.9	7.2	0	0	0	115.4	L1403	L1403-N1405 VanDerWaalsContact C-N 3.28Å; L1403-N1405 PolarHBondContact O-N 3.45Å
1406	C	25.1	Very low	30	Very low	102 Å²	102	132.6 Å²	132.6	69%	0.689	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-112.1	20	-172.5	-70.9	0	0	0	0	115.8	S1404	S1404-C1406 PolarHBondContact O-N 3.2Å
1407	H	26.2	Very low	29.3	Very low	185 Å²	185	136.4 Å²	136.4	86%	0.856	71%	0.711	S	S	*	*	S	Bend	trans	-165.3	81	162.9	-113.4	78.5	0	0	0	114.6
1408	S	27	Very low	28.8	Very low	127 Å²	127	134 Å²	134	89%	0.888	71%	0.709	S	S	*	*			trans	-174.8	109	148.6	-86.6	0	0	0	0	112.1
1409	N	24.8	Very low	28.2	Very low	157 Å²	157	130.1 Å²	130.1	84%	0.84	70%	0.703	S	S	*	*			trans	-81.1	137.8	173.1	-99.3	-38.4	0	0	0	111.8
1410	N	26.3	Very low	27.8	Very low	128 Å²	128	132 Å²	132	68%	0.684	71%	0.714	S	S	*	*			trans	48.9	100.6	153.3	-70.9	-43.6	0	0	0	119.8
1411	N	25.6	Very low	27.5	Very low	136 Å²	136	135.8 Å²	135.8	73%	0.727	72%	0.722	S	S	*	*				82.2	137.6	128.9	-61.7	-37	0	0	0	122.2
1412	H	28.1	Very low	27.2	Very low	159 Å²	159	140.1 Å²	140.1	74%	0.736	73%	0.73	S	S	*	*			trans	88.1	118.9	148.8	-84.4	-61.2	0	0	0	122
1413	H	29.8	Very low	26.8	Very low	131 Å²	131	139 Å²	139	61%	0.606	74%	0.735	S	S	*	*			trans	67.4	112.8	153.1	-69.2	-72.1	0	0	0	120.4
1414	Q	26.8	Very low	26.7	Very low	165 Å²	165	145 Å²	145	77%	0.771	76%	0.762	S	S	*	*				36.1	129.4	112	-62.4	169	-26.2	0	0	116.9
1415	N	28.3	Very low	26.5	Very low	155 Å²	155	144.9 Å²	144.9	83%	0.829	76%	0.761	S	S	*	*			cis	-156.3	162.8	28.8	-161.2	4.4	0	0	0	112.2
1416	K	26.8	Very low	26.4	Very low	175 Å²	175	144.7 Å²	144.7	76%	0.761	76%	0.76	S	S	*	*			trans	-75.1	138.5	170.6	-68.3	-177.2	178.6	-178.7	0	110.7
1417	N	28.2	Very low	26.5	Very low	167 Å²	167	148 Å²	148	89%	0.893	77%	0.767	S	S	*	*				-174.7	146.6	112.7	-90.8	-19.4	0	0	0	111.3
1418	A	26.1	Very low	26.5	Very low	85 Å²	85	145.7 Å²	145.7	70%	0.702	76%	0.761	S	S	*	*			trans	-112.7	143.2	177.9	0	0	0	0	0	111
1419	N	24.8	Very low	26.4	Very low	133 Å²	133	148.5 Å²	148.5	71%	0.711	76%	0.76	S	S	*	*				-176.5	123.9	126	-101	-49.5	0	0	0	112.4
1420	Q	27.5	Very low	26.6	Very low	139 Å²	139	151.6 Å²	151.6	65%	0.65	76%	0.762	S	S	*	*			trans	55.9	140.8	133.8	-62.8	-174	59.4	0	0	119.8
1421	K	26.6	Very low	26.7	Very low	167 Å²	167	152.9 Å²	152.9	73%	0.726	76%	0.762	S	S	*	*			cis	-167.4	-171.3	1.4	-125.7	174.3	-172	154.7	0	109.1
1422	I	24.2	Very low	26.8	Very low	149 Å²	149	151.4 Å²	151.4	76%	0.764	75%	0.754	S	S	*	*			trans	76.5	125.4	168.9	-51.3	-178.4	0	0	0	112.6
1423	N	23.8	Very low	26.8	Very low	139 Å²	139	151.9 Å²	151.9	74%	0.743	76%	0.757	S	S	*	*			cis	-154.8	145	-10.3	-113.1	6.3	0	0	0	108.1
1424	E	29.8	Very low	26.8	Very low	187 Å²	187	152 Å²	152	87%	0.874	76%	0.761	S	S	*	*				-164.8	155.2	121.7	-114.9	173.6	-156	0	0	110.9
1425	S	23.5	Very low	27	Very low	95 Å²	95	148.8 Å²	148.8	66%	0.664	75%	0.749	S	S	*	*			trans	-139.6	121.6	-167.4	54.5	0	0	0	0	110.8
1426	N	25.3	Very low	26.9	Very low	158 Å²	158	148.3 Å²	148.3	85%	0.845	74%	0.742	S	S	*	*			trans	167.8	79.9	142.8	-86.5	-9.3	0	0	0	111.8
1427	M	26.2	Very low	27.1	Very low	170 Å²	170	145 Å²	145	84%	0.837	74%	0.736	S	S	*	*	S	Bend	trans	-150.4	9.9	161.9	-94.9	-50.7	-178.8	0	0	114.8
1428	N	26.2	Very low	27.2	Very low	138 Å²	138	144.9 Å²	144.9	74%	0.738	73%	0.73	S	S	*	*			trans	-101.3	12.3	-172	-87.5	8	0	0	0	115.7
1429	E	26	Very low	27.1	Very low	185 Å²	185	143.7 Å²	143.7	86%	0.864	73%	0.726	S	S	*	*	S	Bend	trans	-102.3	-1.9	-177.4	-148.5	160.2	-138.5	0	0	113.9
1430	Y	27.7	Very low	27.3	Very low	222 Å²	222	143.7 Å²	143.7	87%	0.871	72%	0.724	S	S	*	*	S	Bend	trans	-103.2	-7	175.2	-120.4	-93.6	0	0	0	114.8
1431	F	29.7	Very low	27.3	Very low	155 Å²	155	146.2 Å²	146.2	68%	0.68	73%	0.733	S	S	*	*	S	Bend	trans	-99.5	-9.3	-179.4	-102	-86.3	0	0	0	114.6
1432	N	28	Very low	27.3	Very low	106 Å²	106	146 Å²	146	57%	0.567	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-7.5	-173.2	-85.7	-25.1	0	0	0	115.9
1433	E	28.2	Very low	27.3	Very low	169 Å²	169	146.4 Å²	146.4	79%	0.79	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-24.5	169.7	-69.5	-156.4	134.6	0	0	113.1
1434	L	29.6	Very low	27.6	Very low	133 Å²	133	147.4 Å²	147.4	70%	0.696	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-30.2	178.3	-96.4	158.2	0	0	0	113.4	Q1436 V1437	L1434-Q1436 PolarHBondContact O-N 3.48Å; L1434-V1437 PolarHBondContact O-N 3.14Å
1435	N	29.7	Very low	27.7	Very low	98 Å²	98	143.7 Å²	143.7	52%	0.524	74%	0.736	S	S	.	*	G	3₁₀ helix	trans	-71.8	-9.6	179.1	-77.6	-28.7	0	0	0	114.5	V1437 H1438	N1435-V1437 PolarHBondContact O-N 3.46Å; N1435-H1438 PolarHBondContact O-N 3.07Å
1436	Q	27.7	Very low	27.8	Very low	145 Å²	145	147.8 Å²	147.8	68%	0.678	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-73.1	-10.5	174	-67.8	-173	39.9	0	0	113.7	L1434	L1434-Q1436 PolarHBondContact O-N 3.48Å
1437	V	30.8	Very low	27.7	Very low	106 Å²	106	149 Å²	149	64%	0.642	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-78.1	-21.7	172.6	-176	0	0	0	0	112	L1434 N1435 G1439	L1434-V1437 PolarHBondContact O-N 3.14Å; N1435-V1437 PolarHBondContact O-N 3.46Å; V1437-G1439 VanDerWaalsContact C-N 3.25Å; V1437-G1439 PolarHBondContact O-N 3.01Å
1438	H	29.1	Very low	27.7	Very low	163 Å²	163	148 Å²	148	76%	0.755	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-78	-5.2	175.3	-113.2	86.4	0	0	0	113.8	N1435	N1435-H1438 PolarHBondContact O-N 3.07Å
1439	G	24.7	Very low	27.8	Very low	60 Å²	60	151 Å²	151	62%	0.619	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-97.4	8.3	-173.8	0	0	0	0	0	116.5	V1437	V1437-G1439 VanDerWaalsContact C-N 3.25Å; V1437-G1439 PolarHBondContact O-N 3.01Å
1440	I	28.5	Very low	27.8	Very low	134 Å²	134	150.6 Å²	150.6	69%	0.687	75%	0.751	S	S	*	*	S	Bend	trans	-107.6	3.4	-168.6	-54.4	-179.2	0	0	0	112.8
1441	F	28.5	Very low	27.8	Very low	191 Å²	191	146.4 Å²	146.4	84%	0.838	74%	0.743	S	S	*	*	S	Bend	trans	-119.2	29.6	178.3	-77.5	-75.9	0	0	0	114.1
1442	Q	26.7	Very low	27.6	Very low	162 Å²	162	146.1 Å²	146.1	76%	0.757	75%	0.749	S	S	*	*			trans	-135.4	142.8	167.9	-67.2	-173.2	-4	0	0	110.4
1443	N	24.6	Very low	27.8	Very low	158 Å²	158	148.5 Å²	148.5	85%	0.845	76%	0.76	S	S	*	*			trans	69	125.6	-165.6	-36.3	-66.3	0	0	0	111.4
1444	D	28.9	Very low	27.6	Very low	160 Å²	160	147.1 Å²	147.1	86%	0.856	76%	0.758	S	S	*	*			cis	-133.7	172.9	42.3	-105.4	-15.6	0	0	0	114.8
1445	P	31.2	Very low	27.4	Very low	109 Å²	109	150.2 Å²	150.2	71%	0.708	77%	0.768	S	S	*	*			trans	-101.1	146	-157.8	37	-35.4	0	0	0	116.2
1446	M	25.9	Very low	27.2	Very low	182 Å²	182	149.9 Å²	149.9	90%	0.897	78%	0.78	S	S	*	*			trans	-131.7	117.3	138.3	-78.8	-169.6	68.5	0	0	109.2
1447	K	24.7	Very low	27.1	Very low	183 Å²	183	152.3 Å²	152.3	80%	0.796	79%	0.788	S	S	*	*			trans	-93.9	173.3	149.9	-73.4	-169.2	172.3	-168	0	107.9
1448	D	25.4	Very low	26.9	Very low	149 Å²	149	153.9 Å²	153.9	80%	0.797	79%	0.793	S	S	*	*			trans	86.3	67	170.9	-48	-11.5	0	0	0	115
1449	E	28.7	Very low	27	Very low	202 Å²	202	151.6 Å²	151.6	94%	0.944	79%	0.786	S	S	*	*				-167.1	125.7	115.2	-102.4	172.7	-169.6	0	0	110
1450	E	26.5	Very low	27.4	Very low	175 Å²	175	153.9 Å²	153.9	82%	0.818	79%	0.789	S	S	*	*			trans	-103.9	158.6	179.9	-70.7	-176	144.4	0	0	111.9
1451	N	25.9	Very low	28.1	Very low	135 Å²	135	153.7 Å²	153.7	72%	0.722	79%	0.789	S	S	*	*			trans	79.9	86.4	165	-45.8	-75.4	0	0	0	117.4
1452	N	26.8	Very low	29.5	Very low	149 Å²	149	147 Å²	147	80%	0.797	76%	0.762	S	S	*	*				-172.9	150.6	98.7	-103.5	-69.9	0	0	0	114.5
1453	I	31.8	Very low	30.9	Very low	155 Å²	155	142.2 Å²	142.2	80%	0.795	74%	0.741	S	S	*	*			trans	68.4	104.2	163.5	-59.5	158.7	0	0	0	116.3
1454	D	24.6	Very low	33.2	Very low	141 Å²	141	139 Å²	139	75%	0.754	72%	0.718	S	S	*	*			trans	-67.6	174.8	162.4	-68.7	-74.5	0	0	0	113
1455	H	25.4	Very low	35.8	Very low	197 Å²	197	131.6 Å²	131.6	91%	0.912	68%	0.678	S	S	*	*	S	Bend	trans	84	48.5	-177.8	-56.1	-81.2	0	0	0	117.5
1456	A	25.4	Very low	38.3	Very low	92 Å²	92	127.8 Å²	127.8	76%	0.76	65%	0.653	S	S	*	*			trans	-149.5	11.1	166.6	0	0	0	0	0	116.8
1457	F	24.5	Very low	41.1	Very low	196 Å²	196	120.5 Å²	120.5	86%	0.86	62%	0.616	S	S	*	*			trans	-118.5	108.3	-169.6	-80.9	-88	0	0	0	114.2
1458	N	27.7	Very low	43.8	Very low	139 Å²	139	115.5 Å²	115.5	74%	0.743	60%	0.597	S	S	*	*			trans	-179.6	-11.9	135.3	-97	-17.9	0	0	0	116.6	T1460	N1458-T1460 PolarHBondContact O-N 2.83Å
1459	D	30.5	Very low	46.7	Very low	114 Å²	114	108.5 Å²	108.5	61%	0.61	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-2.3	-168.4	-80.6	-30.2	0	0	0	118.2	H1695	D1459-H1695 IonicContact OD1-CE1 2.87Å; D1459-H1695 PolarHBondContact OD1-CE1 2.81Å
1460	T	33.3	Very low	49.4	Very low	109 Å²	109	98.9 Å²	98.9	67%	0.669	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-14.3	-170.5	47.1	0	0	0	0	115.8	N1458	N1458-T1460 PolarHBondContact O-N 2.83Å
1461	N	43.9	Very low	52.2	Low	129 Å²	129	91.3 Å²	91.3	69%	0.69	48%	0.48	S	S	*	.			trans	-106.4	-8.1	-168.4	-76.8	-25.8	0	0	0	116	L1463	N1461-L1463 PolarHBondContact O-N 3.06Å
1462	D	56.8	Low	55.1	Low	50 Å²	50	86 Å²	86	27%	0.267	45%	0.45	S	S	.	.			trans	-79	87.3	-173.1	-161.2	28.7	0	0	0	112	R1699 R1702	D1462-R1699 WeakPolarHBondContact OD2-CD 3.1Å; D1462-R1699 IonicContact OD2-CZ 2.69Å; D1462-R1699 IonicContact OD2-NE 3.37Å; D1462-R1699 IonicContact OD2-NH1 3.88Å; D1462-R1699 PolarHBondContact OD2-NH1 3.29Å; D1462-R1702 PolarHBondContact O-NH1 3.35Å
1463	L	56.7	Low	58	Low	62 Å²	62	78.9 Å²	78.9	33%	0.325	41%	0.412	S	S	.	.			trans	-99.4	-21.3	-171.9	-105.1	72.9	0	0	0	114.6	I1323 N1461	I1323-L1463 HydrophobicContact CD1-CD1 3.84Å; I1323-L1463 HydrophobicContact CG1-CD1 4.07Å; I1323-L1463 HydrophobicContact CG2-CD1 3.89Å; I1323-L1463 HydrophobicContact CG2-CD2 3.94Å; I1323-L1463 HydrophobicContact CG2-CG 3.61Å; N1461-L1463 PolarHBondContact O-N 3.06Å
1464	Y	71.7	Confident	60.6	Low	90 Å²	90	71.5 Å²	71.5	35%	0.353	37%	0.374	S	S	.	.	S	Bend	trans	-107.3	158.1	-166.2	-69.1	-89.4	0	0	0	110.7	L1392 Q1394 R1699	L1392-Y1464 WeakPolarHBondContact O-CB 3.11Å; L1392-Y1464 WeakPolarHBondContact O-CD1 3.42Å; Q1394-Y1464 HydrophobicContact CG-CD2 4.41Å; Q1394-Y1464 HydrophobicContact CG-CG 3.97Å; Y1464-R1699 WeakPolarHBondContact O-CD 3.3Å
1465	L	83.4	Confident	63.3	Low	5 Å²	5	69.1 Å²	69.1	3%	0.026	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-79.6	148.1	170.4	-69.2	167.4	0	0	0	109.6	L1389 L1392 I1393 Q1394 D1469 L1700 L1703	L1389-L1465 HydrophobicContact CB-CD1 4.05Å; L1389-L1465 HydrophobicContact CD1-CD1 4.22Å; L1389-L1465 HydrophobicContact CD2-CD1 4.36Å; L1389-L1465 HydrophobicContact CG-CD1 4.44Å; L1392-L1465 HydrophobicContact CB-CD1 4.31Å; L1392-L1465 PolarHBondContact O-N 3.41Å; I1393-L1465 VanDerWaalsContact CA-O 3.3Å; I1393-L1465 WeakPolarHBondContact CA-O 3.36Å; I1393-L1465 HydrophobicContact CG1-CB 4.33Å; Q1394-L1465 PolarHBondContact N-O 3.18Å; L1465-D1469 HydrophobicContact CB-CB 4.47Å; L1465-D1469 HydrophobicContact CD2-CB 3.83Å; L1465-L1700 HydrophobicContact CD2-CD2 4.25Å; L1465-L1703 HydrophobicContact CD1-CD2 3.97Å; L1465-L1703 HydrophobicContact CD2-CD2 4.19Å; L1465-L1703 HydrophobicContact CG-CD2 4.45Å
1466	T	85.1	Confident	66	Low	29 Å²	29	61.6 Å²	61.6	18%	0.178	32%	0.323	C	S	.	.			trans	-90	163.1	165.1	62.4	0	0	0	0	110.3	D1468 D1469 M1470	T1466-D1468 PolarHBondContact O-N 2.73Å; T1466-D1468 PolarHBondContact OG1-N 3.21Å; T1466-D1469 PolarHBondContact N-OD2 3.23Å; T1466-D1469 PolarHBondContact O-N 3.01Å; T1466-D1469 PolarHBondContact OG1-N 3.2Å; T1466-D1469 PolarHBondContact OG1-OD2 2.73Å; T1466-M1470 PolarHBondContact O-N 2.84Å
1467	W	83.7	Confident	68.9	Low	30 Å²	30	58.1 Å²	58.1	11%	0.114	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-27.6	167.9	-88.7	102.9	0	0	0	112.7	M1386 I1393 D1395 M1470 L1471 L1813 L1816 K1820	M1386-W1467 HydrophobicContact CE-CH2 3.87Å; M1386-W1467 HydrophobicContact CE-CZ2 4.49Å; M1386-W1467 HydrophobicContact CE-CZ3 4.44Å; M1386-W1467 HydrophobicContact SD-CH2 4.37Å; M1386-W1467 HydrophobicContact SD-CZ3 4.41Å; I1393-W1467 HydrophobicContact CG2-CD2 4.11Å; I1393-W1467 HydrophobicContact CG2-CG 3.89Å; D1395-W1467 PolarHBondContact OD1-NE1 2.95Å; W1467-M1470 PolarHBondContact O-N 3.12Å; W1467-L1471 PolarHBondContact O-N 3.5Å; W1467-L1813 HydrophobicContact CE3-CD1 3.94Å; W1467-L1813 HydrophobicContact CZ3-CD1 4.14Å; W1467-L1816 HydrophobicContact CZ3-CB 4.12Å; W1467-K1820 HydrophobicContact CH2-CD 4.07Å; W1467-K1820 HydrophobicContact CZ2-CD 3.85Å
1468	D	81.3	Confident	71.9	Confident	77 Å²	77	48.8 Å²	48.8	41%	0.412	25%	0.25	S	C	.	.	H	α-helix	trans	-76.5	-32.9	178.7	-65.2	-16.1	0	0	0	112.3	K1399 T1466 M1470 W1472	K1399-D1468 IonicContact NZ-OD1 3.67Å; K1399-D1468 PolarHBondContact NZ-OD1 3.36Å; K1399-D1468 IonicContact NZ-OD2 3.67Å; K1399-D1468 PolarHBondContact NZ-OD2 3.4Å; T1466-D1468 PolarHBondContact O-N 2.73Å; T1466-D1468 PolarHBondContact OG1-N 3.21Å; D1468-M1470 VanDerWaalsContact C-N 3.31Å; D1468-W1472 WeakPolarHBondContact O-CB 3.21Å; D1468-W1472 PolarHBondContact O-N 3.27Å
1469	D	86.2	Confident	74.4	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-40.8	167.4	-57.6	-42.4	0	0	0	110.6	L1465 T1466 W1472 I1473 R1696 R1699	L1465-D1469 HydrophobicContact CB-CB 4.47Å; L1465-D1469 HydrophobicContact CD2-CB 3.83Å; T1466-D1469 PolarHBondContact N-OD2 3.23Å; T1466-D1469 PolarHBondContact O-N 3.01Å; T1466-D1469 PolarHBondContact OG1-N 3.2Å; T1466-D1469 PolarHBondContact OG1-OD2 2.73Å; D1469-W1472 PolarHBondContact O-N 3.24Å; D1469-I1473 VanDerWaalsContact O-CG1 3.28Å; D1469-I1473 WeakPolarHBondContact O-CG1 3.46Å; D1469-I1473 PolarHBondContact O-N 3.46Å; D1469-R1696 WeakPolarHBondContact OD1-CB 3.49Å; D1469-R1696 VanDerWaalsContact OD1-CG 3.3Å; D1469-R1696 WeakPolarHBondContact OD1-CG 3.24Å; D1469-R1699 VanDerWaalsContact CG-NH2 3.33Å; D1469-R1699 IonicContact OD1-CZ 3.3Å; D1469-R1699 IonicContact OD1-NE 3.06Å; D1469-R1699 IonicContact OD1-NH2 3.1Å; D1469-R1699 PolarHBondContact OD1-NH2 2.77Å; D1469-R1699 IonicContact OD2-CZ 2.69Å; D1469-R1699 VanDerWaalsContact OD2-CZ 3.3Å; D1469-R1699 IonicContact OD2-NE 3.46Å; D1469-R1699 PolarHBondContact OD2-NE 3.14Å; D1469-R1699 IonicContact OD2-NH2 3.37Å; D1469-R1699 PolarHBondContact OD2-NH2 2.98Å; D1469-R1699 VanDerWaalsContact OD2-NH2 3.1Å
1470	M	86.8	Confident	76.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-68.3	-40.9	179.9	-165	68.2	-168.7	0	0	112.3	A1385 M1386 L1389 I1393 T1466 W1467 D1468 W1472 I1473 A1474 F1478 L1816	A1385-M1470 HydrophobicContact CB-CE 3.49Å; A1385-M1470 VanDerWaalsContact CB-CE 3.49Å; M1386-M1470 HydrophobicContact CG-CE 4.45Å; M1386-M1470 HydrophobicContact SD-CE 3.73Å; M1386-M1470 HydrophobicContact SD-CG 4.23Å; L1389-M1470 HydrophobicContact CB-SD 4.25Å; L1389-M1470 HydrophobicContact CD1-SD 4.15Å; I1393-M1470 HydrophobicContact CD1-CB 4Å; I1393-M1470 HydrophobicContact CD1-CG 3.84Å; I1393-M1470 HydrophobicContact CD1-SD 4.18Å; T1466-M1470 PolarHBondContact O-N 2.84Å; W1467-M1470 PolarHBondContact O-N 3.12Å; D1468-M1470 VanDerWaalsContact C-N 3.31Å; M1470-W1472 VanDerWaalsContact C-N 3.35Å; M1470-I1473 PolarHBondContact O-N 3.45Å; M1470-I1473 HydrophobicContact SD-CD1 4.46Å; M1470-A1474 WeakPolarHBondContact O-CB 3.49Å; M1470-A1474 PolarHBondContact O-N 3.25Å; M1470-F1478 HydrophobicContact CE-CZ 4.3Å; M1470-L1816 HydrophobicContact CE-CD2 4.15Å; M1470-L1816 HydrophobicContact CG-CD1 4.31Å; M1470-L1816 HydrophobicContact CG-CD2 4.47Å
1471	L	84.7	Confident	79.3	Confident	16 Å²	16	32.5 Å²	32.5	8%	0.084	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-43.1	169.8	-89.6	159.4	0	0	0	111.5	W1467 A1474 K1475 L1812 L1813 L1816	W1467-L1471 PolarHBondContact O-N 3.5Å; L1471-A1474 PolarHBondContact O-N 3.1Å; L1471-K1475 WeakPolarHBondContact O-CB 3.44Å; L1471-K1475 PolarHBondContact O-N 3.33Å; L1471-L1812 HydrophobicContact CD2-CB 4.3Å; L1471-L1812 HydrophobicContact CD2-CD2 4.19Å; L1471-L1812 HydrophobicContact CD2-CG 4.29Å; L1471-L1813 HydrophobicContact CD1-CD1 4.35Å; L1471-L1813 HydrophobicContact CD2-CB 4.39Å; L1471-L1816 HydrophobicContact CD2-CD1 4.41Å; L1471-L1816 HydrophobicContact CG-CD1 4.41Å
1472	W	86.1	Confident	80.8	Confident	23 Å²	23	26.5 Å²	26.5	9%	0.087	13%	0.127	C	C	.	.	H	α-helix	trans	-65.7	-42.8	177.5	-174.6	89.9	0	0	0	112.4	D1468 D1469 M1470 A1474 K1475 N1476 R1696 L1700	D1468-W1472 WeakPolarHBondContact O-CB 3.21Å; D1468-W1472 PolarHBondContact O-N 3.27Å; D1469-W1472 PolarHBondContact O-N 3.24Å; M1470-W1472 VanDerWaalsContact C-N 3.35Å; W1472-A1474 VanDerWaalsContact C-N 3.32Å; W1472-A1474 PolarHBondContact O-N 3.46Å; W1472-K1475 PolarHBondContact O-N 3.28Å; W1472-N1476 VanDerWaalsContact CD1-ND2 3.31Å; W1472-N1476 HydrophobicContact CD2-CB 4.41Å; W1472-N1476 HydrophobicContact CH2-CB 4.39Å; W1472-N1476 HydrophobicContact CZ2-CB 4.18Å; W1472-N1476 PolarHBondContact NE1-ND2 2.66Å; W1472-N1476 WeakPolarHBondContact O-CB 3.4Å; W1472-N1476 PolarHBondContact O-N 2.85Å; W1472-N1476 PolarHBondContact O-ND2 2.85Å; W1472-R1696 VanDerWaalsContact NE1-CZ 3.29Å; W1472-L1700 HydrophobicContact CE3-CD1 3.68Å; W1472-L1700 HydrophobicContact CH2-CD1 4.33Å; W1472-L1700 HydrophobicContact CZ3-CD1 3.48Å; W1472-L1700 VanDerWaalsContact CZ3-CD1 3.48Å
1473	I	87.7	Confident	81.5	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-57.3	-47.5	171.7	-69.1	165.3	0	0	0	109.8	L1389 D1469 M1470 K1475 N1476 R1477 F1478 L1658 L1700	L1389-I1473 HydrophobicContact CD1-CD1 4.02Å; D1469-I1473 VanDerWaalsContact O-CG1 3.28Å; D1469-I1473 WeakPolarHBondContact O-CG1 3.46Å; D1469-I1473 PolarHBondContact O-N 3.46Å; M1470-I1473 PolarHBondContact O-N 3.45Å; M1470-I1473 HydrophobicContact SD-CD1 4.46Å; I1473-K1475 VanDerWaalsContact C-N 3.32Å; I1473-K1475 PolarHBondContact O-N 3.31Å; I1473-N1476 PolarHBondContact O-N 3.4Å; I1473-R1477 HydrophobicContact CG2-CB 4.24Å; I1473-R1477 WeakPolarHBondContact O-CA 3.14Å; I1473-R1477 WeakPolarHBondContact O-CB 3.35Å; I1473-R1477 PolarHBondContact O-N 3.08Å; I1473-F1478 HydrophobicContact CG2-CD1 4.2Å; I1473-F1478 HydrophobicContact CG2-CE1 3.79Å; I1473-L1658 HydrophobicContact CG2-CB 4.39Å; I1473-L1658 HydrophobicContact CG2-CD2 4.14Å; I1473-L1658 WeakPolarHBondContact CG2-O 3.3Å; I1473-L1700 HydrophobicContact CD1-CD2 3.82Å; I1473-L1700 HydrophobicContact CG1-CD2 4.03Å
1474	A	86.3	Confident	82.4	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.7	-41.3	-178.9	0	0	0	0	0	112.6	M1470 L1471 W1472 F1478 L1812 L1816	M1470-A1474 WeakPolarHBondContact O-CB 3.49Å; M1470-A1474 PolarHBondContact O-N 3.25Å; L1471-A1474 PolarHBondContact O-N 3.1Å; W1472-A1474 VanDerWaalsContact C-N 3.32Å; W1472-A1474 PolarHBondContact O-N 3.46Å; A1474-F1478 HydrophobicContact CB-CD2 3.79Å; A1474-F1478 HydrophobicContact CB-CE1 4.32Å; A1474-F1478 HydrophobicContact CB-CE2 3.46Å; A1474-F1478 VanDerWaalsContact CB-CE2 3.46Å; A1474-F1478 HydrophobicContact CB-CG 4.37Å; A1474-F1478 HydrophobicContact CB-CZ 3.78Å; A1474-F1478 WeakPolarHBondContact O-CB 3.36Å; A1474-L1812 HydrophobicContact CB-CD1 4.25Å; A1474-L1812 HydrophobicContact CB-CD2 3.98Å; A1474-L1812 HydrophobicContact CB-CG 4.18Å; A1474-L1816 HydrophobicContact CB-CD1 4.01Å; A1474-L1816 HydrophobicContact CB-CD2 4.27Å; A1474-L1816 HydrophobicContact CB-CG 4.47Å
1475	K	82.3	Confident	82.5	Confident	90 Å²	90	17.4 Å²	17.4	39%	0.391	9%	0.085	S	C	.	.	H	α-helix	trans	-75.2	-28.2	-179.4	-168.1	171.3	-172.4	171	0	114.1	L1471 W1472 I1473 L1812	L1471-K1475 WeakPolarHBondContact O-CB 3.44Å; L1471-K1475 PolarHBondContact O-N 3.33Å; W1472-K1475 PolarHBondContact O-N 3.28Å; I1473-K1475 VanDerWaalsContact C-N 3.32Å; I1473-K1475 PolarHBondContact O-N 3.31Å; K1475-L1812 HydrophobicContact CB-CD2 4.08Å
1476	N	82.5	Confident	81.6	Confident	39 Å²	39	18.2 Å²	18.2	21%	0.209	9%	0.089	C	C	.	.	H	α-helix	trans	-120.4	-7.2	-169.4	-62.3	-88.2	0	0	0	115.9	W1472 I1473 V1664	W1472-N1476 VanDerWaalsContact CD1-ND2 3.31Å; W1472-N1476 HydrophobicContact CD2-CB 4.41Å; W1472-N1476 HydrophobicContact CH2-CB 4.39Å; W1472-N1476 HydrophobicContact CZ2-CB 4.18Å; W1472-N1476 PolarHBondContact NE1-ND2 2.66Å; W1472-N1476 WeakPolarHBondContact O-CB 3.4Å; W1472-N1476 PolarHBondContact O-N 2.85Å; W1472-N1476 PolarHBondContact O-ND2 2.85Å; I1473-N1476 PolarHBondContact O-N 3.4Å; N1476-V1664 HydrophobicContact CB-CG2 4.3Å
1477	R	85.9	Confident	80.6	Confident	19 Å²	19	17 Å²	17	7%	0.072	8%	0.082	C	C	.	.	H	α-helix	trans	-135.4	-12.4	-174.8	-63.5	-64.3	-178.9	-114.4	1.4	115.9	I1473 D1480 K1657 L1658 D1660 I1662	I1473-R1477 HydrophobicContact CG2-CB 4.24Å; I1473-R1477 WeakPolarHBondContact O-CA 3.14Å; I1473-R1477 WeakPolarHBondContact O-CB 3.35Å; I1473-R1477 PolarHBondContact O-N 3.08Å; R1477-D1480 VanDerWaalsContact CD-OD2 3.23Å; R1477-D1480 WeakPolarHBondContact CD-OD2 3.38Å; R1477-D1480 IonicContact NH1-OD2 2.63Å; R1477-D1480 PolarHBondContact O-N 3.11Å; R1477-K1657 WeakPolarHBondContact CD-O 3.44Å; R1477-L1658 HydrophobicContact CB-CD2 4.43Å; R1477-D1660 VanDerWaalsContact CZ-O 3.32Å; R1477-D1660 PolarHBondContact NE-O 3.42Å; R1477-D1660 PolarHBondContact NH2-O 3.35Å; R1477-I1662 PolarHBondContact NH2-O 2.78Å
1478	F	86.8	Confident	79.5	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-70.6	-34.7	179.2	-75.5	4.8	0	0	0	111.7	L1378 I1381 S1382 A1385 M1470 I1473 A1474 D1480 C1481 L1658 L1816	L1378-F1478 HydrophobicContact CD2-CB 3.42Å; L1378-F1478 VanDerWaalsContact CD2-CB 3.42Å; L1378-F1478 HydrophobicContact CD2-CD2 3.44Å; L1378-F1478 VanDerWaalsContact CD2-CD2 3.44Å; L1378-F1478 HydrophobicContact CD2-CG 3.92Å; I1381-F1478 HydrophobicContact CB-CG 4.41Å; I1381-F1478 VanDerWaalsContact CD1-O 3.25Å; I1381-F1478 WeakPolarHBondContact CD1-O 3.5Å; I1381-F1478 HydrophobicContact CG2-CB 3.9Å; I1381-F1478 HydrophobicContact CG2-CD1 3.56Å; I1381-F1478 HydrophobicContact CG2-CD2 4.09Å; I1381-F1478 HydrophobicContact CG2-CE1 4.02Å; I1381-F1478 HydrophobicContact CG2-CG 3.58Å; I1381-F1478 HydrophobicContact CG2-CZ 4.47Å; S1382-F1478 WeakPolarHBondContact OG-CE2 3.26Å; A1385-F1478 HydrophobicContact CB-CE1 3.68Å; A1385-F1478 HydrophobicContact CB-CZ 3.65Å; M1470-F1478 HydrophobicContact CE-CZ 4.3Å; I1473-F1478 HydrophobicContact CG2-CD1 4.2Å; I1473-F1478 HydrophobicContact CG2-CE1 3.79Å; A1474-F1478 HydrophobicContact CB-CD2 3.79Å; A1474-F1478 HydrophobicContact CB-CE1 4.32Å; A1474-F1478 HydrophobicContact CB-CE2 3.46Å; A1474-F1478 VanDerWaalsContact CB-CE2 3.46Å; A1474-F1478 HydrophobicContact CB-CG 4.37Å; A1474-F1478 HydrophobicContact CB-CZ 3.78Å; A1474-F1478 WeakPolarHBondContact O-CB 3.36Å; F1478-D1480 VanDerWaalsContact C-N 3.27Å; F1478-D1480 PolarHBondContact O-N 3.1Å; F1478-C1481 PolarHBondContact O-N 2.85Å; F1478-C1481 VanDerWaalsContact O-N 3.14Å; F1478-L1658 HydrophobicContact CD1-CD2 3.38Å; F1478-L1658 HydrophobicContact CE1-CD2 3.6Å; F1478-L1816 HydrophobicContact CE2-CD2 3.92Å; F1478-L1816 HydrophobicContact CZ-CD2 3.95Å
1479	T	79.8	Confident	78.2	Confident	8 Å²	8	13 Å²	13	5%	0.049	6%	0.064	C	C	.	.	H	α-helix	trans	-50.9	-45.8	171.6	40.5	0	0	0	0	112.6	C1481 V1482 P1483 L1797	T1479-C1481 PolarHBondContact O-N 3.29Å; T1479-C1481 VanDerWaalsContact O-N 3.16Å; T1479-V1482 WeakPolarHBondContact O-CB 3.25Å; T1479-V1482 WeakPolarHBondContact O-CG2 3.45Å; T1479-V1482 PolarHBondContact O-N 3.07Å; T1479-V1482 VanDerWaalsContact O-N 3.1Å; T1479-P1483 WeakPolarHBondContact O-CD 3.25Å; T1479-L1797 HydrophobicContact CG2-CD1 3.81Å; T1479-L1797 HydrophobicContact CG2-CD2 4.22Å
1480	D	83.1	Confident	76.4	Confident	12 Å²	12	14.2 Å²	14.2	6%	0.064	7%	0.073	C	C	.	.	H	α-helix	trans	-65.9	-20	-175.2	-45.9	-4.9	0	0	0	112.2	R1477 F1478 K1657 D1767	R1477-D1480 VanDerWaalsContact CD-OD2 3.23Å; R1477-D1480 WeakPolarHBondContact CD-OD2 3.38Å; R1477-D1480 IonicContact NH1-OD2 2.63Å; R1477-D1480 PolarHBondContact O-N 3.11Å; F1478-D1480 VanDerWaalsContact C-N 3.27Å; F1478-D1480 PolarHBondContact O-N 3.1Å; D1480-K1657 HydrophobicContact CB-CD 4.15Å; D1480-D1767 HydrophobicContact CB-CB 4.15Å
1481	C	84.2	Confident	74.3	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-93.3	-16.4	179	-65.3	0	0	0	0	113.4	I1381 F1478 T1479 V1484 L1485 M1654 L1658	I1381-C1481 HydrophobicContact CD1-CB 3.96Å; I1381-C1481 HydrophobicContact CG1-CB 4.32Å; I1381-C1481 HydrophobicContact CG2-CB 4.16Å; F1478-C1481 PolarHBondContact O-N 2.85Å; F1478-C1481 VanDerWaalsContact O-N 3.14Å; T1479-C1481 PolarHBondContact O-N 3.29Å; T1479-C1481 VanDerWaalsContact O-N 3.16Å; C1481-V1484 WeakPolarHBondContact O-CB 3.19Å; C1481-V1484 PolarHBondContact O-N 3.43Å; C1481-L1485 PolarHBondContact O-N 3.49Å; C1481-L1485 VanDerWaalsContact O-N 3.08Å; C1481-M1654 HydrophobicContact CB-CE 4.07Å; C1481-M1654 HydrophobicContact CB-CG 4.2Å; C1481-L1658 VanDerWaalsContact SG-CD2 3.6Å
1482	V	76.3	Confident	72.1	Confident	3 Å²	3	19.5 Å²	19.5	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-62.2	-42.6	179.8	-169.6	0	0	0	0	113.2	W1373 L1377 I1381 T1479 V1484 L1485 L1486	W1373-V1482 HydrophobicContact CB-CG1 4.03Å; W1373-V1482 HydrophobicContact CD2-CB 4.31Å; W1373-V1482 HydrophobicContact CD2-CG1 3.49Å; W1373-V1482 VanDerWaalsContact CD2-CG1 3.49Å; W1373-V1482 HydrophobicContact CE3-CB 3.5Å; W1373-V1482 HydrophobicContact CE3-CG1 3.17Å; W1373-V1482 HydrophobicContact CE3-CG2 4.38Å; W1373-V1482 HydrophobicContact CG-CG1 3.86Å; W1373-V1482 HydrophobicContact CZ3-CB 3.98Å; W1373-V1482 HydrophobicContact CZ3-CG1 3.9Å; L1377-V1482 HydrophobicContact CB-CG1 3.74Å; L1377-V1482 HydrophobicContact CD1-CG1 3.36Å; L1377-V1482 HydrophobicContact CG-CG1 4.17Å; I1381-V1482 HydrophobicContact CD1-CB 4.34Å; I1381-V1482 HydrophobicContact CD1-CG2 3.54Å; T1479-V1482 WeakPolarHBondContact O-CB 3.25Å; T1479-V1482 WeakPolarHBondContact O-CG2 3.45Å; T1479-V1482 PolarHBondContact O-N 3.07Å; T1479-V1482 VanDerWaalsContact O-N 3.1Å; V1482-V1484 VanDerWaalsContact C-N 3.32Å; V1482-V1484 PolarHBondContact O-N 2.98Å; V1482-L1485 PolarHBondContact O-N 3.39Å; V1482-L1486 HydrophobicContact CG1-CD1 4.33Å; V1482-L1486 PolarHBondContact O-N 3.27Å; V1482-L1486 VanDerWaalsContact O-N 3.09Å
1483	P	70.5	Confident	69.7	Low	4 Å²	4	21.2 Å²	21.2	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-59.4	-42.2	175.1	-20.6	30.2	0	0	0	112.4	W1373 T1479 L1485 L1486 I1487 Y1635 F1766	W1373-P1483 HydrophobicContact CH2-CG 4.33Å; W1373-P1483 HydrophobicContact CZ3-CG 3.85Å; T1479-P1483 WeakPolarHBondContact O-CD 3.25Å; P1483-L1485 VanDerWaalsContact C-N 3.33Å; P1483-L1485 PolarHBondContact O-N 3.47Å; P1483-L1486 PolarHBondContact O-N 3.49Å; P1483-I1487 VanDerWaalsContact O-CD1 3.29Å; P1483-I1487 WeakPolarHBondContact O-CD1 3.13Å; P1483-I1487 VanDerWaalsContact O-CG1 3.25Å; P1483-I1487 WeakPolarHBondContact O-CG1 3.25Å; P1483-I1487 PolarHBondContact O-N 3.08Å; P1483-I1487 VanDerWaalsContact O-N 3.09Å; P1483-Y1635 HydrophobicContact CB-CD1 4.49Å; P1483-Y1635 HydrophobicContact CB-CE1 4.03Å; P1483-F1766 HydrophobicContact CB-CE1 3.88Å; P1483-F1766 HydrophobicContact CB-CZ 4.45Å; P1483-F1766 HydrophobicContact CG-CD1 4.06Å; P1483-F1766 HydrophobicContact CG-CE1 3.44Å; P1483-F1766 VanDerWaalsContact CG-CE1 3.44Å; P1483-F1766 HydrophobicContact CG-CZ 4.34Å
1484	V	75	Confident	67	Low	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.1	-43.5	179.6	-178	0	0	0	0	110.3	C1481 V1482 I1487 S1488 L1639 L1650 Y1653	C1481-V1484 WeakPolarHBondContact O-CB 3.19Å; C1481-V1484 PolarHBondContact O-N 3.43Å; V1482-V1484 VanDerWaalsContact C-N 3.32Å; V1482-V1484 PolarHBondContact O-N 2.98Å; V1484-I1487 PolarHBondContact O-N 3.3Å; V1484-S1488 PolarHBondContact O-N 2.87Å; V1484-S1488 VanDerWaalsContact O-N 3.11Å; V1484-L1639 HydrophobicContact CB-CD2 4.38Å; V1484-L1639 HydrophobicContact CG1-CD2 4.22Å; V1484-L1639 HydrophobicContact CG2-CD2 4.28Å; V1484-L1650 HydrophobicContact CG1-CD1 3.63Å; V1484-L1650 HydrophobicContact CG1-CG 4.4Å; V1484-Y1653 HydrophobicContact CG1-CD1 4.29Å; V1484-Y1653 HydrophobicContact CG2-CD1 4.13Å; V1484-Y1653 HydrophobicContact CG2-CE1 3.84Å
1485	L	73.7	Confident	64.4	Low	7 Å²	7	34.1 Å²	34.1	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-45.3	177.6	-127.6	166.5	0	0	0	111.8	M1339 W1340 R1380 I1381 C1481 V1482 P1483 I1487 S1488 C1489 M1654	M1339-L1485 HydrophobicContact CE-CD1 4.47Å; M1339-L1485 HydrophobicContact CE-CD2 4Å; M1339-L1485 HydrophobicContact CE-CG 4.12Å; M1339-L1485 HydrophobicContact SD-CD1 4.01Å; M1339-L1485 HydrophobicContact SD-CD2 4.46Å; M1339-L1485 HydrophobicContact SD-CG 4.3Å; W1340-L1485 HydrophobicContact CH2-CD2 4.36Å; W1340-L1485 HydrophobicContact CZ2-CD2 3.93Å; R1380-L1485 HydrophobicContact CB-CD1 4.25Å; I1381-L1485 HydrophobicContact CD1-CD1 4.19Å; I1381-L1485 HydrophobicContact CG1-CD1 3.51Å; C1481-L1485 PolarHBondContact O-N 3.49Å; C1481-L1485 VanDerWaalsContact O-N 3.08Å; V1482-L1485 PolarHBondContact O-N 3.39Å; P1483-L1485 VanDerWaalsContact C-N 3.33Å; P1483-L1485 PolarHBondContact O-N 3.47Å; L1485-I1487 VanDerWaalsContact C-N 3.32Å; L1485-I1487 PolarHBondContact O-N 3.15Å; L1485-S1488 WeakPolarHBondContact O-CB 3.43Å; L1485-S1488 PolarHBondContact O-N 2.77Å; L1485-S1488 VanDerWaalsContact O-N 3.13Å; L1485-S1488 PolarHBondContact O-OG 3.34Å; L1485-C1489 PolarHBondContact O-N 3.3Å; L1485-C1489 PolarHBondContact O-SG 3.36Å; L1485-M1654 HydrophobicContact CD1-CE 4.33Å
1486	L	66.6	Low	61.7	Low	23 Å²	23	33.3 Å²	33.3	12%	0.12	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-36.1	177.7	-75.9	170.5	0	0	0	113.2	W1373 L1377 V1482 P1483 S1488 C1489 S1490 I1571	W1373-L1486 HydrophobicContact CD2-CD1 4.09Å; W1373-L1486 VanDerWaalsContact CE2-CD1 3.4Å; W1373-L1486 HydrophobicContact CE3-CD1 4.5Å; W1373-L1486 HydrophobicContact CH2-CD1 3.78Å; W1373-L1486 HydrophobicContact CZ2-CD1 3.24Å; W1373-L1486 HydrophobicContact CZ3-CD1 4.37Å; L1377-L1486 HydrophobicContact CD1-CD1 4.05Å; L1377-L1486 HydrophobicContact CD1-CD2 3.85Å; L1377-L1486 HydrophobicContact CD1-CG 3.88Å; V1482-L1486 HydrophobicContact CG1-CD1 4.33Å; V1482-L1486 PolarHBondContact O-N 3.27Å; V1482-L1486 VanDerWaalsContact O-N 3.09Å; P1483-L1486 PolarHBondContact O-N 3.49Å; L1486-S1488 VanDerWaalsContact C-N 3.33Å; L1486-C1489 WeakPolarHBondContact O-CB 3.29Å; L1486-C1489 PolarHBondContact O-N 3.39Å; L1486-S1490 PolarHBondContact O-N 3.11Å; L1486-S1490 VanDerWaalsContact O-N 3.16Å; L1486-I1571 HydrophobicContact CB-CD1 3.74Å; L1486-I1571 HydrophobicContact CD2-CD1 3.89Å; L1486-I1571 HydrophobicContact CG-CD1 4.35Å; L1486-I1571 WeakPolarHBondContact O-CD1 2.92Å
1487	I	62.1	Low	59.1	Low	4 Å²	4	39.4 Å²	39.4	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-37.1	174.9	-66.2	158.7	0	0	0	111.2	P1483 V1484 L1485 S1490 S1491 Y1635 I1636 L1639 A1644	P1483-I1487 VanDerWaalsContact O-CD1 3.29Å; P1483-I1487 WeakPolarHBondContact O-CD1 3.13Å; P1483-I1487 VanDerWaalsContact O-CG1 3.25Å; P1483-I1487 WeakPolarHBondContact O-CG1 3.25Å; P1483-I1487 PolarHBondContact O-N 3.08Å; P1483-I1487 VanDerWaalsContact O-N 3.09Å; V1484-I1487 PolarHBondContact O-N 3.3Å; L1485-I1487 VanDerWaalsContact C-N 3.32Å; L1485-I1487 PolarHBondContact O-N 3.15Å; I1487-S1490 WeakPolarHBondContact O-CB 3.47Å; I1487-S1490 PolarHBondContact O-N 2.96Å; I1487-S1491 PolarHBondContact O-N 3.15Å; I1487-S1491 PolarHBondContact O-OG 2.94Å; I1487-Y1635 HydrophobicContact CD1-CD1 3.66Å; I1487-Y1635 HydrophobicContact CD1-CE1 3.67Å; I1487-I1636 HydrophobicContact CD1-CB 4.29Å; I1487-I1636 HydrophobicContact CD1-CG1 3.78Å; I1487-I1636 HydrophobicContact CG1-CB 4.11Å; I1487-I1636 HydrophobicContact CG1-CG1 3.66Å; I1487-I1636 HydrophobicContact CG1-CG2 4.07Å; I1487-L1639 HydrophobicContact CB-CD2 4.01Å; I1487-L1639 HydrophobicContact CD1-CB 4.07Å; I1487-L1639 HydrophobicContact CD1-CD2 3.32Å; I1487-L1639 HydrophobicContact CD1-CG 4.29Å; I1487-L1639 HydrophobicContact CG1-CD2 4.23Å; I1487-L1639 HydrophobicContact CG2-CB 4.47Å; I1487-L1639 HydrophobicContact CG2-CD2 3.95Å; I1487-A1644 HydrophobicContact CG2-CB 4.42Å
1488	S	61.4	Low	56.2	Low	7 Å²	7	44.4 Å²	44.4	5%	0.049	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-39.6	174.9	80.1	0	0	0	0	112.3	W1340 V1484 L1485 L1486 S1490 S1491 F1492	W1340-S1488 VanDerWaalsContact CZ2-OG 3.31Å; W1340-S1488 WeakPolarHBondContact CZ2-OG 3.26Å; V1484-S1488 PolarHBondContact O-N 2.87Å; V1484-S1488 VanDerWaalsContact O-N 3.11Å; L1485-S1488 WeakPolarHBondContact O-CB 3.43Å; L1485-S1488 PolarHBondContact O-N 2.77Å; L1485-S1488 VanDerWaalsContact O-N 3.13Å; L1485-S1488 PolarHBondContact O-OG 3.34Å; L1486-S1488 VanDerWaalsContact C-N 3.33Å; S1488-S1490 PolarHBondContact O-N 3.11Å; S1488-S1491 PolarHBondContact O-N 3.41Å; S1488-F1492 PolarHBondContact O-N 3.38Å
1489	C	54.5	Low	53.7	Low	16 Å²	16	50 Å²	50	11%	0.108	28%	0.277	C	S	.	.	H	α-helix	trans	-56.5	-48.6	173.1	-60.7	0	0	0	0	111.3	L1485 L1486 S1491 F1492 V1493 I1571	L1485-C1489 PolarHBondContact O-N 3.3Å; L1485-C1489 PolarHBondContact O-SG 3.36Å; L1486-C1489 WeakPolarHBondContact O-CB 3.29Å; L1486-C1489 PolarHBondContact O-N 3.39Å; C1489-S1491 PolarHBondContact O-N 2.95Å; C1489-F1492 PolarHBondContact O-N 3.15Å; C1489-V1493 WeakPolarHBondContact O-CG2 2.96Å; C1489-I1571 HydrophobicContact CB-CG2 3.99Å
1490	S	47.4	Very low	51	Low	27 Å²	27	54.8 Å²	54.8	19%	0.189	31%	0.311	C	S	.	.	H	α-helix	trans	-57.7	-22.2	177.1	-167.5	0	0	0	0	114.2	L1486 I1487 S1488 N1494	L1486-S1490 PolarHBondContact O-N 3.11Å; L1486-S1490 VanDerWaalsContact O-N 3.16Å; I1487-S1490 WeakPolarHBondContact O-CB 3.47Å; I1487-S1490 PolarHBondContact O-N 2.96Å; S1488-S1490 PolarHBondContact O-N 3.11Å; S1490-N1494 PolarHBondContact O-ND2 3.5Å
1491	S	43.6	Very low	48.1	Very low	35 Å²	35	59.7 Å²	59.7	25%	0.245	35%	0.347	C	S	.	.	H	α-helix	trans	-99.7	-33.3	-171.6	-54.7	0	0	0	0	111.9	I1487 S1488 C1489	I1487-S1491 PolarHBondContact O-N 3.15Å; I1487-S1491 PolarHBondContact O-OG 2.94Å; S1488-S1491 PolarHBondContact O-N 3.41Å; C1489-S1491 PolarHBondContact O-N 2.95Å
1492	F	38.7	Very low	45.3	Very low	93 Å²	93	64.7 Å²	64.7	41%	0.408	38%	0.379	S	S	.	.	H	α-helix	trans	-76.4	-32.1	-177.3	-145.7	-89.5	0	0	0	113.7	S1488 C1489 N1494 K1495 T1496	S1488-F1492 PolarHBondContact O-N 3.38Å; C1489-F1492 PolarHBondContact O-N 3.15Å; F1492-N1494 PolarHBondContact O-N 2.8Å; F1492-N1494 VanDerWaalsContact O-N 3.11Å; F1492-K1495 PolarHBondContact O-N 3Å; F1492-T1496 HydrophobicContact CD1-CG2 4.06Å; F1492-T1496 HydrophobicContact CE1-CG2 4.1Å
1493	V	36	Very low	42.8	Very low	58 Å²	58	72.3 Å²	72.3	35%	0.352	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-53.9	-32.4	176.3	170.8	0	0	0	0	112.6	C1489 K1495 T1496 S1572	C1489-V1493 WeakPolarHBondContact O-CG2 2.96Å; V1493-K1495 PolarHBondContact O-N 3.38Å; V1493-K1495 VanDerWaalsContact O-N 3.11Å; V1493-T1496 PolarHBondContact O-N 3.05Å; V1493-T1496 PolarHBondContact O-OG1 2.85Å; V1493-S1572 WeakPolarHBondContact CG1-OG 3.38Å; V1493-S1572 WeakPolarHBondContact CG2-O 2.97Å; V1493-S1572 WeakPolarHBondContact CG2-OG 3.13Å
1494	N	30.8	Very low	40.7	Very low	133 Å²	133	74.9 Å²	74.9	71%	0.711	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-70.8	0	177.2	-69.8	-65.8	0	0	0	114.1	S1490 F1492	S1490-N1494 PolarHBondContact O-ND2 3.5Å; F1492-N1494 PolarHBondContact O-N 2.8Å; F1492-N1494 VanDerWaalsContact O-N 3.11Å
1495	K	31.2	Very low	38.2	Very low	138 Å²	138	77.2 Å²	77.2	60%	0.6	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-113.8	-13.4	176.4	-73.6	-177.9	174.6	175.4	0	114.6	F1492 V1493 I1497	F1492-K1495 PolarHBondContact O-N 3Å; V1493-K1495 PolarHBondContact O-N 3.38Å; V1493-K1495 VanDerWaalsContact O-N 3.11Å; K1495-I1497 PolarHBondContact O-N 3.21Å
1496	T	25.5	Very low	35.7	Very low	74 Å²	74	78.8 Å²	78.8	45%	0.454	46%	0.46	S	S	.	.			trans	-100.1	52.6	-171.5	51.6	0	0	0	0	113.8	F1492 V1493	F1492-T1496 HydrophobicContact CD1-CG2 4.06Å; F1492-T1496 HydrophobicContact CE1-CG2 4.1Å; V1493-T1496 PolarHBondContact O-N 3.05Å; V1493-T1496 PolarHBondContact O-OG1 2.85Å
1497	I	27.3	Very low	33.6	Very low	167 Å²	167	79.1 Å²	79.1	86%	0.856	47%	0.465	S	S	*	.	S	Bend	trans	-120.8	127.4	151.5	-60.8	179.6	0	0	0	106.1	K1495	K1495-I1497 PolarHBondContact O-N 3.21Å
1498	T	26	Very low	31.8	Very low	124 Å²	124	79.2 Å²	79.2	76%	0.761	47%	0.465	S	S	*	.			trans	-103.5	175.1	-154.9	60.7	0	0	0	0	112.7
1499	P	35.2	Very low	29.9	Very low	117 Å²	117	80.8 Å²	80.8	76%	0.76	48%	0.476	S	S	*	.				-138.9	148.3	-70.7	38.9	-23.3	0	0	0	113.9
1500	S	22.1	Very low	28.3	Very low	108 Å²	108	80.1 Å²	80.1	76%	0.755	47%	0.472	S	S	*	.			trans	-159.1	117.5	161.9	63.3	0	0	0	0	116.1
1501	S	23.1	Very low	27.2	Very low	116 Å²	116	80.9 Å²	80.9	81%	0.811	47%	0.473	S	S	*	.			trans	66.1	151.8	158.4	73.5	0	0	0	0	117.6
1502	P	25.5	Very low	26.3	Very low	105 Å²	105	85.6 Å²	85.6	68%	0.682	49%	0.492	S	S	*	.			trans	-131.8	163.4	-136	42.2	-28.1	0	0	0	115.6
1503	L	23.6	Very low	25.5	Very low	162 Å²	162	87.4 Å²	87.4	85%	0.848	50%	0.501	S	S	*	.			trans	63.4	174.2	153	-98.5	72.2	0	0	0	115.1
1504	P	25.6	Very low	24.9	Very low	58 Å²	58	89.9 Å²	89.9	38%	0.377	52%	0.517	S	S	.	.			cis	-100.2	175.1	-18.5	28.2	-9.6	0	0	0	110.3
1505	S	22.1	Very low	24.6	Very low	50 Å²	50	91.8 Å²	91.8	35%	0.35	52%	0.523	S	S	.	.			trans	75.8	167.9	135	66.2	0	0	0	0	113.8	L1725	S1505-L1725 VanDerWaalsContact C-CG 3.46Å; S1505-L1725 WeakPolarHBondContact OG-CA 3.47Å; S1505-L1725 WeakPolarHBondContact OG-CG 3.23Å; S1505-L1725 PolarHBondContact OG-N 2.95Å
1506	L	22.6	Very low	24.1	Very low	39 Å²	39	89 Å²	89	20%	0.204	52%	0.522	C	S	.	.			cis	175.6	173.9	-8.2	-116.7	65.8	0	0	0	106.4	E1721 T1722 Q1724 L1725	L1506-E1721 CarbonylContact C-O 3.48Å; L1506-E1721 VanDerWaalsContact C-O 3.3Å; L1506-E1721 WeakPolarHBondContact CA-O 3.46Å; L1506-E1721 HydrophobicContact CB-CG 4.33Å; L1506-E1721 WeakPolarHBondContact CB-O 3.39Å; L1506-E1721 HydrophobicContact CD1-CB 3.8Å; L1506-E1721 HydrophobicContact CD1-CG 3.17Å; L1506-E1721 VanDerWaalsContact CD2-CA 3.46Å; L1506-E1721 HydrophobicContact CD2-CB 4.37Å; L1506-E1721 HydrophobicContact CD2-CG 4.49Å; L1506-E1721 HydrophobicContact CG-CB 3.79Å; L1506-E1721 HydrophobicContact CG-CG 3.46Å; L1506-E1721 VanDerWaalsContact CG-CG 3.46Å; L1506-E1721 WeakPolarHBondContact CG-O 3.39Å; L1506-T1722 VanDerWaalsContact CB-CA 3.49Å; L1506-T1722 HydrophobicContact CB-CG2 4.09Å; L1506-T1722 WeakPolarHBondContact CB-O 3.45Å; L1506-T1722 WeakPolarHBondContact CD2-O 3.05Å; L1506-Q1724 HydrophobicContact CD2-CB 3.41Å; L1506-Q1724 VanDerWaalsContact CD2-CB 3.41Å; L1506-Q1724 HydrophobicContact CD2-CG 3.7Å; L1506-Q1724 VanDerWaalsContact CD2-N 3.33Å; L1506-L1725 HydrophobicContact CB-CB 3.61Å; L1506-L1725 HydrophobicContact CB-CD1 4.28Å; L1506-L1725 HydrophobicContact CB-CG 3.93Å; L1506-L1725 VanDerWaalsContact N-CD1 3.34Å
1507	S	22.3	Very low	24.2	Very low	31 Å²	31	92.9 Å²	92.9	22%	0.217	54%	0.54	C	S	.	.			trans	-129.3	-88.6	-144.2	90.7	0	0	0	0	121.5	H1646 V1718 E1721 T1722	S1507-H1646 WeakPolarHBondContact CB-CE1 3.4Å; S1507-H1646 WeakPolarHBondContact CB-NE2 3.34Å; S1507-V1718 WeakPolarHBondContact OG-CG1 3.44Å; S1507-V1718 PolarHBondContact OG-O 3Å; S1507-E1721 WeakPolarHBondContact CA-O 3.18Å; S1507-E1721 WeakPolarHBondContact CB-O 3.23Å; S1507-E1721 PolarHBondContact N-O 2.7Å; S1507-E1721 PolarHBondContact OG-O 3.25Å; S1507-T1722 WeakPolarHBondContact CA-OG1 3.49Å; S1507-T1722 PolarHBondContact N-OG1 3.4Å; S1507-T1722 VanDerWaalsContact N-OG1 3.16Å; S1507-T1722 PolarHBondContact O-OG1 3.06Å
1508	T	23.3	Very low	24	Very low	6 Å²	6	92.1 Å²	92.1	4%	0.037	53%	0.53	C	S	.	.			trans	9.6	120.5	162.9	-3.1	0	0	0	0	117	L1510 A1719 T1722 K1726 E1745	T1508-L1510 HydrophobicContact CG2-CB 4.01Å; T1508-L1510 HydrophobicContact CG2-CD2 3.09Å; T1508-L1510 HydrophobicContact CG2-CG 4.13Å; T1508-A1719 VanDerWaalsContact CG2-CA 3.48Å; T1508-A1719 HydrophobicContact CG2-CB 3.61Å; T1508-A1719 WeakPolarHBondContact CG2-O 3.26Å; T1508-A1719 PolarHBondContact OG1-O 3.05Å; T1508-T1722 WeakPolarHBondContact CA-OG1 3.43Å; T1508-T1722 WeakPolarHBondContact CB-OG1 3.12Å; T1508-T1722 PolarHBondContact N-OG1 3.42Å; T1508-T1722 PolarHBondContact O-OG1 3.28Å; T1508-T1722 WeakPolarHBondContact OG1-CA 2.95Å; T1508-T1722 VanDerWaalsContact OG1-CB 3.27Å; T1508-T1722 WeakPolarHBondContact OG1-CB 3.28Å; T1508-T1722 PolarHBondContact OG1-N 3.33Å; T1508-T1722 PolarHBondContact OG1-OG1 3.14Å; T1508-K1726 PolarHBondContact O-NZ 3Å; T1508-E1745 HydrophobicContact CG2-CB 4.3Å; T1508-E1745 HydrophobicContact CG2-CG 4.43Å; T1508-E1745 PolarHBondContact OG1-OE2 2.82Å
1509	S	21.4	Very low	23.8	Very low	40 Å²	40	93.6 Å²	93.6	28%	0.28	53%	0.526	S	S	.	.			cis	54.2	159.3	42.5	109.1	0	0	0	0	112.1	Q1744	S1509-Q1744 VanDerWaalsContact O-O 3.1Å
1510	L	22.2	Very low	23.3	Very low	2 Å²	2	95.4 Å²	95.4	1%	0.01	53%	0.53	C	S	.	.			trans	154.1	-140.3	149.9	156.1	137.7	0	0	0	105.6	T1508 A1719 Q1744 E1745 Q1746 I1747 V1748 A1749 N1750	T1508-L1510 HydrophobicContact CG2-CB 4.01Å; T1508-L1510 HydrophobicContact CG2-CD2 3.09Å; T1508-L1510 HydrophobicContact CG2-CG 4.13Å; L1510-A1719 HydrophobicContact CD2-CB 3.4Å; L1510-A1719 VanDerWaalsContact CD2-CB 3.4Å; L1510-Q1744 CarbonylContact C-O 3.54Å; L1510-Q1744 WeakPolarHBondContact CA-O 3.5Å; L1510-Q1744 PolarHBondContact N-O 2.77Å; L1510-E1745 HydrophobicContact CD2-CB 4.44Å; L1510-E1745 WeakPolarHBondContact CD2-O 3.44Å; L1510-Q1746 VanDerWaalsContact CD1-O 3.26Å; L1510-Q1746 WeakPolarHBondContact CD1-O 3.36Å; L1510-Q1746 VanDerWaalsContact CG-N 3.27Å; L1510-I1747 VanDerWaalsContact CD1-CA 3.49Å; L1510-V1748 HydrophobicContact CB-CB 3.75Å; L1510-V1748 WeakPolarHBondContact O-CA 3.36Å; L1510-V1748 WeakPolarHBondContact O-CB 3.37Å; L1510-V1748 WeakPolarHBondContact O-CG2 3.31Å; L1510-V1748 PolarHBondContact O-N 2.77Å; L1510-A1749 HydrophobicContact CB-CB 4.47Å; L1510-A1749 VanDerWaalsContact CB-N 3.26Å; L1510-A1749 VanDerWaalsContact CD1-CA 3.44Å; L1510-A1749 HydrophobicContact CD1-CB 3.56Å; L1510-A1749 HydrophobicContact CD2-CB 4.07Å; L1510-A1749 HydrophobicContact CG-CB 4.21Å; L1510-N1750 VanDerWaalsContact CD1-N 3.33Å
1511	N	22.4	Very low	23.3	Very low	42 Å²	42	93.9 Å²	93.9	23%	0.225	52%	0.519	C	S	.	.			trans	-26.3	134.4	-168.5	-156.7	40.7	0	0	0	121.9	E1513 S1743 Q1744 I1747	N1511-E1513 PolarHBondContact ND2-O 3.22Å; N1511-E1513 PolarHBondContact OD1-O 3.19Å; N1511-E1513 VanDerWaalsContact OD1-O 3.1Å; N1511-S1743 VanDerWaalsContact CB-O 3.23Å; N1511-S1743 WeakPolarHBondContact CB-O 3.38Å; N1511-S1743 PolarHBondContact N-O 3.18Å; N1511-S1743 VanDerWaalsContact N-O 3.11Å; N1511-Q1744 HydrophobicContact CB-CB 4.39Å; N1511-Q1744 PolarHBondContact N-O 3.4Å; N1511-Q1744 PolarHBondContact O-NE2 3.19Å; N1511-I1747 HydrophobicContact CB-CG1 4.47Å; N1511-I1747 WeakPolarHBondContact OD1-CD1 3.49Å; N1511-I1747 WeakPolarHBondContact OD1-CG1 3.25Å
1512	Q	25	Very low	23.6	Very low	134 Å²	134	95.5 Å²	95.5	63%	0.626	52%	0.518	S	S	*	.			trans	-133.5	145.5	140	-179.2	-171.6	-42.2	0	0	106
1513	E	23.1	Very low	23.8	Very low	131 Å²	131	93.4 Å²	93.4	61%	0.612	52%	0.516	S	S	*	.			trans	85.6	159.5	-178.2	-56.1	-177.2	-167	0	0	116.3	N1511	N1511-E1513 PolarHBondContact ND2-O 3.22Å; N1511-E1513 PolarHBondContact OD1-O 3.19Å; N1511-E1513 VanDerWaalsContact OD1-O 3.1Å
1514	T	22.5	Very low	24.1	Very low	111 Å²	111	91.2 Å²	91.2	68%	0.681	50%	0.501	S	S	*	.			cis	-136.1	139.2	-9.3	-13.2	0	0	0	0	109.8
1515	M	23.8	Very low	24.3	Very low	172 Å²	172	93.9 Å²	93.9	85%	0.847	51%	0.508	S	S	*	.				-158.8	112.9	125.8	-112.6	-179.6	81.3	0	0	109.2	D1517	M1515-D1517 PolarHBondContact O-N 3.39Å
1516	S	21.7	Very low	24.5	Very low	80 Å²	80	97.4 Å²	97.4	56%	0.559	52%	0.517	S	S	*	.			trans	-77	112	165.2	51.2	0	0	0	0	109.2
1517	D	27.4	Very low	24.5	Very low	156 Å²	156	97.8 Å²	97.8	83%	0.834	52%	0.523	S	S	*	.			trans	-99.1	145.8	142.9	-100.9	-49.9	0	0	0	108.4	M1515	M1515-D1517 PolarHBondContact O-N 3.39Å
1518	F	22.6	Very low	25	Very low	151 Å²	151	97 Å²	97	66%	0.662	52%	0.517	S	S	*	.			trans	-97.1	147.9	-146.9	-117.6	-120.4	0	0	0	116.2
1519	K	22.4	Very low	25.2	Very low	155 Å²	155	100.6 Å²	100.6	67%	0.674	54%	0.536	S	S	*	.			trans	-5.4	124.4	155.9	-52.7	174.7	-172.5	177.1	0	117.3
1520	N	23.7	Very low	25.6	Very low	155 Å²	155	101.4 Å²	101.4	83%	0.829	54%	0.537	S	S	*	.				173.7	164.5	125.2	-93.4	-8.1	0	0	0	109.3
1521	S	22.5	Very low	26.1	Very low	76 Å²	76	106.4 Å²	106.4	53%	0.531	56%	0.563	S	S	.	*			cis	-172.4	-175.7	-29.7	59.6	0	0	0	0	106.1
1522	N	30.2	Very low	26.3	Very low	149 Å²	149	110 Å²	110	80%	0.797	58%	0.582	S	S	*	*			trans	70.8	153	175	-41	-9.6	0	0	0	112.1
1523	G	28.7	Very low	26.4	Very low	61 Å²	61	107.9 Å²	107.9	63%	0.629	57%	0.571	S	S	*	*			cis	98.8	132	15.6	0	0	0	0	0	110.1
1524	H	30	Very low	26.6	Very low	117 Å²	117	106 Å²	106	54%	0.542	57%	0.565	S	S	.	*			cis	-149	-147.7	20	-98.4	-167.1	0	0	0	111	S428 S429 S430	S428-H1524 WeakPolarHBondContact CA-NE2 3.4Å; S428-H1524 PolarHBondContact O-CE1 2.85Å; S429-H1524 VanDerWaalsContact C-CB 3.48Å; S429-H1524 PolarHBondContact N-CD2 3.48Å; S429-H1524 PolarHBondContact N-CE1 2.82Å; S429-H1524 PolarHBondContact N-ND1 3.06Å; S429-H1524 PolarHBondContact N-NE2 3.08Å; S429-H1524 PolarHBondContact O-CE1 3.36Å; S429-H1524 PolarHBondContact O-ND1 3.42Å; S430-H1524 VanDerWaalsContact OG-CA 3.28Å; S430-H1524 WeakPolarHBondContact OG-CA 3.37Å; S430-H1524 WeakPolarHBondContact OG-CB 3.31Å
1525	H	29.6	Very low	26.8	Very low	114 Å²	114	104.7 Å²	104.7	53%	0.528	56%	0.56	S	S	.	*			trans	-60.4	-177.1	179.4	-65.7	-66.6	0	0	0	116.3	S429 S430	S429-H1525 VanDerWaalsContact CA-CG 3.46Å; S429-H1525 WeakPolarHBondContact CB-CD2 3.4Å; S430-H1525 VanDerWaalsContact CB-N 3.29Å; S430-H1525 WeakPolarHBondContact CB-O 3.42Å; S430-H1525 PolarHBondContact N-CD2 2.85Å; S430-H1525 VanDerWaalsContact N-N 3.1Å; S430-H1525 PolarHBondContact OG-N 2.71Å; S430-H1525 PolarHBondContact OG-O 3.27Å
1526	K	26.2	Very low	26.9	Very low	124 Å²	124	104.8 Å²	104.8	54%	0.539	56%	0.556	S	S	.	*				56.8	125	128.3	-79.1	164.5	-170.5	163.1	0	116.6	C431	C431-K1526 VanDerWaalsContact O-CB 3.31Å; C431-K1526 WeakPolarHBondContact O-CB 3.48Å
1527	S	23.4	Very low	27	Very low	46 Å²	46	107.8 Å²	107.8	32%	0.322	56%	0.562	S	S	.	*			cis	65.4	154.3	44.1	111.2	0	0	0	0	112.4	D1529	S1527-D1529 WeakPolarHBondContact CB-OD2 3.32Å; S1527-D1529 PolarHBondContact OG-OD2 3.11Å
1528	T	33	Very low	26.7	Very low	15 Å²	15	105.1 Å²	105.1	9%	0.092	55%	0.554	C	S	.	*			cis	-96.4	162.9	24.5	66.5	0	0	0	0	115.1	Q104 G105 N106	Q104-T1528 WeakPolarHBondContact O-CG2 3.36Å; G105-T1528 WeakPolarHBondContact CA-OG1 3.36Å; G105-T1528 PolarHBondContact N-OG1 2.88Å; N106-T1528 WeakPolarHBondContact CA-OG1 3.46Å
1529	D	26.6	Very low	26.8	Very low	82 Å²	82	102.8 Å²	102.8	44%	0.439	56%	0.556	S	S	.	*			cis	56.8	156.8	47.2	-20.1	-62.7	0	0	0	111.1	S1527	S1527-D1529 WeakPolarHBondContact CB-OD2 3.32Å; S1527-D1529 PolarHBondContact OG-OD2 3.11Å
1530	D	30.3	Very low	26.9	Very low	56 Å²	56	102.1 Å²	102.1	30%	0.299	56%	0.559	S	S	.	*			cis	-157	-161	12.7	-136.1	-21.9	0	0	0	105.7	D102 S103	D102-D1530 WeakPolarHBondContact CA-OD2 3.42Å; S103-D1530 PolarHBondContact N-OD2 3.46Å
1531	L	33.3	Very low	26.9	Very low	108 Å²	108	100.3 Å²	100.3	57%	0.565	55%	0.549	S	S	*	.	S	Bend	cis	-170	140.1	28	-155.6	74.3	0	0	0	104.9	D102	D102-L1531 HydrophobicContact CB-CD1 3.53Å; D102-L1531 HydrophobicContact CB-CG 4.48Å; D102-L1531 VanDerWaalsContact OD1-CD1 3.25Å; D102-L1531 WeakPolarHBondContact OD1-CD1 3.43Å
1532	D	25.8	Very low	27.1	Very low	116 Å²	116	103.5 Å²	103.5	62%	0.62	56%	0.555	S	S	*	*	S	Bend	cis	-134.5	153.8	-4.1	86.1	-61.4	0	0	0	108.9	D102	D102-D1532 VanDerWaalsContact OD1-CB 3.24Å; D102-D1532 WeakPolarHBondContact OD1-CB 3.45Å
1533	K	26.9	Very low	26.8	Very low	90 Å²	90	103 Å²	103	39%	0.391	55%	0.548	S	S	.	.			cis	-123.3	150.9	-12.2	-71.9	-173.6	-176.4	-59.8	0	111	A101 D102	A101-K1533 HydrophobicContact CB-CB 4.26Å; A101-K1533 PolarHBondContact O-NZ 3.43Å; D102-K1533 IonicContact OD1-NZ 3.23Å; D102-K1533 PolarHBondContact OD1-NZ 3.03Å; D102-K1533 IonicContact OD2-NZ 2.69Å; D102-K1533 PolarHBondContact OD2-NZ 3.03Å
1534	L	28.3	Very low	26.5	Very low	91 Å²	91	105.5 Å²	105.5	48%	0.476	54%	0.543	S	S	.	.			trans	-125.7	144.3	-170.6	-74.9	172.5	0	0	0	109.5	A101	A101-L1534 HydrophobicContact CB-CB 4.23Å; A101-L1534 VanDerWaalsContact CB-N 3.34Å; A101-L1534 WeakPolarHBondContact CB-O 3.36Å
1535	S	26	Very low	26.3	Very low	84 Å²	84	106.2 Å²	106.2	59%	0.587	55%	0.546	S	S	*	.				79.8	155.5	78.6	113.3	0	0	0	0	113.8
1536	F	26.4	Very low	26.2	Very low	175 Å²	175	106.9 Å²	106.9	77%	0.768	55%	0.549	S	S	*	.			cis	-163	172.9	-22.6	-133.8	-113.6	0	0	0	108.8
1537	Q	22.9	Very low	26	Very low	143 Å²	143	105.1 Å²	105.1	67%	0.668	54%	0.543	S	S	*	.			trans	37.1	121.3	153.2	-114.5	68.8	-48.8	0	0	124.9
1538	C	22.8	Very low	26.2	Very low	100 Å²	100	108.9 Å²	108.9	68%	0.676	55%	0.551	S	S	*	*				50.6	132.9	125.6	-73.3	0	0	0	0	125.7
1539	S	23.1	Very low	25.6	Very low	102 Å²	102	110.5 Å²	110.5	71%	0.713	56%	0.563	S	S	*	*			trans	75	150.4	132.1	-64.8	0	0	0	0	119.5
1540	I	25.1	Very low	25.5	Very low	140 Å²	140	112.4 Å²	112.4	72%	0.718	57%	0.572	S	S	*	*			cis	-155.6	159.7	-6.7	-113.6	163.4	0	0	0	109
1541	N	24.8	Very low	25.2	Very low	118 Å²	118	113.5 Å²	113.5	63%	0.631	58%	0.584	S	S	*	*			trans	6.3	144.4	162.5	-52.3	0.8	0	0	0	120.4
1542	H	25.1	Very low	24.8	Very low	143 Å²	143	113.3 Å²	113.3	66%	0.662	59%	0.591	S	S	*	*				-156.5	170.1	56.7	-110.3	-83.3	0	0	0	115.3
1543	H	23.6	Very low	24.5	Very low	139 Å²	139	113.4 Å²	113.4	64%	0.644	60%	0.602	S	S	*	*			trans	1.5	136.1	161	-55.5	-32.5	0	0	0	118.3
1544	H	24	Very low	24.3	Very low	113 Å²	113	114.1 Å²	114.1	52%	0.523	62%	0.618	S	S	.	*				-149.7	165.9	65.8	-113.6	-99.9	0	0	0	116.7
1545	H	24.7	Very low	24	Very low	132 Å²	132	115 Å²	115	61%	0.611	63%	0.631	S	S	*	*			trans	66.7	148.9	150.4	-85.2	-61.7	0	0	0	122.2
1546	H	27.9	Very low	23.8	Very low	128 Å²	128	115.7 Å²	115.7	59%	0.593	64%	0.637	S	S	*	*			trans	48.6	140.7	145.9	-67.4	-64.9	0	0	0	121.1
1547	Q	23	Very low	23.6	Very low	87 Å²	87	113.1 Å²	113.1	41%	0.407	63%	0.63	S	S	.	*			cis	-158.8	-127.3	-28.1	-136.7	-179.5	-8.4	0	0	108.2	I224 F225 S1549	I224-Q1547 HydrophobicContact CB-CG 4.05Å; I224-Q1547 HydrophobicContact CG2-CB 4.47Å; I224-Q1547 HydrophobicContact CG2-CG 3.81Å; I224-Q1547 WeakPolarHBondContact O-CG 3.46Å; I224-Q1547 PolarHBondContact O-NE2 3.11Å; F225-Q1547 HydrophobicContact CD2-CG 4.38Å; Q1547-S1549 PolarHBondContact O-N 3.32Å
1548	Y	25.8	Very low	23.5	Very low	125 Å²	125	113.1 Å²	113.1	49%	0.49	63%	0.633	S	S	.	*			trans	-60.9	128.6	-165.2	-75.6	-111	0	0	0	112.7	S223 I224 F225	S223-Y1548 WeakPolarHBondContact O-CD1 3.39Å; S223-Y1548 WeakPolarHBondContact O-CD2 3.46Å; S223-Y1548 WeakPolarHBondContact O-CE1 3.23Å; S223-Y1548 WeakPolarHBondContact O-CE2 3.18Å; I224-Y1548 VanDerWaalsContact C-CZ 3.5Å; I224-Y1548 HydrophobicContact CB-CD1 4.14Å; I224-Y1548 HydrophobicContact CB-CD2 3.4Å; I224-Y1548 HydrophobicContact CB-CE2 4.02Å; I224-Y1548 HydrophobicContact CB-CG 3.5Å; I224-Y1548 VanDerWaalsContact CB-CG 3.5Å; I224-Y1548 HydrophobicContact CG1-CD1 4.1Å; I224-Y1548 HydrophobicContact CG1-CG 3.98Å; I224-Y1548 HydrophobicContact CG2-CD2 4.43Å; I224-Y1548 PolarHBondContact N-OH 3.37Å; I224-Y1548 WeakPolarHBondContact O-CD2 3.32Å; I224-Y1548 WeakPolarHBondContact O-CE2 3.37Å; F225-Y1548 PolarHBondContact O-OH 3.38Å
1549	S	21.5	Very low	23.4	Very low	49 Å²	49	112.4 Å²	112.4	34%	0.343	63%	0.625	S	S	.	*				63.9	113.5	72	-104.9	0	0	0	0	112.5	I224 Q1547	I224-S1549 VanDerWaalsContact CD1-OG 3.25Å; I224-S1549 WeakPolarHBondContact CD1-OG 3.26Å; I224-S1549 WeakPolarHBondContact CG1-OG 3.32Å; Q1547-S1549 PolarHBondContact O-N 3.32Å
1550	I	23.6	Very low	23.4	Very low	121 Å²	121	114.3 Å²	114.3	62%	0.621	63%	0.632	S	S	*	*				54.4	84.6	116.1	-61.6	173.6	0	0	0	112.2	Y221	Y221-I1550 VanDerWaalsContact CE1-O 3.25Å; Y221-I1550 WeakPolarHBondContact CE1-O 3.49Å
1551	S	24.3	Very low	23.2	Very low	79 Å²	79	113.3 Å²	113.3	55%	0.552	63%	0.633	S	S	*	*				73.4	154.5	77.6	80.2	0	0	0	0	112.3	Y221	Y221-S1551 PolarHBondContact OH-O 2.83Å
1552	S	24.7	Very low	23.2	Very low	104 Å²	104	113.6 Å²	113.6	73%	0.727	64%	0.642	S	S	*	*			cis	-170.2	171.6	46.7	50.7	0	0	0	0	113.7
1553	S	20.4	Very low	23.1	Very low	119 Å²	119	113.1 Å²	113.1	83%	0.832	65%	0.649	S	S	*	*			trans	-122.5	121.6	149	-54.9	0	0	0	0	108.9
1554	S	22.2	Very low	23.3	Very low	105 Å²	105	115.4 Å²	115.4	73%	0.734	66%	0.657	S	S	*	*			trans	3.2	136.1	159.6	-47.7	0	0	0	0	120.9
1555	S	22.2	Very low	23.5	Very low	108 Å²	108	116 Å²	116	76%	0.755	66%	0.658	S	S	*	*				23.2	132.3	112.4	-30.1	0	0	0	0	117.4
1556	S	21.7	Very low	23.9	Very low	100 Å²	100	112.7 Å²	112.7	70%	0.699	65%	0.649	S	S	*	*			cis	-164.7	169.8	25.8	-51.2	0	0	0	0	114.3
1557	I	21.9	Very low	24.2	Very low	121 Å²	121	110.8 Å²	110.8	62%	0.621	65%	0.65	S	S	*	*			trans	77	110.8	145.3	-75.3	159.5	0	0	0	120
1558	I	21.2	Very low	25.1	Very low	143 Å²	143	109.4 Å²	109.4	73%	0.733	65%	0.647	S	S	*	*			trans	54.9	86.5	147.1	-51.6	172.8	0	0	0	117.3	I2	I2-I1558 WeakPolarHBondContact CD1-O 3.41Å
1559	T	21.3	Very low	26.1	Very low	84 Å²	84	105.6 Å²	105.6	52%	0.515	63%	0.633	S	S	.	*			trans	-128.2	155	142.1	-16.8	0	0	0	0	109.9	I2 T1561	I2-T1559 HydrophobicContact CD1-CG2 4.25Å; I2-T1559 HydrophobicContact CG2-CG2 4.29Å; T1559-T1561 PolarHBondContact O-N 3.41Å
1560	T	22.5	Very low	27.4	Very low	142 Å²	142	106.6 Å²	106.6	87%	0.871	63%	0.634	S	S	*	*			trans	-71.9	98.9	-164.8	52	0	0	0	0	113.6
1561	T	21.8	Very low	28.6	Very low	119 Å²	119	101 Å²	101	73%	0.73	61%	0.606	S	S	*	*			trans	-76.5	151	169.5	54.6	0	0	0	0	111.5	T1559 T1563	T1559-T1561 PolarHBondContact O-N 3.41Å; T1561-T1563 PolarHBondContact O-N 2.85Å
1562	P	23	Very low	29.5	Very low	125 Å²	125	97.8 Å²	97.8	81%	0.812	58%	0.583	S	S	*	*			trans	-67.4	121.8	-176.7	26.4	-34.2	0	0	0	110.9	K1564	P1562-K1564 PolarHBondContact O-N 3.28Å
1563	T	24	Very low	30.3	Very low	133 Å²	133	94 Å²	94	82%	0.816	55%	0.554	S	S	*	*			trans	-55.2	103.7	-172.5	55.3	0	0	0	0	112.3	T1561 K1565	T1561-T1563 PolarHBondContact O-N 2.85Å; T1563-K1565 PolarHBondContact O-N 2.98Å
1564	K	27.6	Very low	31	Very low	187 Å²	187	93 Å²	93	81%	0.813	54%	0.536	S	S	*	.			trans	-57.2	110.2	164.9	-67.1	174.2	-178.7	172.5	0	107	P1562 S1566	P1562-K1564 PolarHBondContact O-N 3.28Å; K1564-S1566 VanDerWaalsContact C-N 3.26Å; K1564-S1566 PolarHBondContact O-N 3.29Å
1565	K	29.1	Very low	31.8	Very low	126 Å²	126	88.5 Å²	88.5	55%	0.548	50%	0.504	S	S	.	.			trans	-60.2	91.3	164	-80.9	-166.1	173.3	-167.8	0	107.1	K650 T1563	K650-K1565 WeakPolarHBondContact CD-O 3.47Å; K650-K1565 WeakPolarHBondContact CE-O 3.33Å; K650-K1565 PolarHBondContact NZ-O 2.97Å; T1563-K1565 PolarHBondContact O-N 2.98Å
1566	S	31.4	Very low	32.3	Very low	61 Å²	61	87.7 Å²	87.7	43%	0.427	49%	0.488	S	S	.	.			trans	-68.1	149.3	179.8	55.8	0	0	0	0	109.7	K1564 T1568 T1586	K1564-S1566 VanDerWaalsContact C-N 3.26Å; K1564-S1566 PolarHBondContact O-N 3.29Å; S1566-T1568 PolarHBondContact O-N 3.28Å; S1566-T1586 VanDerWaalsContact CB-CG2 3.47Å; S1566-T1586 WeakPolarHBondContact OG-CG2 3.29Å
1567	C	36	Very low	32.8	Very low	89 Å²	89	87 Å²	87	60%	0.601	48%	0.482	S	S	*	.			trans	-93.5	95.3	175.9	-160.7	0	0	0	0	106.4	K1569 T1586	C1567-K1569 PolarHBondContact O-N 3.02Å; C1567-T1586 PolarHBondContact O-OG1 2.69Å
1568	T	40.8	Very low	33.4	Very low	58 Å²	58	88.6 Å²	88.6	36%	0.356	49%	0.491	S	S	.	.			trans	-57.6	103.4	-175	51.7	0	0	0	0	110.6	S1566 L1570 T1586	S1566-T1568 PolarHBondContact O-N 3.28Å; T1568-L1570 PolarHBondContact O-N 2.9Å; T1568-T1586 WeakPolarHBondContact CA-OG1 3.42Å
1569	K	48	Very low	33.9	Very low	45 Å²	45	84.4 Å²	84.4	20%	0.196	47%	0.474	C	S	.	.			trans	-80	104.2	173.5	-71.6	179.8	-178.7	159.1	0	108.2	C1567 L1585 T1586 D1633 I1636	C1567-K1569 PolarHBondContact O-N 3.02Å; K1569-L1585 HydrophobicContact CB-CB 4.08Å; K1569-L1585 HydrophobicContact CB-CD1 3.81Å; K1569-L1585 WeakPolarHBondContact O-CB 3.27Å; K1569-L1585 PolarHBondContact O-N 3.21Å; K1569-T1586 PolarHBondContact N-OG1 3.49Å; K1569-T1586 VanDerWaalsContact N-OG1 3.09Å; K1569-D1633 WeakPolarHBondContact CD-OD1 3.39Å; K1569-D1633 WeakPolarHBondContact CE-OD1 3.29Å; K1569-D1633 PolarHBondContact NZ-O 3.06Å; K1569-D1633 IonicContact NZ-OD1 3.63Å; K1569-D1633 PolarHBondContact NZ-OD1 2.78Å; K1569-I1636 HydrophobicContact CD-CB 4.4Å; K1569-I1636 HydrophobicContact CD-CG2 3.62Å
1570	L	47.5	Very low	34.9	Very low	69 Å²	69	83.3 Å²	83.3	36%	0.361	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	112.5	175.2	-69.6	158	0	0	0	108	T1568 F1582 I1583 D1584	T1568-L1570 PolarHBondContact O-N 2.9Å; L1570-F1582 HydrophobicContact CB-CD1 4.48Å; L1570-F1582 HydrophobicContact CD2-CB 4.33Å; L1570-I1583 WeakPolarHBondContact CA-O 3.18Å; L1570-D1584 HydrophobicContact CD2-CB 3.78Å
1571	I	48.2	Very low	35.9	Very low	4 Å²	4	79.3 Å²	79.3	2%	0.021	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	138.8	155.2	-59.7	-177.5	0	0	0	106	L1486 C1489 F1573 F1582 I1583 L1585	L1486-I1571 HydrophobicContact CB-CD1 3.74Å; L1486-I1571 HydrophobicContact CD2-CD1 3.89Å; L1486-I1571 HydrophobicContact CG-CD1 4.35Å; L1486-I1571 WeakPolarHBondContact O-CD1 2.92Å; C1489-I1571 HydrophobicContact CB-CG2 3.99Å; I1571-F1573 HydrophobicContact CG2-CD1 4.31Å; I1571-F1582 CarbonylContact O-C 3.4Å; I1571-F1582 WeakPolarHBondContact O-CA 3.48Å; I1571-I1583 PolarHBondContact N-O 2.77Å; I1571-I1583 PolarHBondContact O-N 2.67Å; I1571-L1585 HydrophobicContact CD1-CD1 3.82Å; I1571-L1585 HydrophobicContact CD1-CD2 3.77Å; I1571-L1585 HydrophobicContact CD1-CG 3.96Å; I1571-L1585 HydrophobicContact CG1-CD1 3.54Å; I1571-L1585 HydrophobicContact CG1-CD2 4.25Å; I1571-L1585 HydrophobicContact CG1-CG 3.86Å
1572	S	43.8	Very low	37.1	Very low	11 Å²	11	79.9 Å²	79.9	8%	0.077	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.7	158.8	62.5	0	0	0	0	111.2	V1493 H1581	V1493-S1572 WeakPolarHBondContact CG1-OG 3.38Å; V1493-S1572 WeakPolarHBondContact CG2-O 2.97Å; V1493-S1572 WeakPolarHBondContact CG2-OG 3.13Å; S1572-H1581 WeakPolarHBondContact CA-O 3.27Å; S1572-H1581 WeakPolarHBondContact CB-O 3.25Å
1573	F	42.3	Very low	38.7	Very low	26 Å²	26	75 Å²	75	11%	0.114	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.8	174.3	40.7	-79.3	0	0	0	108.3	I1345 L1353 I1571 T1575 H1581 I1583	I1345-F1573 HydrophobicContact CD1-CB 3.61Å; L1353-F1573 HydrophobicContact CD1-CE2 3.99Å; L1353-F1573 HydrophobicContact CD1-CZ 3.71Å; I1571-F1573 HydrophobicContact CG2-CD1 4.31Å; F1573-T1575 HydrophobicContact CD2-CG2 4.2Å; F1573-H1581 HydrophobicContact CD2-CB 3.9Å; F1573-H1581 HydrophobicContact CE1-CB 4.25Å; F1573-H1581 HydrophobicContact CE2-CB 3.46Å; F1573-H1581 VanDerWaalsContact CE2-CB 3.46Å; F1573-H1581 AromaticContact CE2-CG 3.84Å; F1573-H1581 HydrophobicContact CG-CB 4.47Å; F1573-H1581 HydrophobicContact CZ-CB 3.64Å; F1573-H1581 PolarHBondContact N-O 3.45Å; F1573-H1581 VanDerWaalsContact N-O 3.14Å; F1573-H1581 PolarHBondContact O-N 3.45Å; F1573-I1583 HydrophobicContact CE1-CD1 3.66Å; F1573-I1583 HydrophobicContact CE1-CG1 3.86Å; F1573-I1583 HydrophobicContact CZ-CD1 4.02Å; F1573-I1583 HydrophobicContact CZ-CG1 4.29Å
1574	Q	35	Very low	40.3	Very low	96 Å²	96	69.8 Å²	69.8	45%	0.449	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.7	178.2	-175.6	169.5	-5.5	0	0	108.5	E1576 C1579 V1580	Q1574-E1576 WeakPolarHBondContact CG-O 3.32Å; Q1574-E1576 PolarHBondContact NE2-O 2.66Å; Q1574-C1579 WeakPolarHBondContact CA-O 3.14Å; Q1574-C1579 WeakPolarHBondContact CG-O 3.15Å; Q1574-V1580 HydrophobicContact CB-CG2 4.24Å; Q1574-V1580 HydrophobicContact CG-CG2 4.12Å
1575	T	38.8	Very low	41.8	Very low	11 Å²	11	61.4 Å²	61.4	7%	0.067	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-29.2	-172.5	44.6	0	0	0	0	111.7	P1348 F1573 C1579 H1581	P1348-T1575 HydrophobicContact CG-CG2 3.35Å; F1573-T1575 HydrophobicContact CD2-CG2 4.2Å; T1575-C1579 PolarHBondContact N-O 3.35Å; T1575-C1579 PolarHBondContact OG1-O 2.95Å; T1575-H1581 VanDerWaalsContact CG2-CD2 3.45Å; T1575-H1581 WeakPolarHBondContact CG2-CD2 3.15Å; T1575-H1581 PolarHBondContact OG1-CD2 2.98Å; T1575-H1581 VanDerWaalsContact OG1-CD2 3.29Å; T1575-H1581 PolarHBondContact OG1-NE2 2.88Å
1576	E	32.8	Very low	43.1	Very low	91 Å²	91	55.8 Å²	55.8	43%	0.425	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	167	171.5	-74.5	-150.9	114.4	0	0	111	Q1574 N1578 C1579	Q1574-E1576 WeakPolarHBondContact CG-O 3.32Å; Q1574-E1576 PolarHBondContact NE2-O 2.66Å; E1576-N1578 PolarHBondContact O-N 3.37Å; E1576-C1579 HydrophobicContact CB-CB 3.97Å; E1576-C1579 PolarHBondContact O-N 3.24Å; E1576-C1579 VanDerWaalsContact O-N 3.14Å
1577	P	32.1	Very low	44.5	Very low	87 Å²	87	58.7 Å²	58.7	57%	0.565	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	108.2	160.2	23.6	-34.9	0	0	0	111.3
1578	N	34.3	Very low	45.8	Very low	153 Å²	153	55 Å²	55	82%	0.818	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-7.3	-177.7	-44.3	-61	0	0	0	118.1	E1576	E1576-N1578 PolarHBondContact O-N 3.37Å
1579	C	31.2	Very low	46.8	Very low	56 Å²	56	53 Å²	53	38%	0.378	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	115.1	175	-65	0	0	0	0	111.4	Q1574 T1575 E1576	Q1574-C1579 WeakPolarHBondContact CA-O 3.14Å; Q1574-C1579 WeakPolarHBondContact CG-O 3.15Å; T1575-C1579 PolarHBondContact N-O 3.35Å; T1575-C1579 PolarHBondContact OG1-O 2.95Å; E1576-C1579 HydrophobicContact CB-CB 3.97Å; E1576-C1579 PolarHBondContact O-N 3.24Å; E1576-C1579 VanDerWaalsContact O-N 3.14Å
1580	V	42.1	Very low	47.4	Very low	60 Å²	60	55.4 Å²	55.4	36%	0.364	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	115.5	-175	-177.5	0	0	0	0	110.5	Q1574 F1582	Q1574-V1580 HydrophobicContact CB-CG2 4.24Å; Q1574-V1580 HydrophobicContact CG-CG2 4.12Å; V1580-F1582 HydrophobicContact CB-CE2 4.22Å; V1580-F1582 HydrophobicContact CB-CZ 4.45Å; V1580-F1582 HydrophobicContact CG1-CD2 4.47Å; V1580-F1582 HydrophobicContact CG1-CE1 4.32Å; V1580-F1582 HydrophobicContact CG1-CE2 3.77Å; V1580-F1582 HydrophobicContact CG1-CZ 3.68Å; V1580-F1582 WeakPolarHBondContact O-CD2 3.36Å; V1580-F1582 WeakPolarHBondContact O-CE2 3.19Å
1581	H	45.2	Very low	48.1	Very low	58 Å²	58	52.7 Å²	52.7	27%	0.269	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	152.4	177.1	-54.4	-99.8	0	0	0	110.4	S1572 F1573 T1575	S1572-H1581 WeakPolarHBondContact CA-O 3.27Å; S1572-H1581 WeakPolarHBondContact CB-O 3.25Å; F1573-H1581 HydrophobicContact CD2-CB 3.9Å; F1573-H1581 HydrophobicContact CE1-CB 4.25Å; F1573-H1581 HydrophobicContact CE2-CB 3.46Å; F1573-H1581 VanDerWaalsContact CE2-CB 3.46Å; F1573-H1581 AromaticContact CE2-CG 3.84Å; F1573-H1581 HydrophobicContact CG-CB 4.47Å; F1573-H1581 HydrophobicContact CZ-CB 3.64Å; F1573-H1581 PolarHBondContact N-O 3.45Å; F1573-H1581 VanDerWaalsContact N-O 3.14Å; F1573-H1581 PolarHBondContact O-N 3.45Å; T1575-H1581 VanDerWaalsContact CG2-CD2 3.45Å; T1575-H1581 WeakPolarHBondContact CG2-CD2 3.15Å; T1575-H1581 PolarHBondContact OG1-CD2 2.98Å; T1575-H1581 VanDerWaalsContact OG1-CD2 3.29Å; T1575-H1581 PolarHBondContact OG1-NE2 2.88Å
1582	F	46.8	Very low	48.8	Very low	131 Å²	131	53.1 Å²	53.1	58%	0.575	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130	122.3	-176	-66.4	-92	0	0	0	112.2	L1570 I1571 V1580	L1570-F1582 HydrophobicContact CB-CD1 4.48Å; L1570-F1582 HydrophobicContact CD2-CB 4.33Å; I1571-F1582 CarbonylContact O-C 3.4Å; I1571-F1582 WeakPolarHBondContact O-CA 3.48Å; V1580-F1582 HydrophobicContact CB-CE2 4.22Å; V1580-F1582 HydrophobicContact CB-CZ 4.45Å; V1580-F1582 HydrophobicContact CG1-CD2 4.47Å; V1580-F1582 HydrophobicContact CG1-CE1 4.32Å; V1580-F1582 HydrophobicContact CG1-CE2 3.77Å; V1580-F1582 HydrophobicContact CG1-CZ 3.68Å; V1580-F1582 WeakPolarHBondContact O-CD2 3.36Å; V1580-F1582 WeakPolarHBondContact O-CE2 3.19Å
1583	I	55.4	Low	49.7	Very low	24 Å²	24	53.9 Å²	53.9	12%	0.123	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.9	169.5	-68.9	175.2	0	0	0	109.1	L1570 I1571 F1573 L1585 L1588	L1570-I1583 WeakPolarHBondContact CA-O 3.18Å; I1571-I1583 PolarHBondContact N-O 2.77Å; I1571-I1583 PolarHBondContact O-N 2.67Å; F1573-I1583 HydrophobicContact CE1-CD1 3.66Å; F1573-I1583 HydrophobicContact CE1-CG1 3.86Å; F1573-I1583 HydrophobicContact CZ-CD1 4.02Å; F1573-I1583 HydrophobicContact CZ-CG1 4.29Å; I1583-L1585 PolarHBondContact O-N 2.86Å; I1583-L1588 HydrophobicContact CG2-CD2 4.37Å
1584	D	58.6	Low	50.6	Low	23 Å²	23	56.6 Å²	56.6	12%	0.123	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	93.9	171.8	-171.9	-21.5	0	0	0	109.4	L1570 T1586 K1587 L1588	L1570-D1584 HydrophobicContact CD2-CB 3.78Å; D1584-T1586 PolarHBondContact O-N 3.41Å; D1584-T1586 VanDerWaalsContact O-N 3.15Å; D1584-T1586 WeakPolarHBondContact OD1-CA 3.35Å; D1584-T1586 VanDerWaalsContact OD1-CB 3.26Å; D1584-T1586 WeakPolarHBondContact OD1-CB 3.44Å; D1584-T1586 PolarHBondContact OD1-N 2.71Å; D1584-K1587 HydrophobicContact CB-CB 4.05Å; D1584-K1587 HydrophobicContact CB-CD 3.95Å; D1584-K1587 HydrophobicContact CB-CG 4.03Å; D1584-K1587 WeakPolarHBondContact O-CB 3.27Å; D1584-K1587 PolarHBondContact O-N 3.17Å; D1584-K1587 PolarHBondContact OD1-N 2.64Å; D1584-K1587 VanDerWaalsContact OD1-N 3.1Å; D1584-K1587 VanDerWaalsContact OD2-CE 3.3Å; D1584-K1587 WeakPolarHBondContact OD2-CE 3.39Å; D1584-K1587 WeakPolarHBondContact OD2-CG 3.31Å; D1584-L1588 PolarHBondContact O-N 3.07Å
1585	L	58	Low	51.8	Low	11 Å²	11	52.6 Å²	52.6	6%	0.058	28%	0.284	C	S	.	.	H	α-helix	trans	-55.7	-29.7	177.8	-69.7	163.1	0	0	0	112.5	K1569 I1571 I1583 L1588 S1589 I1636	K1569-L1585 HydrophobicContact CB-CB 4.08Å; K1569-L1585 HydrophobicContact CB-CD1 3.81Å; K1569-L1585 WeakPolarHBondContact O-CB 3.27Å; K1569-L1585 PolarHBondContact O-N 3.21Å; I1571-L1585 HydrophobicContact CD1-CD1 3.82Å; I1571-L1585 HydrophobicContact CD1-CD2 3.77Å; I1571-L1585 HydrophobicContact CD1-CG 3.96Å; I1571-L1585 HydrophobicContact CG1-CD1 3.54Å; I1571-L1585 HydrophobicContact CG1-CD2 4.25Å; I1571-L1585 HydrophobicContact CG1-CG 3.86Å; I1583-L1585 PolarHBondContact O-N 2.86Å; L1585-L1588 PolarHBondContact O-N 3.45Å; L1585-S1589 WeakPolarHBondContact O-CB 3.48Å; L1585-S1589 PolarHBondContact O-N 3.07Å; L1585-I1636 HydrophobicContact CB-CD1 4.5Å; L1585-I1636 HydrophobicContact CD1-CD1 3.59Å; L1585-I1636 HydrophobicContact CD1-CG2 4.26Å; L1585-I1636 HydrophobicContact CD2-CD1 3.78Å; L1585-I1636 HydrophobicContact CG-CD1 4.17Å
1586	T	57.6	Low	52.4	Low	7 Å²	7	53.8 Å²	53.8	4%	0.043	30%	0.299	C	S	.	.	H	α-helix	trans	-74.3	-36.7	179.5	-56.5	0	0	0	0	110.6	S1566 C1567 T1568 K1569 D1584 N1590	S1566-T1586 VanDerWaalsContact CB-CG2 3.47Å; S1566-T1586 WeakPolarHBondContact OG-CG2 3.29Å; C1567-T1586 PolarHBondContact O-OG1 2.69Å; T1568-T1586 WeakPolarHBondContact CA-OG1 3.42Å; K1569-T1586 PolarHBondContact N-OG1 3.49Å; K1569-T1586 VanDerWaalsContact N-OG1 3.09Å; D1584-T1586 PolarHBondContact O-N 3.41Å; D1584-T1586 VanDerWaalsContact O-N 3.15Å; D1584-T1586 WeakPolarHBondContact OD1-CA 3.35Å; D1584-T1586 VanDerWaalsContact OD1-CB 3.26Å; D1584-T1586 WeakPolarHBondContact OD1-CB 3.44Å; D1584-T1586 PolarHBondContact OD1-N 2.71Å; T1586-N1590 PolarHBondContact O-N 2.71Å; T1586-N1590 PolarHBondContact O-ND2 3.16Å
1587	K	60	Low	53.2	Low	123 Å²	123	55 Å²	55	54%	0.535	30%	0.302	S	S	.	.	H	α-helix	trans	-65.5	-45.5	167.4	-73.3	-180	-167	174.8	0	111.3	I1357 D1584 S1589 N1590 A1591	I1357-K1587 HydrophobicContact CD1-CB 3.81Å; I1357-K1587 HydrophobicContact CD1-CG 4.5Å; D1584-K1587 HydrophobicContact CB-CB 4.05Å; D1584-K1587 HydrophobicContact CB-CD 3.95Å; D1584-K1587 HydrophobicContact CB-CG 4.03Å; D1584-K1587 WeakPolarHBondContact O-CB 3.27Å; D1584-K1587 PolarHBondContact O-N 3.17Å; D1584-K1587 PolarHBondContact OD1-N 2.64Å; D1584-K1587 VanDerWaalsContact OD1-N 3.1Å; D1584-K1587 VanDerWaalsContact OD2-CE 3.3Å; D1584-K1587 WeakPolarHBondContact OD2-CE 3.39Å; D1584-K1587 WeakPolarHBondContact OD2-CG 3.31Å; K1587-S1589 PolarHBondContact O-N 2.79Å; K1587-N1590 PolarHBondContact O-N 3.04Å; K1587-A1591 WeakPolarHBondContact O-CB 3.22Å; K1587-A1591 PolarHBondContact O-N 3.08Å
1588	L	63.2	Low	53.7	Low	10 Å²	10	52 Å²	52	5%	0.052	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-43.3	-179.5	-170.9	64.4	0	0	0	112.6	W1365 L1369 I1583 D1584 L1585 N1590 A1591 L1592	W1365-L1588 HydrophobicContact CE3-CD1 4.42Å; W1365-L1588 HydrophobicContact CZ3-CD1 3.88Å; L1369-L1588 HydrophobicContact CD1-CD2 3.92Å; L1369-L1588 HydrophobicContact CD2-CD1 4.24Å; L1369-L1588 HydrophobicContact CD2-CD2 4.21Å; I1583-L1588 HydrophobicContact CG2-CD2 4.37Å; D1584-L1588 PolarHBondContact O-N 3.07Å; L1585-L1588 PolarHBondContact O-N 3.45Å; L1588-N1590 PolarHBondContact O-N 3.4Å; L1588-A1591 WeakPolarHBondContact O-CB 3.28Å; L1588-A1591 PolarHBondContact O-N 3.24Å; L1588-L1592 HydrophobicContact CD1-CD1 4.23Å; L1588-L1592 HydrophobicContact CD1-CG 4.5Å; L1588-L1592 HydrophobicContact CG-CD1 3.98Å; L1588-L1592 WeakPolarHBondContact O-CD1 3.46Å; L1588-L1592 PolarHBondContact O-N 3.22Å
1589	S	62.2	Low	53.9	Low	16 Å²	16	49.6 Å²	49.6	11%	0.112	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-36.5	175.4	163.8	0	0	0	0	112.9	L1585 K1587 G1593 L1629	L1585-S1589 WeakPolarHBondContact O-CB 3.48Å; L1585-S1589 PolarHBondContact O-N 3.07Å; K1587-S1589 PolarHBondContact O-N 2.79Å; S1589-G1593 PolarHBondContact O-N 2.79Å; S1589-L1629 WeakPolarHBondContact O-CD2 3.41Å; S1589-L1629 PolarHBondContact OG-O 3.25Å; S1589-L1629 VanDerWaalsContact OG-O 3.07Å
1590	N	59.5	Low	54.1	Low	97 Å²	97	50.1 Å²	50.1	52%	0.519	27%	0.266	S	S	.	.	H	α-helix	trans	-70.6	-42.1	171	-68.5	-55.3	0	0	0	111.1	T1586 K1587 L1588 G1593 D1594	T1586-N1590 PolarHBondContact O-N 2.71Å; T1586-N1590 PolarHBondContact O-ND2 3.16Å; K1587-N1590 PolarHBondContact O-N 3.04Å; L1588-N1590 PolarHBondContact O-N 3.4Å; N1590-G1593 CarbonylContact O-C 3.3Å; N1590-G1593 VanDerWaalsContact O-CA 3.24Å; N1590-G1593 WeakPolarHBondContact O-CA 3.13Å; N1590-G1593 PolarHBondContact O-N 3.05Å; N1590-D1594 PolarHBondContact O-N 3.09Å; N1590-D1594 VanDerWaalsContact O-N 3.13Å
1591	A	62.3	Low	53.6	Low	11 Å²	11	52.4 Å²	52.4	9%	0.091	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-54	-175.4	0	0	0	0	0	113.1	I1357 W1365 K1587 L1588 G1593 D1594	I1357-A1591 HydrophobicContact CB-CB 3.6Å; I1357-A1591 HydrophobicContact CD1-CB 3.95Å; I1357-A1591 HydrophobicContact CG1-CB 4.39Å; I1357-A1591 HydrophobicContact CG2-CB 3.57Å; W1365-A1591 HydrophobicContact CH2-CB 3.68Å; W1365-A1591 HydrophobicContact CZ2-CB 3.97Å; W1365-A1591 HydrophobicContact CZ3-CB 4.36Å; K1587-A1591 WeakPolarHBondContact O-CB 3.22Å; K1587-A1591 PolarHBondContact O-N 3.08Å; L1588-A1591 WeakPolarHBondContact O-CB 3.28Å; L1588-A1591 PolarHBondContact O-N 3.24Å; A1591-G1593 PolarHBondContact O-N 2.74Å; A1591-D1594 PolarHBondContact O-N 3.44Å
1592	L	63.9	Low	53	Low	13 Å²	13	55.5 Å²	55.5	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-67.9	-23.5	176.5	-28.7	120	0	0	0	110	W1365 L1369 L1588 D1594 I1595 L1629 F1773	W1365-L1592 HydrophobicContact CH2-CB 4.07Å; W1365-L1592 HydrophobicContact CH2-CD2 3.65Å; W1365-L1592 HydrophobicContact CH2-CG 3.56Å; W1365-L1592 HydrophobicContact CZ3-CD2 3.44Å; W1365-L1592 VanDerWaalsContact CZ3-CD2 3.44Å; W1365-L1592 HydrophobicContact CZ3-CG 3.65Å; L1369-L1592 HydrophobicContact CD2-CD1 4.47Å; L1369-L1592 HydrophobicContact CD2-CD2 4.11Å; L1588-L1592 HydrophobicContact CD1-CD1 4.23Å; L1588-L1592 HydrophobicContact CD1-CG 4.5Å; L1588-L1592 HydrophobicContact CG-CD1 3.98Å; L1588-L1592 WeakPolarHBondContact O-CD1 3.46Å; L1588-L1592 PolarHBondContact O-N 3.22Å; L1592-D1594 PolarHBondContact O-N 3.33Å; L1592-I1595 HydrophobicContact CB-CD1 3.79Å; L1592-I1595 HydrophobicContact CB-CG1 4.48Å; L1592-I1595 HydrophobicContact CD2-CD1 4.06Å; L1592-I1595 HydrophobicContact CG-CD1 4.39Å; L1592-I1595 WeakPolarHBondContact O-CB 3.29Å; L1592-I1595 PolarHBondContact O-N 3.35Å; L1592-L1629 HydrophobicContact CB-CD1 3.71Å; L1592-L1629 HydrophobicContact CB-CD2 3.38Å; L1592-L1629 HydrophobicContact CB-CG 3.99Å; L1592-L1629 HydrophobicContact CD1-CD2 3.54Å; L1592-L1629 HydrophobicContact CG-CD2 4.02Å; L1592-L1629 WeakPolarHBondContact O-CD1 3.44Å; L1592-F1773 HydrophobicContact CD2-CD2 4.48Å; L1592-F1773 HydrophobicContact CD2-CE1 4.44Å; L1592-F1773 HydrophobicContact CD2-CE2 3.54Å; L1592-F1773 HydrophobicContact CD2-CZ 3.52Å
1593	G	62.4	Low	52.2	Low	27 Å²	27	56.5 Å²	56.5	28%	0.278	31%	0.305	S	S	.	.	H	α-helix	trans	-64.9	-14	172.5	0	0	0	0	0	114.9	S1589 N1590 A1591 K1597	S1589-G1593 PolarHBondContact O-N 2.79Å; N1590-G1593 CarbonylContact O-C 3.3Å; N1590-G1593 VanDerWaalsContact O-CA 3.24Å; N1590-G1593 WeakPolarHBondContact O-CA 3.13Å; N1590-G1593 PolarHBondContact O-N 3.05Å; A1591-G1593 PolarHBondContact O-N 2.74Å; G1593-K1597 PolarHBondContact O-NZ 2.7Å
1594	D	60.4	Low	50.9	Low	83 Å²	83	61.5 Å²	61.5	44%	0.444	34%	0.337	S	S	.	.	H	α-helix	trans	-98.7	-15.4	171.1	-72.1	-40.5	0	0	0	113	N1590 A1591 L1592 G1596 K1597	N1590-D1594 PolarHBondContact O-N 3.09Å; N1590-D1594 VanDerWaalsContact O-N 3.13Å; A1591-D1594 PolarHBondContact O-N 3.44Å; L1592-D1594 PolarHBondContact O-N 3.33Å; D1594-G1596 PolarHBondContact O-N 3.04Å; D1594-K1597 WeakPolarHBondContact O-CB 3.1Å; D1594-K1597 PolarHBondContact O-N 2.96Å; D1594-K1597 IonicContact OD1-NZ 2.77Å; D1594-K1597 PolarHBondContact OD1-NZ 2.79Å
1595	I	60.9	Low	49.4	Very low	13 Å²	13	66.9 Å²	66.9	7%	0.067	37%	0.371	C	S	.	.	H	α-helix	trans	-63.6	-39.4	176.6	-63.2	173.8	0	0	0	111.9	A1362 W1365 C1366 L1592 K1597 E1598 Y1599	A1362-I1595 HydrophobicContact CB-CD1 4.15Å; A1362-I1595 HydrophobicContact CB-CG1 3.92Å; W1365-I1595 HydrophobicContact CH2-CD1 3.74Å; W1365-I1595 HydrophobicContact CH2-CG1 4.37Å; W1365-I1595 HydrophobicContact CZ2-CD1 3.86Å; W1365-I1595 HydrophobicContact CZ2-CG1 4.14Å; C1366-I1595 WeakPolarHBondContact SG-CD1 3.41Å; L1592-I1595 HydrophobicContact CB-CD1 3.79Å; L1592-I1595 HydrophobicContact CB-CG1 4.48Å; L1592-I1595 HydrophobicContact CD2-CD1 4.06Å; L1592-I1595 HydrophobicContact CG-CD1 4.39Å; L1592-I1595 WeakPolarHBondContact O-CB 3.29Å; L1592-I1595 PolarHBondContact O-N 3.35Å; I1595-K1597 PolarHBondContact O-N 2.88Å; I1595-E1598 PolarHBondContact O-N 3.5Å; I1595-Y1599 HydrophobicContact CG2-CD2 3.87Å; I1595-Y1599 HydrophobicContact CG2-CE2 3.55Å
1596	G	52.6	Low	48.1	Very low	36 Å²	36	72.5 Å²	72.5	37%	0.371	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-0.6	174.6	0	0	0	0	0	114.4	D1594	D1594-G1596 PolarHBondContact O-N 3.04Å
1597	K	48.2	Very low	46.8	Very low	115 Å²	115	77.7 Å²	77.7	50%	0.5	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-11.1	174.1	-48.9	175.6	-178.1	99.2	0	112.9	G1593 D1594 I1595	G1593-K1597 PolarHBondContact O-NZ 2.7Å; D1594-K1597 WeakPolarHBondContact O-CB 3.1Å; D1594-K1597 PolarHBondContact O-N 2.96Å; D1594-K1597 IonicContact OD1-NZ 2.77Å; D1594-K1597 PolarHBondContact OD1-NZ 2.79Å; I1595-K1597 PolarHBondContact O-N 2.88Å
1598	E	43.4	Very low	45.3	Very low	24 Å²	24	77.4 Å²	77.4	11%	0.112	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-48.6	175.5	-71.1	-148.6	88.7	0	0	112	R1360 I1595 S1600 L1601	R1360-E1598 WeakPolarHBondContact CD-OE1 3.33Å; R1360-E1598 WeakPolarHBondContact CG-OE1 3.26Å; R1360-E1598 VanDerWaalsContact CZ-CD 3.41Å; R1360-E1598 IonicContact CZ-OE1 2.83Å; R1360-E1598 IonicContact NE-OE1 2.67Å; R1360-E1598 PolarHBondContact NE-OE1 3.21Å; R1360-E1598 IonicContact NH1-OE1 2.75Å; R1360-E1598 PolarHBondContact NH1-OE1 3.09Å; R1360-E1598 IonicContact NH2-OE1 3.07Å; I1595-E1598 PolarHBondContact O-N 3.5Å; E1598-S1600 PolarHBondContact O-N 3.19Å; E1598-L1601 PolarHBondContact O-N 2.91Å
1599	Y	38.7	Very low	43.7	Very low	103 Å²	103	82.6 Å²	82.6	40%	0.404	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.9	179.5	-66.3	-72	0	0	0	114.3	I1595 Q1623	I1595-Y1599 HydrophobicContact CG2-CD2 3.87Å; I1595-Y1599 HydrophobicContact CG2-CE2 3.55Å; Y1599-Q1623 PolarHBondContact O-NE2 2.92Å
1600	S	34.9	Very low	42.1	Very low	68 Å²	68	86.8 Å²	86.8	48%	0.476	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	2.4	171.2	-141.7	0	0	0	0	113.6	E1598 Q1623	E1598-S1600 PolarHBondContact O-N 3.19Å; S1600-Q1623 PolarHBondContact OG-NE2 3.36Å; S1600-Q1623 PolarHBondContact OG-OE1 3Å
1601	L	32.6	Very low	40.6	Very low	108 Å²	108	86 Å²	86	57%	0.565	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-8.8	-174.1	-139.6	77.1	0	0	0	115.2	E1598	E1598-L1601 PolarHBondContact O-N 2.91Å
1602	N	31.3	Very low	39.1	Very low	122 Å²	122	89.7 Å²	89.7	65%	0.652	52%	0.521	S	S	*	.	S	Bend	trans	-89.1	-0.7	-174.1	-77.1	2.1	0	0	0	115.2
1603	N	30.1	Very low	37.4	Very low	152 Å²	152	94.2 Å²	94.2	81%	0.813	55%	0.55	S	S	*	.	S	Bend	trans	-106.5	57.3	176.8	-79.6	9.6	0	0	0	112.5
1604	T	27.5	Very low	35.7	Very low	130 Å²	130	99.2 Å²	99.2	80%	0.798	57%	0.57	S	S	*	*			trans	-159.7	82.7	162.1	-9.1	0	0	0	0	114.9
1605	T	28.2	Very low	34.1	Very low	135 Å²	135	102.8 Å²	102.8	83%	0.828	59%	0.589	S	S	*	*			trans	-144	77.3	156.3	47.1	0	0	0	0	112.4
1606	T	30.7	Very low	32.4	Very low	130 Å²	130	106.6 Å²	106.6	80%	0.798	62%	0.616	S	S	*	*	S	Bend	trans	-169.1	115.7	130.4	25	0	0	0	0	112.2
1607	T	29.1	Very low	31.1	Very low	116 Å²	116	108.9 Å²	108.9	71%	0.712	63%	0.627	S	S	*	*			trans	55.6	110	141.8	54.8	0	0	0	0	122.8
1608	T	29.2	Very low	30	Very low	117 Å²	117	107.3 Å²	107.3	72%	0.718	62%	0.624	S	S	*	*				72.2	117.6	127.4	58.1	0	0	0	0	122.4
1609	T	29.3	Very low	29.2	Very low	119 Å²	119	114 Å²	114	73%	0.73	66%	0.66	S	S	*	*			trans	42	127.3	133.9	61.9	0	0	0	0	119
1610	T	29.2	Very low	28.8	Very low	104 Å²	104	118 Å²	118	64%	0.638	68%	0.683	S	S	*	*			cis	-173.9	173.8	14.1	5.4	0	0	0	0	107.9
1611	N	28.6	Very low	28.4	Very low	79 Å²	79	121 Å²	121	42%	0.422	69%	0.693	S	S	.	*			cis	-148.2	-168.3	5.4	-150.2	0.7	0	0	0	113.2	Y78	Y78-N1611 PolarHBondContact OH-ND2 2.83Å
1612	T	30.5	Very low	28.4	Very low	89 Å²	89	124 Å²	124	55%	0.546	71%	0.71	S	S	.	*			trans	-46.8	133.4	173.1	46.9	0	0	0	0	120
1613	T	28.3	Very low	28.6	Very low	109 Å²	109	122.8 Å²	122.8	67%	0.669	70%	0.7	S	S	*	*			trans	64.6	137	136.7	62.3	0	0	0	0	120.5
1614	N	26.7	Very low	29	Very low	132 Å²	132	118.4 Å²	118.4	71%	0.706	68%	0.682	S	S	*	*			cis	-161	148.8	-1.4	-109.4	-10.2	0	0	0	111.7
1615	N	25.7	Very low	29.5	Very low	158 Å²	158	117.5 Å²	117.5	85%	0.845	68%	0.676	S	S	*	*			trans	65.6	141.3	169.6	-52.5	-25.7	0	0	0	115.8
1616	S	25	Very low	30.4	Very low	92 Å²	92	113 Å²	113	64%	0.643	64%	0.644	S	S	*	*			cis	-143.8	-151.9	5.1	78.8	0	0	0	0	111.8
1617	S	25.8	Very low	31.3	Very low	85 Å²	85	109.6 Å²	109.6	59%	0.594	62%	0.624	S	S	*	*			trans	55.9	115.8	-170.1	35.6	0	0	0	0	115.3
1618	N	25.5	Very low	32.4	Very low	81 Å²	81	104.4 Å²	104.4	43%	0.433	59%	0.592	S	S	.	*				67.4	86.2	73.6	-75.3	5	0	0	0	114	Q216 K217	Q216-N1618 PolarHBondContact OE1-ND2 2.97Å; K217-N1618 PolarHBondContact NZ-OD1 3.13Å
1619	D	25.5	Very low	33.4	Very low	164 Å²	164	100 Å²	100	88%	0.877	56%	0.563	S	S	*	*				-151.8	123.8	126.2	-104.4	-29.1	0	0	0	109.7
1620	H	30	Very low	34.4	Very low	188 Å²	188	102.3 Å²	102.3	87%	0.87	57%	0.566	S	S	*	*			trans	-96.2	106.9	-179.2	-102	-71.7	0	0	0	110.2	N1622	H1620-N1622 PolarHBondContact O-N 3Å
1621	N	28.1	Very low	35.5	Very low	130 Å²	130	100.5 Å²	100.5	70%	0.695	55%	0.548	S	S	*	.			trans	-58.3	129.2	170.3	-77.1	-68.4	0	0	0	111.2	Q1623	N1621-Q1623 PolarHBondContact O-N 3.26Å
1622	N	31.5	Very low	36.8	Very low	172 Å²	172	97.4 Å²	97.4	92%	0.92	53%	0.532	S	S	*	.			trans	-66.6	93.2	165.6	-85.8	-23.9	0	0	0	109.9	H1620	H1620-N1622 PolarHBondContact O-N 3Å
1623	Q	36.6	Very low	37.9	Very low	97 Å²	97	96.2 Å²	96.2	45%	0.453	52%	0.522	S	S	.	.			trans	-106.1	108.6	164	-76.1	-174.1	2.2	0	0	109.6	Y1599 S1600 N1621 T1625	Y1599-Q1623 PolarHBondContact O-NE2 2.92Å; S1600-Q1623 PolarHBondContact OG-NE2 3.36Å; S1600-Q1623 PolarHBondContact OG-OE1 3Å; N1621-Q1623 PolarHBondContact O-N 3.26Å; Q1623-T1625 PolarHBondContact O-N 3.22Å
1624	S	37	Very low	39.3	Very low	60 Å²	60	92.6 Å²	92.6	42%	0.42	50%	0.503	S	S	.	.			trans	-74.2	83.9	-177.5	42.9	0	0	0	0	112.2	Y1626	S1624-Y1626 VanDerWaalsContact CB-CZ 3.48Å; S1624-Y1626 WeakPolarHBondContact CB-OH 3.46Å; S1624-Y1626 WeakPolarHBondContact O-CD2 3.38Å; S1624-Y1626 WeakPolarHBondContact O-CE2 3.35Å; S1624-Y1626 PolarHBondContact O-N 3.21Å; S1624-Y1626 VanDerWaalsContact OG-CZ 3.29Å; S1624-Y1626 PolarHBondContact OG-OH 3.45Å
1625	T	37.8	Very low	40.8	Very low	110 Å²	110	86.3 Å²	86.3	68%	0.675	47%	0.47	S	S	*	.			trans	-72.3	87.7	166.4	36.8	0	0	0	0	111.2	Q1623 P1627	Q1623-T1625 PolarHBondContact O-N 3.22Å; T1625-P1627 WeakPolarHBondContact O-CD 3.2Å
1626	Y	48.9	Very low	42.5	Very low	42 Å²	42	79.5 Å²	79.5	17%	0.165	43%	0.433	C	S	.	.			trans	-63.3	112.3	178.9	-51.9	-82.5	0	0	0	112.8	S1624 I1628 T1769 H1772 D1776	S1624-Y1626 VanDerWaalsContact CB-CZ 3.48Å; S1624-Y1626 WeakPolarHBondContact CB-OH 3.46Å; S1624-Y1626 WeakPolarHBondContact O-CD2 3.38Å; S1624-Y1626 WeakPolarHBondContact O-CE2 3.35Å; S1624-Y1626 PolarHBondContact O-N 3.21Å; S1624-Y1626 VanDerWaalsContact OG-CZ 3.29Å; S1624-Y1626 PolarHBondContact OG-OH 3.45Å; Y1626-I1628 PolarHBondContact O-N 2.81Å; Y1626-T1769 HydrophobicContact CD1-CG2 4.41Å; Y1626-H1772 HydrophobicContact CE1-CB 4.41Å; Y1626-D1776 WeakPolarHBondContact CE1-OD2 2.75Å; Y1626-D1776 WeakPolarHBondContact OH-CB 3.5Å; Y1626-D1776 VanDerWaalsContact OH-CG 3.3Å; Y1626-D1776 PolarHBondContact OH-OD2 2.97Å
1627	P	49	Very low	44.1	Very low	57 Å²	57	77.6 Å²	77.6	37%	0.37	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.2	-177.9	-23.1	37.2	0	0	0	114.9	T1625 L1629 Q1630 Y1631	T1625-P1627 WeakPolarHBondContact O-CD 3.2Å; P1627-L1629 PolarHBondContact O-N 3.42Å; P1627-Q1630 PolarHBondContact O-N 3.36Å; P1627-Y1631 HydrophobicContact CB-CD2 4.14Å; P1627-Y1631 HydrophobicContact CB-CE2 3.84Å; P1627-Y1631 PolarHBondContact O-N 2.54Å
1628	I	51.9	Low	45.7	Very low	8 Å²	8	78.1 Å²	78.1	4%	0.041	41%	0.413	C	S	.	.	H	α-helix	trans	-49.2	-19.1	-175.3	-168.8	158	0	0	0	114.9	Y1626 Y1631 L1632 F1766 T1769 W1770	Y1626-I1628 PolarHBondContact O-N 2.81Å; I1628-Y1631 CarbonylContact O-C 3.43Å; I1628-Y1631 PolarHBondContact O-N 3.14Å; I1628-L1632 WeakPolarHBondContact O-CB 3.39Å; I1628-L1632 PolarHBondContact O-N 2.78Å; I1628-F1766 HydrophobicContact CD1-CD2 4.49Å; I1628-F1766 HydrophobicContact CD1-CE1 4.01Å; I1628-F1766 HydrophobicContact CD1-CE2 3.93Å; I1628-F1766 HydrophobicContact CD1-CZ 3.64Å; I1628-F1766 HydrophobicContact CG1-CD2 4.03Å; I1628-F1766 HydrophobicContact CG1-CE1 4.45Å; I1628-F1766 HydrophobicContact CG1-CE2 3.46Å; I1628-F1766 VanDerWaalsContact CG1-CE2 3.46Å; I1628-F1766 HydrophobicContact CG1-CZ 3.69Å; I1628-T1769 HydrophobicContact CB-CG2 3.59Å; I1628-T1769 HydrophobicContact CG2-CG2 3.94Å; I1628-W1770 VanDerWaalsContact CD1-CA 3.43Å; I1628-W1770 HydrophobicContact CD1-CB 3.51Å; I1628-W1770 HydrophobicContact CD1-CD2 4.29Å; I1628-W1770 HydrophobicContact CD1-CE3 3.69Å; I1628-W1770 HydrophobicContact CD1-CG 4.28Å
1629	L	49.6	Very low	47.6	Very low	23 Å²	23	74.3 Å²	74.3	12%	0.12	39%	0.392	C	S	.	.	H	α-helix	trans	-88.6	-29.1	-173.1	-72.8	146.1	0	0	0	114.1	S1589 L1592 P1627 Y1631	S1589-L1629 WeakPolarHBondContact O-CD2 3.41Å; S1589-L1629 PolarHBondContact OG-O 3.25Å; S1589-L1629 VanDerWaalsContact OG-O 3.07Å; L1592-L1629 HydrophobicContact CB-CD1 3.71Å; L1592-L1629 HydrophobicContact CB-CD2 3.38Å; L1592-L1629 HydrophobicContact CB-CG 3.99Å; L1592-L1629 HydrophobicContact CD1-CD2 3.54Å; L1592-L1629 HydrophobicContact CG-CD2 4.02Å; L1592-L1629 WeakPolarHBondContact O-CD1 3.44Å; P1627-L1629 PolarHBondContact O-N 3.42Å; L1629-Y1631 VanDerWaalsContact C-N 3.32Å
1630	Q	50.7	Low	49.3	Very low	169 Å²	169	67 Å²	67	79%	0.79	36%	0.356	S	S	*	.	H	α-helix	trans	-75.6	-31.4	165.2	-50.2	-167	38.5	0	0	109.4	P1627	P1627-Q1630 PolarHBondContact O-N 3.36Å
1631	Y	53.2	Low	50.9	Low	66 Å²	66	64 Å²	64	26%	0.259	35%	0.347	S	S	.	.	H	α-helix	trans	-80.4	-34.9	179.3	-61.4	-31.5	0	0	0	115.1	P1627 I1628 L1629 D1633 A1634 Y1635 W1762 E1765	P1627-Y1631 HydrophobicContact CB-CD2 4.14Å; P1627-Y1631 HydrophobicContact CB-CE2 3.84Å; P1627-Y1631 PolarHBondContact O-N 2.54Å; I1628-Y1631 CarbonylContact O-C 3.43Å; I1628-Y1631 PolarHBondContact O-N 3.14Å; L1629-Y1631 VanDerWaalsContact C-N 3.32Å; Y1631-D1633 PolarHBondContact O-N 3.14Å; Y1631-A1634 CarbonylContact O-C 3.58Å; Y1631-A1634 WeakPolarHBondContact O-CA 3.23Å; Y1631-A1634 WeakPolarHBondContact O-CB 3.38Å; Y1631-A1634 PolarHBondContact O-N 3.02Å; Y1631-Y1635 VanDerWaalsContact O-CB 3.27Å; Y1631-Y1635 WeakPolarHBondContact O-CB 3.23Å; Y1631-Y1635 PolarHBondContact O-N 3.45Å; Y1631-W1762 HydrophobicContact CD1-CZ2 4.12Å; Y1631-W1762 AromaticContact CD1-NE1 3.44Å; Y1631-W1762 AromaticContact CE1-NE1 3.5Å; Y1631-W1762 HydrophobicContact CG-CZ2 4.43Å; Y1631-W1762 AromaticContact CG-NE1 3.78Å; Y1631-W1762 AromaticContact CZ-NE1 3.84Å; Y1631-E1765 HydrophobicContact CE2-CB 4.45Å; Y1631-E1765 WeakPolarHBondContact CE2-OE2 3.26Å; Y1631-E1765 PolarHBondContact OH-OE2 3.43Å
1632	L	56	Low	52.5	Low	14 Å²	14	59.3 Å²	59.3	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-57.4	-50.9	-172.6	-171.2	72.4	0	0	0	112.8	I1628 A1634 Y1635 I1636 F1766	I1628-L1632 WeakPolarHBondContact O-CB 3.39Å; I1628-L1632 PolarHBondContact O-N 2.78Å; L1632-A1634 VanDerWaalsContact C-N 3.29Å; L1632-A1634 PolarHBondContact O-N 2.87Å; L1632-Y1635 PolarHBondContact O-N 3.1Å; L1632-I1636 HydrophobicContact CD1-CD1 3.91Å; L1632-I1636 HydrophobicContact CD1-CG1 4.43Å; L1632-I1636 HydrophobicContact CG-CD1 3.79Å; L1632-I1636 WeakPolarHBondContact O-CB 3.01Å; L1632-I1636 WeakPolarHBondContact O-CG1 3.48Å; L1632-I1636 PolarHBondContact O-N 3.16Å; L1632-F1766 HydrophobicContact CB-CE2 4.28Å; L1632-F1766 HydrophobicContact CD1-CE2 3.8Å; L1632-F1766 HydrophobicContact CD1-CZ 3.63Å
1633	D	52.5	Low	54.2	Low	63 Å²	63	51.2 Å²	51.2	34%	0.337	28%	0.276	S	S	.	.	H	α-helix	trans	-69.1	-29.7	179.1	-165	32.2	0	0	0	112	K1569 Y1631 S1637	K1569-D1633 WeakPolarHBondContact CD-OD1 3.39Å; K1569-D1633 WeakPolarHBondContact CE-OD1 3.29Å; K1569-D1633 PolarHBondContact NZ-O 3.06Å; K1569-D1633 IonicContact NZ-OD1 3.63Å; K1569-D1633 PolarHBondContact NZ-OD1 2.78Å; Y1631-D1633 PolarHBondContact O-N 3.14Å; D1633-S1637 VanDerWaalsContact O-CB 3.3Å; D1633-S1637 WeakPolarHBondContact O-CB 3.38Å; D1633-S1637 PolarHBondContact O-N 3.3Å
1634	A	58.2	Low	55.1	Low	34 Å²	34	47.2 Å²	47.2	28%	0.281	26%	0.26	S	S	.	.	H	α-helix	trans	-69.5	-48.3	172.9	0	0	0	0	0	111.7	Y1631 L1632 S1637 Q1638 W1762	Y1631-A1634 CarbonylContact O-C 3.58Å; Y1631-A1634 WeakPolarHBondContact O-CA 3.23Å; Y1631-A1634 WeakPolarHBondContact O-CB 3.38Å; Y1631-A1634 PolarHBondContact O-N 3.02Å; L1632-A1634 VanDerWaalsContact C-N 3.29Å; L1632-A1634 PolarHBondContact O-N 2.87Å; A1634-S1637 CarbonylContact O-C 3.44Å; A1634-S1637 WeakPolarHBondContact O-CA 3.42Å; A1634-S1637 WeakPolarHBondContact O-CB 3.36Å; A1634-S1637 PolarHBondContact O-N 3Å; A1634-Q1638 WeakPolarHBondContact O-CG 3.22Å; A1634-Q1638 PolarHBondContact O-N 3.39Å; A1634-W1762 HydrophobicContact CB-CH2 3.96Å; A1634-W1762 HydrophobicContact CB-CZ2 3.94Å
1635	Y	59.1	Low	56.3	Low	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-48.4	-176.2	-174.4	-97.5	0	0	0	110.4	P1483 I1487 Y1631 L1632 S1637 Q1638 L1639 Y1653 F1759 W1762 F1766	P1483-Y1635 HydrophobicContact CB-CD1 4.49Å; P1483-Y1635 HydrophobicContact CB-CE1 4.03Å; I1487-Y1635 HydrophobicContact CD1-CD1 3.66Å; I1487-Y1635 HydrophobicContact CD1-CE1 3.67Å; Y1631-Y1635 VanDerWaalsContact O-CB 3.27Å; Y1631-Y1635 WeakPolarHBondContact O-CB 3.23Å; Y1631-Y1635 PolarHBondContact O-N 3.45Å; L1632-Y1635 PolarHBondContact O-N 3.1Å; Y1635-S1637 PolarHBondContact O-N 3.22Å; Y1635-Q1638 PolarHBondContact O-N 3.01Å; Y1635-L1639 HydrophobicContact CE1-CD2 4.1Å; Y1635-L1639 VanDerWaalsContact O-CB 3.25Å; Y1635-L1639 WeakPolarHBondContact O-CB 3.46Å; Y1635-L1639 PolarHBondContact O-N 3.39Å; Y1635-Y1653 PolarHBondContact OH-OH 3.31Å; Y1635-F1759 HydrophobicContact CE2-CZ 4.13Å; Y1635-W1762 AromaticContact CD2-CE3 3.99Å; Y1635-W1762 HydrophobicContact CD2-CE3 3.99Å; Y1635-W1762 HydrophobicContact CD2-CH2 4.06Å; Y1635-W1762 AromaticContact CD2-CZ3 3.63Å; Y1635-W1762 HydrophobicContact CD2-CZ3 3.63Å; Y1635-W1762 HydrophobicContact CG-CH2 4.43Å; Y1635-W1762 HydrophobicContact CG-CZ3 4.37Å; Y1635-F1766 HydrophobicContact CD2-CB 4.5Å; Y1635-F1766 HydrophobicContact CD2-CG 4.49Å; Y1635-F1766 HydrophobicContact CG-CD2 4.23Å; Y1635-F1766 HydrophobicContact CG-CG 4.42Å
1636	I	60.2	Low	58.1	Low	15 Å²	15	48.8 Å²	48.8	8%	0.077	25%	0.247	C	C	.	.	H	α-helix	trans	-60.8	-30.7	172.6	-60.9	176	0	0	0	111.2	I1487 K1569 L1585 L1632 G1640	I1487-I1636 HydrophobicContact CD1-CB 4.29Å; I1487-I1636 HydrophobicContact CD1-CG1 3.78Å; I1487-I1636 HydrophobicContact CG1-CB 4.11Å; I1487-I1636 HydrophobicContact CG1-CG1 3.66Å; I1487-I1636 HydrophobicContact CG1-CG2 4.07Å; K1569-I1636 HydrophobicContact CD-CB 4.4Å; K1569-I1636 HydrophobicContact CD-CG2 3.62Å; L1585-I1636 HydrophobicContact CB-CD1 4.5Å; L1585-I1636 HydrophobicContact CD1-CD1 3.59Å; L1585-I1636 HydrophobicContact CD1-CG2 4.26Å; L1585-I1636 HydrophobicContact CD2-CD1 3.78Å; L1585-I1636 HydrophobicContact CG-CD1 4.17Å; L1632-I1636 HydrophobicContact CD1-CD1 3.91Å; L1632-I1636 HydrophobicContact CD1-CG1 4.43Å; L1632-I1636 HydrophobicContact CG-CD1 3.79Å; L1632-I1636 WeakPolarHBondContact O-CB 3.01Å; L1632-I1636 WeakPolarHBondContact O-CG1 3.48Å; L1632-I1636 PolarHBondContact O-N 3.16Å; I1636-G1640 WeakPolarHBondContact O-CA 3.27Å; I1636-G1640 PolarHBondContact O-N 2.82Å
1637	S	58.4	Low	59.4	Low	51 Å²	51	49.1 Å²	49.1	36%	0.357	26%	0.255	S	S	.	.	H	α-helix	trans	-78.7	-36.8	175.6	-162.2	0	0	0	0	113.7	D1633 A1634 Y1635 N1641	D1633-S1637 VanDerWaalsContact O-CB 3.3Å; D1633-S1637 WeakPolarHBondContact O-CB 3.38Å; D1633-S1637 PolarHBondContact O-N 3.3Å; A1634-S1637 CarbonylContact O-C 3.44Å; A1634-S1637 WeakPolarHBondContact O-CA 3.42Å; A1634-S1637 WeakPolarHBondContact O-CB 3.36Å; A1634-S1637 PolarHBondContact O-N 3Å; Y1635-S1637 PolarHBondContact O-N 3.22Å; S1637-N1641 WeakPolarHBondContact O-CB 3.3Å; S1637-N1641 PolarHBondContact O-N 2.89Å; S1637-N1641 VanDerWaalsContact O-N 3.1Å; S1637-N1641 PolarHBondContact O-ND2 3.48Å; S1637-N1641 VanDerWaalsContact O-ND2 3.11Å
1638	Q	60.8	Low	61	Low	97 Å²	97	47.4 Å²	47.4	45%	0.453	24%	0.242	S	C	.	.	H	α-helix	trans	-79.3	-52.5	-178.1	-69.2	-172.7	15.2	0	0	110.4	A1634 Y1635 G1640 N1641 F1642 F1759 W1762	A1634-Q1638 WeakPolarHBondContact O-CG 3.22Å; A1634-Q1638 PolarHBondContact O-N 3.39Å; Y1635-Q1638 PolarHBondContact O-N 3.01Å; Q1638-G1640 PolarHBondContact O-N 3.07Å; Q1638-N1641 PolarHBondContact O-N 3.44Å; Q1638-N1641 VanDerWaalsContact O-N 3.1Å; Q1638-F1642 WeakPolarHBondContact O-CB 3.44Å; Q1638-F1642 PolarHBondContact O-N 3.02Å; Q1638-F1759 HydrophobicContact CB-CE2 3.87Å; Q1638-W1762 HydrophobicContact CB-CH2 4.46Å; Q1638-W1762 HydrophobicContact CB-CZ3 4.09Å; Q1638-W1762 HydrophobicContact CG-CH2 4.34Å; Q1638-W1762 HydrophobicContact CG-CZ3 4.3Å
1639	L	64.6	Low	62.5	Low	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56	-40.4	172	-160.6	82.3	0	0	0	111.1	V1484 I1487 Y1635 F1642 L1643 A1644 L1650 Y1653 F1759	V1484-L1639 HydrophobicContact CB-CD2 4.38Å; V1484-L1639 HydrophobicContact CG1-CD2 4.22Å; V1484-L1639 HydrophobicContact CG2-CD2 4.28Å; I1487-L1639 HydrophobicContact CB-CD2 4.01Å; I1487-L1639 HydrophobicContact CD1-CB 4.07Å; I1487-L1639 HydrophobicContact CD1-CD2 3.32Å; I1487-L1639 HydrophobicContact CD1-CG 4.29Å; I1487-L1639 HydrophobicContact CG1-CD2 4.23Å; I1487-L1639 HydrophobicContact CG2-CB 4.47Å; I1487-L1639 HydrophobicContact CG2-CD2 3.95Å; Y1635-L1639 HydrophobicContact CE1-CD2 4.1Å; Y1635-L1639 VanDerWaalsContact O-CB 3.25Å; Y1635-L1639 WeakPolarHBondContact O-CB 3.46Å; Y1635-L1639 PolarHBondContact O-N 3.39Å; L1639-F1642 PolarHBondContact O-N 3.18Å; L1639-L1643 HydrophobicContact CD1-CD1 3.33Å; L1639-L1643 HydrophobicContact CD1-CG 3.99Å; L1639-L1643 HydrophobicContact CG-CD1 3.93Å; L1639-L1643 HydrophobicContact CG-CG 4.32Å; L1639-L1643 PolarHBondContact O-N 2.9Å; L1639-A1644 PolarHBondContact O-N 3.2Å; L1639-L1650 HydrophobicContact CD2-CD1 4.37Å; L1639-Y1653 HydrophobicContact CD1-CD1 4.07Å; L1639-Y1653 HydrophobicContact CD1-CE1 3.72Å; L1639-F1759 HydrophobicContact CB-CZ 3.94Å; L1639-F1759 HydrophobicContact CD1-CE1 3.34Å; L1639-F1759 HydrophobicContact CD1-CZ 3.36Å; L1639-F1759 HydrophobicContact CG-CZ 4.28Å
1640	G	61.4	Low	64.1	Low	12 Å²	12	46.2 Å²	46.2	12%	0.124	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-41.4	176.2	0	0	0	0	0	113.7	I1636 Q1638	I1636-G1640 WeakPolarHBondContact O-CA 3.27Å; I1636-G1640 PolarHBondContact O-N 2.82Å; Q1638-G1640 PolarHBondContact O-N 3.07Å
1641	N	62.9	Low	65.8	Low	125 Å²	125	38.2 Å²	38.2	67%	0.668	20%	0.198	S	C	*	.	H	α-helix	trans	-79.5	-23.2	176.7	-72	-21.5	0	0	0	113.3	S1637 Q1638	S1637-N1641 WeakPolarHBondContact O-CB 3.3Å; S1637-N1641 PolarHBondContact O-N 2.89Å; S1637-N1641 VanDerWaalsContact O-N 3.1Å; S1637-N1641 PolarHBondContact O-ND2 3.48Å; S1637-N1641 VanDerWaalsContact O-ND2 3.11Å; Q1638-N1641 PolarHBondContact O-N 3.44Å; Q1638-N1641 VanDerWaalsContact O-N 3.1Å
1642	F	62.3	Low	67.5	Low	31 Å²	31	35 Å²	35	14%	0.136	19%	0.186	C	C	.	.	H	α-helix	trans	-95.3	-43	-171.7	-170.8	-115.2	0	0	0	113.2	Q1638 L1639 F1711 R1752 M1755 F1759	Q1638-F1642 WeakPolarHBondContact O-CB 3.44Å; Q1638-F1642 PolarHBondContact O-N 3.02Å; L1639-F1642 PolarHBondContact O-N 3.18Å; F1642-F1711 HydrophobicContact CE1-CZ 4.35Å; F1642-R1752 HydrophobicContact CD2-CG 4.29Å; F1642-R1752 HydrophobicContact CE2-CB 3.63Å; F1642-R1752 HydrophobicContact CE2-CG 3.6Å; F1642-R1752 HydrophobicContact CZ-CB 3.86Å; F1642-R1752 HydrophobicContact CZ-CG 4.31Å; F1642-M1755 HydrophobicContact CE2-CE 4.35Å; F1642-F1759 HydrophobicContact CD1-CD1 4.31Å; F1642-F1759 HydrophobicContact CD1-CE1 4.42Å; F1642-F1759 HydrophobicContact CE1-CD1 4.28Å
1643	L	66.9	Low	68.9	Low	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-37	-173.1	-52.4	-174.5	0	0	0	114.7	L1639 Y1645 H1646 L1649 L1650 Y1653 F1711	L1639-L1643 HydrophobicContact CD1-CD1 3.33Å; L1639-L1643 HydrophobicContact CD1-CG 3.99Å; L1639-L1643 HydrophobicContact CG-CD1 3.93Å; L1639-L1643 HydrophobicContact CG-CG 4.32Å; L1639-L1643 PolarHBondContact O-N 2.9Å; L1643-Y1645 PolarHBondContact O-N 2.82Å; L1643-H1646 PolarHBondContact O-N 2.77Å; L1643-L1649 HydrophobicContact CD2-CD2 3.9Å; L1643-L1649 HydrophobicContact CD2-CG 3.83Å; L1643-L1650 HydrophobicContact CB-CB 4.32Å; L1643-L1650 HydrophobicContact CB-CD1 3.85Å; L1643-L1650 HydrophobicContact CD1-CD1 3.68Å; L1643-L1650 HydrophobicContact CG-CD1 4.44Å; L1643-Y1653 HydrophobicContact CD1-CD1 3.75Å; L1643-Y1653 HydrophobicContact CD1-CD2 4.17Å; L1643-Y1653 HydrophobicContact CD1-CE1 4.49Å; L1643-Y1653 HydrophobicContact CD1-CG 3.56Å; L1643-F1711 HydrophobicContact CD2-CE2 4.14Å; L1643-F1711 HydrophobicContact CD2-CZ 4.11Å
1644	A	55.8	Low	70.6	Confident	13 Å²	13	31.4 Å²	31.4	11%	0.107	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	4.8	-151.9	0	0	0	0	0	117.8	I1487 L1639	I1487-A1644 HydrophobicContact CG2-CB 4.42Å; L1639-A1644 PolarHBondContact O-N 3.2Å
1645	Y	62.6	Low	72.2	Confident	164 Å²	164	29.8 Å²	29.8	64%	0.643	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-15.1	171.8	-62	-80.2	0	0	0	113.7	L1643	L1643-Y1645 PolarHBondContact O-N 2.82Å
1646	H	74.1	Confident	73.6	Confident	39 Å²	39	29.8 Å²	29.8	18%	0.181	15%	0.153	C	C	.	.			trans	-119.8	100.1	-174.8	-65.6	-84.9	0	0	0	111.1	S1507 L1643 I1648 L1649 L1650 V1718 E1721	S1507-H1646 WeakPolarHBondContact CB-CE1 3.4Å; S1507-H1646 WeakPolarHBondContact CB-NE2 3.34Å; L1643-H1646 PolarHBondContact O-N 2.77Å; H1646-I1648 VanDerWaalsContact C-N 3.31Å; H1646-I1648 PolarHBondContact O-N 3.11Å; H1646-L1649 HydrophobicContact CB-CB 3.91Å; H1646-L1649 PolarHBondContact O-N 2.81Å; H1646-L1649 VanDerWaalsContact O-N 3.13Å; H1646-L1650 PolarHBondContact O-N 3.26Å; H1646-L1650 VanDerWaalsContact O-N 3.08Å; H1646-V1718 HydrophobicContact CB-CG1 4.46Å; H1646-V1718 HydrophobicContact CB-CG2 3.83Å; H1646-E1721 IonicContact CE1-OE2 2.68Å; H1646-E1721 PolarHBondContact CE1-OE2 2.84Å; H1646-E1721 IonicContact CG-OE2 2.66Å; H1646-E1721 IonicContact ND1-OE2 3.91Å; H1646-E1721 PolarHBondContact ND1-OE2 3.02Å
1647	P	76.7	Confident	74.9	Confident	50 Å²	50	29.4 Å²	29.4	33%	0.325	15%	0.151	S	C	.	.	H	α-helix	trans	-50.1	-46.6	-178.5	-31.8	37.8	0	0	0	114	L1649 L1650 S1651	P1647-L1649 VanDerWaalsContact C-N 3.33Å; P1647-L1649 PolarHBondContact O-N 3.23Å; P1647-L1650 PolarHBondContact O-N 2.75Å; P1647-S1651 WeakPolarHBondContact O-CB 3.4Å; P1647-S1651 PolarHBondContact O-N 3.33Å; P1647-S1651 PolarHBondContact O-OG 3.35Å
1648	I	83.2	Confident	76.5	Confident	21 Å²	21	27 Å²	27	11%	0.108	13%	0.134	C	C	.	.	H	α-helix	trans	-59	-43.1	-178.5	-55.2	-178.6	0	0	0	111.5	L1329 N1333 H1646 S1651 A1652 A1714 Y1717	L1329-I1648 HydrophobicContact CB-CG2 4.45Å; L1329-I1648 HydrophobicContact CD2-CG2 3.77Å; N1333-I1648 HydrophobicContact CB-CD1 4.34Å; N1333-I1648 HydrophobicContact CB-CG1 4.02Å; H1646-I1648 VanDerWaalsContact C-N 3.31Å; H1646-I1648 PolarHBondContact O-N 3.11Å; I1648-S1651 WeakPolarHBondContact CA-OG 3.34Å; I1648-S1651 PolarHBondContact O-OG 2.94Å; I1648-A1652 WeakPolarHBondContact O-CB 3.46Å; I1648-A1652 PolarHBondContact O-N 3.29Å; I1648-A1714 HydrophobicContact CG2-CB 4.29Å; I1648-Y1717 HydrophobicContact CD1-CD1 4.22Å; I1648-Y1717 HydrophobicContact CD1-CE1 3.89Å
1649	L	83.8	Confident	77.8	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-71.4	-39.8	-178.9	-172.5	67.9	0	0	0	111.8	L1643 H1646 P1647 A1652 Y1653 F1711 A1714 I1715 V1718	L1643-L1649 HydrophobicContact CD2-CD2 3.9Å; L1643-L1649 HydrophobicContact CD2-CG 3.83Å; H1646-L1649 HydrophobicContact CB-CB 3.91Å; H1646-L1649 PolarHBondContact O-N 2.81Å; H1646-L1649 VanDerWaalsContact O-N 3.13Å; P1647-L1649 VanDerWaalsContact C-N 3.33Å; P1647-L1649 PolarHBondContact O-N 3.23Å; L1649-A1652 PolarHBondContact O-N 3.19Å; L1649-Y1653 PolarHBondContact O-N 3.42Å; L1649-F1711 HydrophobicContact CD1-CD2 4.05Å; L1649-F1711 HydrophobicContact CD1-CE1 4.47Å; L1649-F1711 HydrophobicContact CD1-CE2 3.52Å; L1649-F1711 HydrophobicContact CD1-CZ 3.78Å; L1649-F1711 HydrophobicContact CG-CE2 4.03Å; L1649-F1711 HydrophobicContact CG-CZ 4.4Å; L1649-A1714 HydrophobicContact CD1-CB 3.91Å; L1649-I1715 HydrophobicContact CD1-CB 4.49Å; L1649-I1715 HydrophobicContact CD1-CG1 3.73Å; L1649-V1718 HydrophobicContact CB-CG2 4.12Å
1650	L	82.1	Confident	78.8	Confident	5 Å²	5	23 Å²	23	3%	0.026	12%	0.116	C	C	.	.	H	α-helix	trans	-66.3	-40.3	175.8	-173.8	56.2	0	0	0	112	W1336 V1484 L1639 L1643 H1646 P1647 Y1653 M1654	W1336-L1650 HydrophobicContact CH2-CD2 3.76Å; W1336-L1650 HydrophobicContact CH2-CG 3.81Å; W1336-L1650 HydrophobicContact CZ2-CD2 3.88Å; W1336-L1650 HydrophobicContact CZ2-CG 4.26Å; W1336-L1650 HydrophobicContact CZ3-CG 4.37Å; V1484-L1650 HydrophobicContact CG1-CD1 3.63Å; V1484-L1650 HydrophobicContact CG1-CG 4.4Å; L1639-L1650 HydrophobicContact CD2-CD1 4.37Å; L1643-L1650 HydrophobicContact CB-CB 4.32Å; L1643-L1650 HydrophobicContact CB-CD1 3.85Å; L1643-L1650 HydrophobicContact CD1-CD1 3.68Å; L1643-L1650 HydrophobicContact CG-CD1 4.44Å; H1646-L1650 PolarHBondContact O-N 3.26Å; H1646-L1650 VanDerWaalsContact O-N 3.08Å; P1647-L1650 PolarHBondContact O-N 2.75Å; L1650-Y1653 PolarHBondContact O-N 3.43Å; L1650-M1654 PolarHBondContact O-N 3.43Å
1651	S	86.3	Confident	79.1	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-70.3	-32.9	174.2	50.8	0	0	0	0	113.9	I1332 P1647 I1648 Y1653 M1654 A1655	I1332-S1651 WeakPolarHBondContact CG2-OG 3.35Å; P1647-S1651 WeakPolarHBondContact O-CB 3.4Å; P1647-S1651 PolarHBondContact O-N 3.33Å; P1647-S1651 PolarHBondContact O-OG 3.35Å; I1648-S1651 WeakPolarHBondContact CA-OG 3.34Å; I1648-S1651 PolarHBondContact O-OG 2.94Å; S1651-Y1653 VanDerWaalsContact C-N 3.35Å; S1651-M1654 PolarHBondContact O-N 3.1Å; S1651-A1655 WeakPolarHBondContact O-CB 3.46Å; S1651-A1655 PolarHBondContact O-N 3.46Å
1652	A	89.3	Confident	79.3	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-69.5	-32.9	173	0	0	0	0	0	111.9	I1332 I1648 L1649 A1655 L1656 F1711 A1714	I1332-A1652 HydrophobicContact CD1-CB 4.16Å; I1332-A1652 HydrophobicContact CG2-CB 4.49Å; I1648-A1652 WeakPolarHBondContact O-CB 3.46Å; I1648-A1652 PolarHBondContact O-N 3.29Å; L1649-A1652 PolarHBondContact O-N 3.19Å; A1652-A1655 PolarHBondContact O-N 2.8Å; A1652-L1656 PolarHBondContact O-N 2.79Å; A1652-F1711 HydrophobicContact CB-CB 4.16Å; A1652-F1711 HydrophobicContact CB-CD2 3.77Å; A1652-F1711 HydrophobicContact CB-CG 4.45Å; A1652-A1714 HydrophobicContact CB-CB 4.02Å
1653	Y	86.6	Confident	78.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-68.4	-40.8	170.4	-177.3	-99.6	0	0	0	112.3	V1484 Y1635 L1639 L1643 L1649 L1650 S1651 A1655 L1656 K1657 F1759 L1760	V1484-Y1653 HydrophobicContact CG1-CD1 4.29Å; V1484-Y1653 HydrophobicContact CG2-CD1 4.13Å; V1484-Y1653 HydrophobicContact CG2-CE1 3.84Å; Y1635-Y1653 PolarHBondContact OH-OH 3.31Å; L1639-Y1653 HydrophobicContact CD1-CD1 4.07Å; L1639-Y1653 HydrophobicContact CD1-CE1 3.72Å; L1643-Y1653 HydrophobicContact CD1-CD1 3.75Å; L1643-Y1653 HydrophobicContact CD1-CD2 4.17Å; L1643-Y1653 HydrophobicContact CD1-CE1 4.49Å; L1643-Y1653 HydrophobicContact CD1-CG 3.56Å; L1649-Y1653 PolarHBondContact O-N 3.42Å; L1650-Y1653 PolarHBondContact O-N 3.43Å; S1651-Y1653 VanDerWaalsContact C-N 3.35Å; Y1653-A1655 VanDerWaalsContact C-N 3.31Å; Y1653-A1655 PolarHBondContact O-N 3.14Å; Y1653-L1656 WeakPolarHBondContact O-CB 3.29Å; Y1653-L1656 PolarHBondContact O-N 2.98Å; Y1653-K1657 HydrophobicContact CD1-CG 4.39Å; Y1653-K1657 HydrophobicContact CE1-CG 4.02Å; Y1653-K1657 PolarHBondContact O-N 3.29Å; Y1653-K1657 WeakPolarHBondContact OH-CE 3.48Å; Y1653-F1759 HydrophobicContact CE1-CE1 4.37Å; Y1653-F1759 AromaticContact CE2-CD1 3.72Å; Y1653-F1759 HydrophobicContact CE2-CD1 3.72Å; Y1653-F1759 AromaticContact CE2-CE1 3.71Å; Y1653-F1759 HydrophobicContact CE2-CE1 3.71Å; Y1653-F1759 AromaticContact CZ-CE1 3.59Å; Y1653-F1759 WeakPolarHBondContact OH-CE1 3.25Å; Y1653-L1760 HydrophobicContact CD2-CD2 4.32Å; Y1653-L1760 HydrophobicContact CE2-CD2 3.7Å; Y1653-L1760 HydrophobicContact CE2-CG 4.48Å
1654	M	87.5	Confident	77.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.5	-39	173.8	-169.9	176.4	175.5	0	0	111.6	W1336 M1339 I1381 F1384 C1481 L1485 L1650 S1651 K1657 L1658	W1336-M1654 HydrophobicContact CE3-SD 4.32Å; W1336-M1654 HydrophobicContact CZ3-SD 3.81Å; M1339-M1654 HydrophobicContact SD-CE 4.07Å; M1339-M1654 HydrophobicContact SD-SD 4.42Å; I1381-M1654 HydrophobicContact CB-CE 4.25Å; I1381-M1654 HydrophobicContact CG1-CE 3.88Å; I1381-M1654 HydrophobicContact CG2-CE 4.02Å; F1384-M1654 HydrophobicContact CB-CE 4.09Å; F1384-M1654 HydrophobicContact CD1-CE 3.67Å; F1384-M1654 HydrophobicContact CD1-CG 4.07Å; F1384-M1654 HydrophobicContact CD1-SD 3.7Å; F1384-M1654 HydrophobicContact CD2-SD 4.47Å; F1384-M1654 HydrophobicContact CE1-CB 4.09Å; F1384-M1654 HydrophobicContact CE1-CE 4.36Å; F1384-M1654 HydrophobicContact CE1-CG 3.8Å; F1384-M1654 HydrophobicContact CE1-SD 3.86Å; F1384-M1654 HydrophobicContact CG-CE 3.98Å; F1384-M1654 HydrophobicContact CG-SD 4.03Å; F1384-M1654 HydrophobicContact CZ-CB 4.36Å; F1384-M1654 HydrophobicContact CZ-CG 4.47Å; F1384-M1654 HydrophobicContact CZ-SD 4.33Å; C1481-M1654 HydrophobicContact CB-CE 4.07Å; C1481-M1654 HydrophobicContact CB-CG 4.2Å; L1485-M1654 HydrophobicContact CD1-CE 4.33Å; L1650-M1654 PolarHBondContact O-N 3.43Å; S1651-M1654 PolarHBondContact O-N 3.1Å; M1654-K1657 PolarHBondContact O-N 2.94Å; M1654-L1658 WeakPolarHBondContact O-CG 3.46Å; M1654-L1658 PolarHBondContact O-N 2.8Å
1655	A	90.9	Very high	76.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-39.9	172.7	0	0	0	0	0	113.3	L1388 S1651 A1652 Y1653 L1658 T1659 F1707	L1388-A1655 HydrophobicContact CD2-CB 3.57Å; S1651-A1655 WeakPolarHBondContact O-CB 3.46Å; S1651-A1655 PolarHBondContact O-N 3.46Å; A1652-A1655 PolarHBondContact O-N 2.8Å; Y1653-A1655 VanDerWaalsContact C-N 3.31Å; Y1653-A1655 PolarHBondContact O-N 3.14Å; A1655-L1658 PolarHBondContact O-N 2.94Å; A1655-T1659 WeakPolarHBondContact O-CG2 3.4Å; A1655-T1659 PolarHBondContact O-N 3.13Å; A1655-T1659 PolarHBondContact O-OG1 2.81Å; A1655-F1707 HydrophobicContact CB-CD1 3.49Å; A1655-F1707 VanDerWaalsContact CB-CD1 3.49Å; A1655-F1707 HydrophobicContact CB-CD2 4.37Å; A1655-F1707 HydrophobicContact CB-CE1 3.65Å; A1655-F1707 HydrophobicContact CB-CE2 4.48Å; A1655-F1707 HydrophobicContact CB-CG 3.9Å; A1655-F1707 HydrophobicContact CB-CZ 4.15Å
1656	L	89.9	Confident	75.7	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-44.4	173.7	-87.5	171.1	0	0	0	112.3	A1652 Y1653 T1659 D1660 H1704 F1707 L1708 F1711	A1652-L1656 PolarHBondContact O-N 2.79Å; Y1653-L1656 WeakPolarHBondContact O-CB 3.29Å; Y1653-L1656 PolarHBondContact O-N 2.98Å; L1656-T1659 CarbonylContact O-C 3.49Å; L1656-T1659 PolarHBondContact O-N 3.09Å; L1656-T1659 PolarHBondContact O-OG1 2.84Å; L1656-D1660 PolarHBondContact O-N 3.45Å; L1656-H1704 PolarHBondContact O-ND1 2.84Å; L1656-F1707 HydrophobicContact CD2-CB 4.1Å; L1656-F1707 HydrophobicContact CG-CB 4.24Å; L1656-L1708 HydrophobicContact CD1-CD1 4.23Å; L1656-L1708 HydrophobicContact CD2-CB 4.05Å; L1656-L1708 HydrophobicContact CD2-CD1 4.13Å; L1656-F1711 HydrophobicContact CD1-CB 3.6Å; L1656-F1711 HydrophobicContact CD1-CD1 4.17Å; L1656-F1711 HydrophobicContact CD1-CD2 4.11Å; L1656-F1711 HydrophobicContact CD1-CG 3.69Å; L1656-F1711 HydrophobicContact CG-CB 4.41Å
1657	K	87.5	Confident	74.1	Confident	7 Å²	7	26.8 Å²	26.8	3%	0.03	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-51.8	174.3	-76.4	-89	-175.9	164.6	0	111.6	R1477 D1480 Y1653 M1654 T1659 D1660 G1763 D1767	R1477-K1657 WeakPolarHBondContact CD-O 3.44Å; D1480-K1657 HydrophobicContact CB-CD 4.15Å; Y1653-K1657 HydrophobicContact CD1-CG 4.39Å; Y1653-K1657 HydrophobicContact CE1-CG 4.02Å; Y1653-K1657 PolarHBondContact O-N 3.29Å; Y1653-K1657 WeakPolarHBondContact OH-CE 3.48Å; M1654-K1657 PolarHBondContact O-N 2.94Å; K1657-T1659 PolarHBondContact O-N 3.46Å; K1657-D1660 PolarHBondContact O-N 3.16Å; K1657-G1763 PolarHBondContact NZ-O 3.21Å; K1657-D1767 IonicContact NZ-OD1 3.54Å; K1657-D1767 PolarHBondContact NZ-OD1 2.99Å; K1657-D1767 IonicContact NZ-OD2 3.33Å; K1657-D1767 PolarHBondContact NZ-OD2 3.36Å
1658	L	90.6	Very high	71.9	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-57.2	-21.9	178.4	-72.5	-179.5	0	0	0	114.3	I1381 F1384 A1385 I1473 R1477 F1478 C1481 M1654 A1655	I1381-L1658 HydrophobicContact CG2-CD2 4.2Å; F1384-L1658 HydrophobicContact CD1-CD1 3.89Å; F1384-L1658 HydrophobicContact CE1-CD1 3.98Å; A1385-L1658 HydrophobicContact CB-CD1 3.87Å; I1473-L1658 HydrophobicContact CG2-CB 4.39Å; I1473-L1658 HydrophobicContact CG2-CD2 4.14Å; I1473-L1658 WeakPolarHBondContact CG2-O 3.3Å; R1477-L1658 HydrophobicContact CB-CD2 4.43Å; F1478-L1658 HydrophobicContact CD1-CD2 3.38Å; F1478-L1658 HydrophobicContact CE1-CD2 3.6Å; C1481-L1658 VanDerWaalsContact SG-CD2 3.6Å; M1654-L1658 WeakPolarHBondContact O-CG 3.46Å; M1654-L1658 PolarHBondContact O-N 2.8Å; A1655-L1658 PolarHBondContact O-N 2.94Å
1659	T	89.4	Confident	69.4	Low	1 Å²	1	39.2 Å²	39.2	1%	0.006	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	6.2	-174.9	59.5	0	0	0	0	113.5	A1655 L1656 K1657 P1661 L1703 H1704 F1707	A1655-T1659 WeakPolarHBondContact O-CG2 3.4Å; A1655-T1659 PolarHBondContact O-N 3.13Å; A1655-T1659 PolarHBondContact O-OG1 2.81Å; L1656-T1659 CarbonylContact O-C 3.49Å; L1656-T1659 PolarHBondContact O-N 3.09Å; L1656-T1659 PolarHBondContact O-OG1 2.84Å; K1657-T1659 PolarHBondContact O-N 3.46Å; T1659-P1661 VanDerWaalsContact O-CD 3.31Å; T1659-P1661 WeakPolarHBondContact O-CD 3.45Å; T1659-P1661 VanDerWaalsContact O-N 3.15Å; T1659-L1703 HydrophobicContact CG2-CD2 3.52Å; T1659-L1703 HydrophobicContact CG2-CG 3.88Å; T1659-H1704 WeakPolarHBondContact O-CB 3.37Å; T1659-H1704 PolarHBondContact O-ND1 3.4Å; T1659-F1707 HydrophobicContact CG2-CD2 3.81Å; T1659-F1707 HydrophobicContact CG2-CE2 3.92Å
1660	D	85.3	Confident	66.8	Low	11 Å²	11	43.4 Å²	43.4	6%	0.059	22%	0.219	C	C	.	.			trans	-59.4	117.9	179.5	-166	-44.4	0	0	0	110.5	R1477 L1656 K1657 I1662 H1704 R1764	R1477-D1660 VanDerWaalsContact CZ-O 3.32Å; R1477-D1660 PolarHBondContact NE-O 3.42Å; R1477-D1660 PolarHBondContact NH2-O 3.35Å; L1656-D1660 PolarHBondContact O-N 3.45Å; K1657-D1660 PolarHBondContact O-N 3.16Å; D1660-I1662 VanDerWaalsContact C-N 3.31Å; D1660-I1662 PolarHBondContact O-N 2.71Å; D1660-I1662 WeakPolarHBondContact OD1-CB 3.18Å; D1660-I1662 VanDerWaalsContact OD1-CG1 3.28Å; D1660-I1662 WeakPolarHBondContact OD1-CG1 3.32Å; D1660-I1662 PolarHBondContact OD1-N 2.72Å; D1660-H1704 WeakPolarHBondContact CA-ND1 3.42Å; D1660-R1764 IonicContact OD2-CZ 2.68Å; D1660-R1764 IonicContact OD2-NH1 3.89Å; D1660-R1764 PolarHBondContact OD2-NH1 3.02Å
1661	P	68	Low	64.2	Low	22 Å²	22	49.1 Å²	49.1	14%	0.143	25%	0.25	C	C	.	.			trans	-85.3	3.7	-172	35.9	-37.5	0	0	0	113.8	T1659 I1663 L1700 Q1701 H1704	T1659-P1661 VanDerWaalsContact O-CD 3.31Å; T1659-P1661 WeakPolarHBondContact O-CD 3.45Å; T1659-P1661 VanDerWaalsContact O-N 3.15Å; P1661-I1663 PolarHBondContact O-N 2.69Å; P1661-L1700 HydrophobicContact CB-CB 4.47Å; P1661-Q1701 HydrophobicContact CB-CB 4.48Å; P1661-Q1701 HydrophobicContact CB-CG 3.51Å; P1661-Q1701 HydrophobicContact CG-CG 3.7Å; P1661-H1704 HydrophobicContact CG-CB 4.48Å
1662	I	65.6	Low	61.3	Low	87 Å²	87	57.9 Å²	57.9	45%	0.446	29%	0.29	S	S	.	.			trans	-63.3	118.9	-179	-71.6	168	0	0	0	110.2	R1477 D1660 V1664 R1764	R1477-I1662 PolarHBondContact NH2-O 2.78Å; D1660-I1662 VanDerWaalsContact C-N 3.31Å; D1660-I1662 PolarHBondContact O-N 2.71Å; D1660-I1662 WeakPolarHBondContact OD1-CB 3.18Å; D1660-I1662 VanDerWaalsContact OD1-CG1 3.28Å; D1660-I1662 WeakPolarHBondContact OD1-CG1 3.32Å; D1660-I1662 PolarHBondContact OD1-N 2.72Å; I1662-V1664 PolarHBondContact O-N 2.88Å; I1662-R1764 VanDerWaalsContact CD1-CZ 3.49Å
1663	I	49.6	Very low	58.3	Low	96 Å²	96	67.5 Å²	67.5	49%	0.492	33%	0.332	S	S	.	.			trans	-54.1	126.1	-178	-62.6	169.2	0	0	0	109.3	P1661 G1665	P1661-I1663 PolarHBondContact O-N 2.69Å; I1663-G1665 PolarHBondContact O-N 3.28Å; I1663-G1665 VanDerWaalsContact O-N 3.15Å
1664	V	48	Very low	55.5	Low	43 Å²	43	75.6 Å²	75.6	26%	0.261	37%	0.372	S	S	.	.			trans	-69	110.5	167.5	-178.5	0	0	0	0	106.4	N1476 I1662 N1666 E1667	N1476-V1664 HydrophobicContact CB-CG2 4.3Å; I1662-V1664 PolarHBondContact O-N 2.88Å; V1664-N1666 HydrophobicContact CG1-CB 4.06Å; V1664-N1666 PolarHBondContact O-N 2.66Å; V1664-E1667 PolarHBondContact O-N 3.38Å
1665	G	38.4	Very low	52.6	Low	42 Å²	42	83.2 Å²	83.2	43%	0.433	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	25.5	-175.6	0	0	0	0	0	116	I1663	I1663-G1665 PolarHBondContact O-N 3.28Å; I1663-G1665 VanDerWaalsContact O-N 3.15Å
1666	N	37.8	Very low	49.5	Very low	78 Å²	78	90 Å²	90	42%	0.417	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-6.4	178.8	-67.4	-32.3	0	0	0	112.8	V1664 E1668	V1664-N1666 HydrophobicContact CG1-CB 4.06Å; V1664-N1666 PolarHBondContact O-N 2.66Å; N1666-E1668 VanDerWaalsContact C-N 3.27Å
1667	E	39.8	Very low	46.8	Very low	97 Å²	97	99.1 Å²	99.1	45%	0.453	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-20.4	168.3	-71	-177.6	177.1	0	0	111.3	V1664 R1696	V1664-E1667 PolarHBondContact O-N 3.38Å; E1667-R1696 IonicContact OE1-NH2 3.76Å; E1667-R1696 PolarHBondContact OE1-NH2 3.19Å; E1667-R1696 IonicContact OE2-NH2 3.66Å
1668	E	30.9	Very low	44	Very low	143 Å²	143	106.8 Å²	106.8	67%	0.668	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-7.5	176.4	-66.6	-175.1	144.7	0	0	114.9	N1666	N1666-E1668 VanDerWaalsContact C-N 3.27Å
1669	Y	29.6	Very low	41	Very low	189 Å²	189	113.7 Å²	113.7	74%	0.741	56%	0.559	S	S	*	*	S	Bend	trans	-105.1	45	-176.2	-89.1	-83.6	0	0	0	113.4
1670	H	29.4	Very low	38.1	Very low	89 Å²	89	121 Å²	121	41%	0.412	59%	0.593	S	S	.	*	S	Bend	trans	-136.1	2	-175.5	-113.6	18.7	0	0	0	119.5	R1803	H1670-R1803 PolarHBondContact CD2-NH2 3.28Å; H1670-R1803 PolarHBondContact CE1-NH2 3.48Å; H1670-R1803 PolarHBondContact ND1-NH2 3.33Å; H1670-R1803 PolarHBondContact NE2-NE 3.44Å; H1670-R1803 PolarHBondContact NE2-NH2 3.01Å; H1670-R1803 VanDerWaalsContact NE2-NH2 3.12Å; H1670-R1803 PolarHBondContact O-NH2 3.01Å
1671	D	28.3	Very low	35.5	Very low	126 Å²	126	128.6 Å²	128.6	67%	0.674	63%	0.628	S	S	*	*	S	Bend	trans	-113.6	12.1	176.8	-74.8	-27.9	0	0	0	115.2
1672	H	25.8	Very low	33.5	Very low	184 Å²	184	135.4 Å²	135.4	85%	0.852	66%	0.657	S	S	*	*	S	Bend	trans	-120	42.3	176.7	-89.4	-7.9	0	0	0	114
1673	F	26.2	Very low	31.9	Very low	201 Å²	201	139.7 Å²	139.7	88%	0.882	68%	0.675	S	S	*	*	S	Bend	trans	-145.9	41.3	165.6	-110.2	-75	0	0	0	112.6
1674	M	27.9	Very low	30.8	Very low	171 Å²	171	143.3 Å²	143.3	84%	0.842	69%	0.69	S	S	*	*			trans	-142.5	57.3	172.7	-78.2	-64.9	164.8	0	0	110.8
1675	D	25.6	Very low	30.1	Very low	159 Å²	159	149.1 Å²	149.1	85%	0.85	71%	0.714	S	S	*	*			trans	-144.1	61.9	176.7	-138.9	-11.7	0	0	0	111.5
1676	D	26.5	Very low	29.6	Very low	144 Å²	144	155.7 Å²	155.7	77%	0.77	73%	0.733	S	S	*	*			trans	-148.5	46.4	165.4	-150.4	-0.6	0	0	0	113.3
1677	H	32.1	Very low	29.1	Very low	190 Å²	190	162.1 Å²	162.1	88%	0.88	75%	0.753	S	S	*	*	S	Bend	trans	-148.5	125.4	154.7	-92.1	-11.2	0	0	0	110.2
1678	Q	28.7	Very low	28.7	Very low	169 Å²	169	166 Å²	166	79%	0.79	77%	0.771	S	S	*	*			trans	-87.7	141.9	-159.1	-68.5	178.1	-25.4	0	0	115.4
1679	H	28.2	Very low	29.3	Very low	146 Å²	146	167.3 Å²	167.3	68%	0.676	77%	0.77	S	S	*	*			trans	86.8	126.2	142.1	-72.3	-3	0	0	0	122.3
1680	H	27.7	Very low	30.4	Very low	155 Å²	155	162.3 Å²	162.3	72%	0.718	76%	0.756	S	S	*	*			trans	74	134	156.1	-53.5	-36.2	0	0	0	117.6
1681	H	31.2	Very low	31.5	Very low	170 Å²	170	161.3 Å²	161.3	79%	0.787	76%	0.757	S	S	*	*			cis	-133.5	166.7	8.4	-102.3	-66.2	0	0	0	112.8
1682	H	26.4	Very low	33.2	Very low	164 Å²	164	162.7 Å²	162.7	76%	0.759	76%	0.758	S	S	*	*			trans	-55.9	142.7	179.4	-66.4	-62.8	0	0	0	114.7
1683	H	31	Very low	35.1	Very low	177 Å²	177	155.7 Å²	155.7	82%	0.819	73%	0.726	S	S	*	*				-142	129.8	122.3	-119	-87.3	0	0	0	109.8	H1685	H1683-H1685 PolarHBondContact O-N 3.28Å
1684	H	27.5	Very low	37.1	Very low	173 Å²	173	149.6 Å²	149.6	80%	0.801	70%	0.702	S	S	*	*			trans	-73.7	122.2	166	-101	-82.2	0	0	0	108.5
1685	H	32.4	Very low	39.4	Very low	165 Å²	165	144.3 Å²	144.3	76%	0.764	68%	0.675	S	S	*	*			trans	-134.6	150.5	152.2	-102.5	-92	0	0	0	108.1	H1683	H1683-H1685 PolarHBondContact O-N 3.28Å
1686	Q	27.8	Very low	42.2	Very low	180 Å²	180	138.4 Å²	138.4	84%	0.841	64%	0.641	S	S	*	*			trans	-76.7	153.5	-172	-67.9	151	-85.3	0	0	111.3	E1688	Q1686-E1688 PolarHBondContact O-N 3.28Å
1687	Y	28.8	Very low	44.8	Very low	212 Å²	212	132.6 Å²	132.6	83%	0.831	61%	0.61	S	S	*	*			trans	-65.8	95.6	168.7	-84	-93.8	0	0	0	109.6
1688	E	31.4	Very low	47.1	Very low	178 Å²	178	126.9 Å²	126.9	83%	0.832	58%	0.583	S	S	*	*			trans	-94.7	117.4	176.3	-169.2	165	-133.5	0	0	109.1	Q1686 N1690	Q1686-E1688 PolarHBondContact O-N 3.28Å; E1688-N1690 PolarHBondContact O-N 3.19Å; E1688-N1690 VanDerWaalsContact O-N 3.17Å
1689	W	42.9	Very low	49.7	Very low	172 Å²	172	120.1 Å²	120.1	65%	0.652	55%	0.551	S	S	*	*			trans	-61.6	118.2	179	-79.3	76.2	0	0	0	109.7	P1691 I1694	W1689-P1691 VanDerWaalsContact O-CD 3.31Å; W1689-P1691 WeakPolarHBondContact O-CD 3.41Å; W1689-I1694 HydrophobicContact CB-CD1 3.92Å; W1689-I1694 HydrophobicContact CB-CG1 4.48Å
1690	N	52.4	Low	52.5	Low	84 Å²	84	113.2 Å²	113.2	45%	0.449	52%	0.519	S	S	.	.			trans	-50.5	115	-175.1	-179.1	-13.8	0	0	0	111.1	E1688 F1692 I1693	E1688-N1690 PolarHBondContact O-N 3.19Å; E1688-N1690 VanDerWaalsContact O-N 3.17Å; N1690-F1692 PolarHBondContact O-N 2.67Å; N1690-F1692 WeakPolarHBondContact OD1-CD2 3.43Å; N1690-F1692 PolarHBondContact OD1-N 2.76Å; N1690-I1693 HydrophobicContact CB-CD1 4.12Å; N1690-I1693 HydrophobicContact CB-CG1 4.28Å; N1690-I1693 WeakPolarHBondContact O-CB 3.43Å; N1690-I1693 PolarHBondContact O-N 2.81Å
1691	P	51.9	Low	55.2	Low	67 Å²	67	111 Å²	111	44%	0.435	51%	0.509	S	S	.	.	H	α-helix	trans	-54.4	-33	-173.2	-30.5	36.4	0	0	0	114.1	W1689 I1693 I1694 H1695	W1689-P1691 VanDerWaalsContact O-CD 3.31Å; W1689-P1691 WeakPolarHBondContact O-CD 3.41Å; P1691-I1693 VanDerWaalsContact C-N 3.26Å; P1691-I1693 PolarHBondContact O-N 2.89Å; P1691-I1694 PolarHBondContact O-N 2.98Å; P1691-I1694 VanDerWaalsContact O-N 3.11Å; P1691-H1695 PolarHBondContact O-CD2 2.8Å; P1691-H1695 PolarHBondContact O-N 2.88Å
1692	F	63.7	Low	57.7	Low	156 Å²	156	106.8 Å²	106.8	68%	0.684	49%	0.486	S	S	*	.	H	α-helix	trans	-57.6	-37.4	177	-76.3	-92.8	0	0	0	113	N1690 R1696	N1690-F1692 PolarHBondContact O-N 2.67Å; N1690-F1692 WeakPolarHBondContact OD1-CD2 3.43Å; N1690-F1692 PolarHBondContact OD1-N 2.76Å; F1692-R1696 VanDerWaalsContact O-CB 3.25Å; F1692-R1696 WeakPolarHBondContact O-CB 3.39Å; F1692-R1696 PolarHBondContact O-N 3.35Å
1693	I	67.5	Low	60.5	Low	37 Å²	37	99.2 Å²	99.2	19%	0.19	45%	0.451	C	S	.	.	H	α-helix	trans	-69.8	-41.3	178	-59.7	177.3	0	0	0	110	N1690 P1691 N1697	N1690-I1693 HydrophobicContact CB-CD1 4.12Å; N1690-I1693 HydrophobicContact CB-CG1 4.28Å; N1690-I1693 WeakPolarHBondContact O-CB 3.43Å; N1690-I1693 PolarHBondContact O-N 2.81Å; P1691-I1693 VanDerWaalsContact C-N 3.26Å; P1691-I1693 PolarHBondContact O-N 2.89Å; I1693-N1697 WeakPolarHBondContact O-CB 3.39Å; I1693-N1697 PolarHBondContact O-N 3.39Å; I1693-N1697 PolarHBondContact O-ND2 3.14Å; I1693-N1697 PolarHBondContact O-OD1 3.08Å
1694	I	68.3	Low	63.3	Low	72 Å²	72	92 Å²	92	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-63	-49.9	177.3	-60.4	176	0	0	0	110.2	W1689 P1691 N1697 Q1698	W1689-I1694 HydrophobicContact CB-CD1 3.92Å; W1689-I1694 HydrophobicContact CB-CG1 4.48Å; P1691-I1694 PolarHBondContact O-N 2.98Å; P1691-I1694 VanDerWaalsContact O-N 3.11Å; I1694-N1697 PolarHBondContact O-N 2.64Å; I1694-Q1698 WeakPolarHBondContact O-CG 3.29Å; I1694-Q1698 PolarHBondContact O-N 3.22Å
1695	H	76	Confident	66.1	Low	61 Å²	61	90.9 Å²	90.9	28%	0.282	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-43.9	178.9	-63.8	-65.8	0	0	0	112.1	D1459 P1691 N1697 Q1698 R1699	D1459-H1695 IonicContact OD1-CE1 2.87Å; D1459-H1695 PolarHBondContact OD1-CE1 2.81Å; P1691-H1695 PolarHBondContact O-CD2 2.8Å; P1691-H1695 PolarHBondContact O-N 2.88Å; H1695-N1697 PolarHBondContact O-N 3.02Å; H1695-Q1698 PolarHBondContact O-N 2.86Å; H1695-R1699 WeakPolarHBondContact O-CG 3.34Å; H1695-R1699 PolarHBondContact O-N 3.21Å
1696	R	84.4	Confident	68.7	Low	34 Å²	34	85.9 Å²	85.9	13%	0.128	39%	0.386	C	S	.	.	H	α-helix	trans	-52.5	-52.2	171.7	173.7	177.7	77.8	-158.4	7.5	111.2	D1469 W1472 E1667 F1692 Q1698 R1699 L1700	D1469-R1696 WeakPolarHBondContact OD1-CB 3.49Å; D1469-R1696 VanDerWaalsContact OD1-CG 3.3Å; D1469-R1696 WeakPolarHBondContact OD1-CG 3.24Å; W1472-R1696 VanDerWaalsContact NE1-CZ 3.29Å; E1667-R1696 IonicContact OE1-NH2 3.76Å; E1667-R1696 PolarHBondContact OE1-NH2 3.19Å; E1667-R1696 IonicContact OE2-NH2 3.66Å; F1692-R1696 VanDerWaalsContact O-CB 3.25Å; F1692-R1696 WeakPolarHBondContact O-CB 3.39Å; F1692-R1696 PolarHBondContact O-N 3.35Å; R1696-Q1698 VanDerWaalsContact C-N 3.33Å; R1696-Q1698 PolarHBondContact O-N 2.8Å; R1696-R1699 PolarHBondContact O-N 3.22Å; R1696-L1700 HydrophobicContact CG-CD1 3.85Å; R1696-L1700 HydrophobicContact CG-CG 4.43Å; R1696-L1700 WeakPolarHBondContact O-CB 3.33Å; R1696-L1700 VanDerWaalsContact O-CG 3.31Å; R1696-L1700 WeakPolarHBondContact O-CG 3.1Å; R1696-L1700 PolarHBondContact O-N 3.08Å
1697	N	81.2	Confident	71.7	Confident	23 Å²	23	77.3 Å²	77.3	12%	0.123	35%	0.345	C	S	.	.	H	α-helix	trans	-63.7	-38.3	-178.5	-68.3	-8	0	0	0	111.5	I1693 I1694 H1695 Q1701	I1693-N1697 WeakPolarHBondContact O-CB 3.39Å; I1693-N1697 PolarHBondContact O-N 3.39Å; I1693-N1697 PolarHBondContact O-ND2 3.14Å; I1693-N1697 PolarHBondContact O-OD1 3.08Å; I1694-N1697 PolarHBondContact O-N 2.64Å; H1695-N1697 PolarHBondContact O-N 3.02Å; N1697-Q1701 WeakPolarHBondContact O-CB 3.32Å; N1697-Q1701 WeakPolarHBondContact O-CG 3.28Å; N1697-Q1701 PolarHBondContact O-N 2.95Å
1698	Q	79.8	Confident	74.5	Confident	69 Å²	69	69.9 Å²	69.9	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-64.3	-45.6	173	-71.3	-176.5	27	0	0	112.7	I1694 H1695 R1696 Q1701 R1702	I1694-Q1698 WeakPolarHBondContact O-CG 3.29Å; I1694-Q1698 PolarHBondContact O-N 3.22Å; H1695-Q1698 PolarHBondContact O-N 2.86Å; R1696-Q1698 VanDerWaalsContact C-N 3.33Å; R1696-Q1698 PolarHBondContact O-N 2.8Å; Q1698-Q1701 PolarHBondContact O-N 3.31Å; Q1698-R1702 VanDerWaalsContact O-CG 3.22Å; Q1698-R1702 WeakPolarHBondContact O-CG 2.92Å; Q1698-R1702 PolarHBondContact O-N 2.95Å
1699	R	84.2	Confident	77.1	Confident	28 Å²	28	65.3 Å²	65.3	11%	0.106	30%	0.301	C	S	.	.	H	α-helix	trans	-59.1	-47.2	176.5	-71.7	-170.8	-66.4	-100.5	3.9	110.9	D1462 Y1464 D1469 H1695 R1696 R1702 L1703	D1462-R1699 WeakPolarHBondContact OD2-CD 3.1Å; D1462-R1699 IonicContact OD2-CZ 2.69Å; D1462-R1699 IonicContact OD2-NE 3.37Å; D1462-R1699 IonicContact OD2-NH1 3.88Å; D1462-R1699 PolarHBondContact OD2-NH1 3.29Å; Y1464-R1699 WeakPolarHBondContact O-CD 3.3Å; D1469-R1699 VanDerWaalsContact CG-NH2 3.33Å; D1469-R1699 IonicContact OD1-CZ 3.3Å; D1469-R1699 IonicContact OD1-NE 3.06Å; D1469-R1699 IonicContact OD1-NH2 3.1Å; D1469-R1699 PolarHBondContact OD1-NH2 2.77Å; D1469-R1699 IonicContact OD2-CZ 2.69Å; D1469-R1699 VanDerWaalsContact OD2-CZ 3.3Å; D1469-R1699 IonicContact OD2-NE 3.46Å; D1469-R1699 PolarHBondContact OD2-NE 3.14Å; D1469-R1699 IonicContact OD2-NH2 3.37Å; D1469-R1699 PolarHBondContact OD2-NH2 2.98Å; D1469-R1699 VanDerWaalsContact OD2-NH2 3.1Å; H1695-R1699 WeakPolarHBondContact O-CG 3.34Å; H1695-R1699 PolarHBondContact O-N 3.21Å; R1696-R1699 PolarHBondContact O-N 3.22Å; R1699-R1702 PolarHBondContact O-N 3.02Å; R1699-L1703 WeakPolarHBondContact O-CB 3.32Å; R1699-L1703 PolarHBondContact O-N 2.75Å
1700	L	85.8	Confident	79.2	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-40.5	176.9	-66	175.1	0	0	0	112.7	L1465 W1472 I1473 P1661 R1696 L1703 H1704	L1465-L1700 HydrophobicContact CD2-CD2 4.25Å; W1472-L1700 HydrophobicContact CE3-CD1 3.68Å; W1472-L1700 HydrophobicContact CH2-CD1 4.33Å; W1472-L1700 HydrophobicContact CZ3-CD1 3.48Å; W1472-L1700 VanDerWaalsContact CZ3-CD1 3.48Å; I1473-L1700 HydrophobicContact CD1-CD2 3.82Å; I1473-L1700 HydrophobicContact CG1-CD2 4.03Å; P1661-L1700 HydrophobicContact CB-CB 4.47Å; R1696-L1700 HydrophobicContact CG-CD1 3.85Å; R1696-L1700 HydrophobicContact CG-CG 4.43Å; R1696-L1700 WeakPolarHBondContact O-CB 3.33Å; R1696-L1700 VanDerWaalsContact O-CG 3.31Å; R1696-L1700 WeakPolarHBondContact O-CG 3.1Å; R1696-L1700 PolarHBondContact O-N 3.08Å; L1700-L1703 PolarHBondContact O-N 2.91Å; L1700-H1704 WeakPolarHBondContact O-CB 3.31Å; L1700-H1704 PolarHBondContact O-N 3.37Å
1701	Q	84.9	Confident	80.9	Confident	109 Å²	109	53.2 Å²	53.2	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-62.4	-42.5	174.7	-77.7	175.6	11.5	0	0	112.6	P1661 N1697 Q1698 L1703 K1705	P1661-Q1701 HydrophobicContact CB-CB 4.48Å; P1661-Q1701 HydrophobicContact CB-CG 3.51Å; P1661-Q1701 HydrophobicContact CG-CG 3.7Å; N1697-Q1701 WeakPolarHBondContact O-CB 3.32Å; N1697-Q1701 WeakPolarHBondContact O-CG 3.28Å; N1697-Q1701 PolarHBondContact O-N 2.95Å; Q1698-Q1701 PolarHBondContact O-N 3.31Å; Q1701-L1703 VanDerWaalsContact C-N 3.32Å; Q1701-L1703 PolarHBondContact O-N 2.94Å; Q1701-K1705 WeakPolarHBondContact O-CB 3.43Å; Q1701-K1705 PolarHBondContact O-N 3.25Å
1702	R	82.5	Confident	82.5	Confident	80 Å²	80	51.7 Å²	51.7	30%	0.302	24%	0.237	S	C	.	.	H	α-helix	trans	-58.6	-46.3	174.1	-67.4	164.2	-167.4	-172.6	3.3	110.2	D1462 Q1698 R1699 Y1706	D1462-R1702 PolarHBondContact O-NH1 3.35Å; Q1698-R1702 VanDerWaalsContact O-CG 3.22Å; Q1698-R1702 WeakPolarHBondContact O-CG 2.92Å; Q1698-R1702 PolarHBondContact O-N 2.95Å; R1699-R1702 PolarHBondContact O-N 3.02Å; R1702-Y1706 PolarHBondContact O-N 3.48Å; R1702-Y1706 VanDerWaalsContact O-N 3.11Å
1703	L	86.5	Confident	83.5	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.026	23%	0.229	C	C	.	.	H	α-helix	trans	-67.6	-42.8	-179.7	-170.8	67.7	0	0	0	113	I1325 L1389 L1392 L1465 T1659 R1699 L1700 Q1701 Y1706 F1707	I1325-L1703 HydrophobicContact CD1-CB 4.48Å; I1325-L1703 HydrophobicContact CD1-CD1 3.95Å; I1325-L1703 HydrophobicContact CG2-CD1 4.33Å; L1389-L1703 HydrophobicContact CD2-CD1 4.48Å; L1389-L1703 HydrophobicContact CD2-CD2 4.08Å; L1392-L1703 HydrophobicContact CD1-CD1 3.72Å; L1465-L1703 HydrophobicContact CD1-CD2 3.97Å; L1465-L1703 HydrophobicContact CD2-CD2 4.19Å; L1465-L1703 HydrophobicContact CG-CD2 4.45Å; T1659-L1703 HydrophobicContact CG2-CD2 3.52Å; T1659-L1703 HydrophobicContact CG2-CG 3.88Å; R1699-L1703 WeakPolarHBondContact O-CB 3.32Å; R1699-L1703 PolarHBondContact O-N 2.75Å; L1700-L1703 PolarHBondContact O-N 2.91Å; Q1701-L1703 VanDerWaalsContact C-N 3.32Å; Q1701-L1703 PolarHBondContact O-N 2.94Å; L1703-Y1706 CarbonylContact O-C 3.56Å; L1703-Y1706 WeakPolarHBondContact O-CA 3.44Å; L1703-Y1706 WeakPolarHBondContact O-CB 3.47Å; L1703-Y1706 PolarHBondContact O-N 2.86Å; L1703-F1707 HydrophobicContact CD1-CD2 4.21Å; L1703-F1707 HydrophobicContact CD1-CE2 3.69Å; L1703-F1707 HydrophobicContact CD2-CE2 4.3Å; L1703-F1707 HydrophobicContact CG-CD2 3.95Å; L1703-F1707 HydrophobicContact CG-CE2 3.73Å; L1703-F1707 WeakPolarHBondContact O-CD2 3.49Å; L1703-F1707 PolarHBondContact O-N 3.21Å
1704	H	89	Confident	84.4	Confident	27 Å²	27	47.8 Å²	47.8	13%	0.125	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-46.5	176.5	-173.7	87.4	0	0	0	111.8	L1656 T1659 D1660 P1661 L1700 Y1706 F1707 L1708	L1656-H1704 PolarHBondContact O-ND1 2.84Å; T1659-H1704 WeakPolarHBondContact O-CB 3.37Å; T1659-H1704 PolarHBondContact O-ND1 3.4Å; D1660-H1704 WeakPolarHBondContact CA-ND1 3.42Å; P1661-H1704 HydrophobicContact CG-CB 4.48Å; L1700-H1704 WeakPolarHBondContact O-CB 3.31Å; L1700-H1704 PolarHBondContact O-N 3.37Å; H1704-Y1706 PolarHBondContact O-N 2.87Å; H1704-F1707 CarbonylContact O-C 3.5Å; H1704-F1707 PolarHBondContact O-N 3.22Å; H1704-F1707 VanDerWaalsContact O-N 3.15Å; H1704-L1708 WeakPolarHBondContact O-CB 3.08Å; H1704-L1708 PolarHBondContact O-N 3.21Å
1705	K	86	Confident	85.1	Confident	149 Å²	149	44.3 Å²	44.3	65%	0.648	20%	0.203	S	C	*	.	H	α-helix	trans	-59.5	-33.5	174.6	-173.8	174.2	-177.9	175.2	0	111.5	Q1701 N1709	Q1701-K1705 WeakPolarHBondContact O-CB 3.43Å; Q1701-K1705 PolarHBondContact O-N 3.25Å; K1705-N1709 PolarHBondContact O-N 3.05Å
1706	Y	87.3	Confident	85.3	Confident	60 Å²	60	43.8 Å²	43.8	24%	0.235	20%	0.202	C	C	.	.	H	α-helix	trans	-69.6	-47.7	173.4	-162.6	-104.4	0	0	0	112	I1325 I1327 R1702 L1703 H1704 L1708 N1709 I1710	I1325-Y1706 HydrophobicContact CB-CD1 3.84Å; I1325-Y1706 HydrophobicContact CB-CD2 4.26Å; I1325-Y1706 HydrophobicContact CB-CE1 3.97Å; I1325-Y1706 HydrophobicContact CB-CE2 4.4Å; I1325-Y1706 HydrophobicContact CB-CG 4.01Å; I1325-Y1706 HydrophobicContact CD1-CG 4.19Å; I1325-Y1706 HydrophobicContact CG1-CG 4.45Å; I1325-Y1706 HydrophobicContact CG2-CD1 4.06Å; I1325-Y1706 HydrophobicContact CG2-CE1 4.22Å; I1325-Y1706 WeakPolarHBondContact O-CE1 3.41Å; I1325-Y1706 PolarHBondContact O-OH 3.34Å; I1327-Y1706 HydrophobicContact CB-CE1 4.09Å; I1327-Y1706 VanDerWaalsContact O-CE1 3.32Å; I1327-Y1706 WeakPolarHBondContact O-CE1 3.48Å; I1327-Y1706 PolarHBondContact O-OH 3.25Å; R1702-Y1706 PolarHBondContact O-N 3.48Å; R1702-Y1706 VanDerWaalsContact O-N 3.11Å; L1703-Y1706 CarbonylContact O-C 3.56Å; L1703-Y1706 WeakPolarHBondContact O-CA 3.44Å; L1703-Y1706 WeakPolarHBondContact O-CB 3.47Å; L1703-Y1706 PolarHBondContact O-N 2.86Å; H1704-Y1706 PolarHBondContact O-N 2.87Å; Y1706-L1708 VanDerWaalsContact C-N 3.28Å; Y1706-L1708 PolarHBondContact O-N 3.42Å; Y1706-N1709 WeakPolarHBondContact O-CB 3.26Å; Y1706-N1709 PolarHBondContact O-N 2.91Å; Y1706-N1709 VanDerWaalsContact O-N 3.11Å; Y1706-I1710 HydrophobicContact CD1-CD1 3.75Å; Y1706-I1710 HydrophobicContact CD1-CG1 4.23Å; Y1706-I1710 HydrophobicContact CE1-CD1 3.58Å; Y1706-I1710 HydrophobicContact CE1-CG1 4.04Å; Y1706-I1710 WeakPolarHBondContact O-CG1 3.27Å; Y1706-I1710 PolarHBondContact O-N 2.72Å
1707	F	90.5	Very high	85.1	Confident	0 Å²	0	48 Å²	48	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.1	-27.2	174.4	-78.9	-62.7	0	0	0	114	I1327 I1332 L1388 L1389 A1655 L1656 T1659 L1703 H1704 I1710 F1711	I1327-F1707 HydrophobicContact CD1-CE1 4.48Å; I1327-F1707 HydrophobicContact CD1-CZ 3.74Å; I1327-F1707 HydrophobicContact CG2-CE1 3.9Å; I1327-F1707 HydrophobicContact CG2-CZ 4.18Å; I1332-F1707 HydrophobicContact CD1-CD1 3.97Å; I1332-F1707 HydrophobicContact CD1-CE1 3.85Å; I1332-F1707 HydrophobicContact CG1-CE1 4.23Å; L1388-F1707 HydrophobicContact CD1-CE1 4.02Å; L1388-F1707 HydrophobicContact CD1-CZ 4.01Å; L1388-F1707 HydrophobicContact CD2-CE1 3.98Å; L1388-F1707 HydrophobicContact CD2-CZ 3.76Å; L1388-F1707 HydrophobicContact CG-CE1 4.3Å; L1388-F1707 HydrophobicContact CG-CZ 3.91Å; L1389-F1707 HydrophobicContact CD2-CE2 3.85Å; L1389-F1707 HydrophobicContact CD2-CZ 3.93Å; A1655-F1707 HydrophobicContact CB-CD1 3.49Å; A1655-F1707 VanDerWaalsContact CB-CD1 3.49Å; A1655-F1707 HydrophobicContact CB-CD2 4.37Å; A1655-F1707 HydrophobicContact CB-CE1 3.65Å; A1655-F1707 HydrophobicContact CB-CE2 4.48Å; A1655-F1707 HydrophobicContact CB-CG 3.9Å; A1655-F1707 HydrophobicContact CB-CZ 4.15Å; L1656-F1707 HydrophobicContact CD2-CB 4.1Å; L1656-F1707 HydrophobicContact CG-CB 4.24Å; T1659-F1707 HydrophobicContact CG2-CD2 3.81Å; T1659-F1707 HydrophobicContact CG2-CE2 3.92Å; L1703-F1707 HydrophobicContact CD1-CD2 4.21Å; L1703-F1707 HydrophobicContact CD1-CE2 3.69Å; L1703-F1707 HydrophobicContact CD2-CE2 4.3Å; L1703-F1707 HydrophobicContact CG-CD2 3.95Å; L1703-F1707 HydrophobicContact CG-CE2 3.73Å; L1703-F1707 WeakPolarHBondContact O-CD2 3.49Å; L1703-F1707 PolarHBondContact O-N 3.21Å; H1704-F1707 CarbonylContact O-C 3.5Å; H1704-F1707 PolarHBondContact O-N 3.22Å; H1704-F1707 VanDerWaalsContact O-N 3.15Å; F1707-I1710 HydrophobicContact CD1-CD1 3.83Å; F1707-I1710 HydrophobicContact CE1-CD1 3.96Å; F1707-I1710 PolarHBondContact O-N 3.25Å; F1707-F1711 VanDerWaalsContact O-CB 3.3Å; F1707-F1711 WeakPolarHBondContact O-CB 3.4Å; F1707-F1711 PolarHBondContact O-N 3.32Å
1708	L	87.4	Confident	84.8	Confident	55 Å²	55	46.9 Å²	46.9	29%	0.288	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-41.9	171.3	-168.3	68.3	0	0	0	110.7	L1656 H1704 Y1706 F1711 N1712 L1756	L1656-L1708 HydrophobicContact CD1-CD1 4.23Å; L1656-L1708 HydrophobicContact CD2-CB 4.05Å; L1656-L1708 HydrophobicContact CD2-CD1 4.13Å; H1704-L1708 WeakPolarHBondContact O-CB 3.08Å; H1704-L1708 PolarHBondContact O-N 3.21Å; Y1706-L1708 VanDerWaalsContact C-N 3.28Å; Y1706-L1708 PolarHBondContact O-N 3.42Å; L1708-F1711 PolarHBondContact O-N 2.94Å; L1708-N1712 WeakPolarHBondContact O-CB 3.34Å; L1708-N1712 PolarHBondContact O-N 3.29Å; L1708-N1712 PolarHBondContact O-ND2 2.93Å; L1708-N1712 VanDerWaalsContact O-ND2 3.14Å; L1708-L1756 HydrophobicContact CD1-CD2 3.63Å
1709	N	86.9	Confident	84.6	Confident	83 Å²	83	43.7 Å²	43.7	44%	0.444	20%	0.198	S	C	.	.	H	α-helix	trans	-64	-45.1	171.4	-70.3	-16.2	0	0	0	111.7	K1705 Y1706 F1711 N1712 E1713	K1705-N1709 PolarHBondContact O-N 3.05Å; Y1706-N1709 WeakPolarHBondContact O-CB 3.26Å; Y1706-N1709 PolarHBondContact O-N 2.91Å; Y1706-N1709 VanDerWaalsContact O-N 3.11Å; N1709-F1711 VanDerWaalsContact C-N 3.33Å; N1709-F1711 PolarHBondContact O-N 2.96Å; N1709-N1712 CarbonylContact O-C 3.59Å; N1709-N1712 WeakPolarHBondContact O-CB 3.39Å; N1709-N1712 PolarHBondContact O-N 3.13Å; N1709-E1713 PolarHBondContact O-N 3.44Å
1710	I	87.7	Confident	83.9	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-66.5	-34.4	177.5	-51.8	170.2	0	0	0	111.7	I1327 L1329 I1332 Y1706 F1707 N1712 E1713 A1714	I1327-I1710 HydrophobicContact CB-CD1 4.18Å; I1327-I1710 HydrophobicContact CG2-CD1 3.75Å; L1329-I1710 HydrophobicContact CD2-CG2 3.49Å; L1329-I1710 VanDerWaalsContact CD2-CG2 3.49Å; L1329-I1710 HydrophobicContact CG-CG2 4Å; I1332-I1710 HydrophobicContact CD1-CB 4.16Å; I1332-I1710 HydrophobicContact CD1-CD1 4.14Å; I1332-I1710 HydrophobicContact CD1-CG2 3.45Å; I1332-I1710 VanDerWaalsContact CD1-CG2 3.45Å; Y1706-I1710 HydrophobicContact CD1-CD1 3.75Å; Y1706-I1710 HydrophobicContact CD1-CG1 4.23Å; Y1706-I1710 HydrophobicContact CE1-CD1 3.58Å; Y1706-I1710 HydrophobicContact CE1-CG1 4.04Å; Y1706-I1710 WeakPolarHBondContact O-CG1 3.27Å; Y1706-I1710 PolarHBondContact O-N 2.72Å; F1707-I1710 HydrophobicContact CD1-CD1 3.83Å; F1707-I1710 HydrophobicContact CE1-CD1 3.96Å; F1707-I1710 PolarHBondContact O-N 3.25Å; I1710-N1712 VanDerWaalsContact C-N 3.34Å; I1710-E1713 CarbonylContact O-C 3.56Å; I1710-E1713 PolarHBondContact O-N 3.4Å; I1710-A1714 WeakPolarHBondContact O-CB 3.44Å; I1710-A1714 PolarHBondContact O-N 2.91Å
1711	F	87.8	Confident	83.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-37.4	173.5	-178.5	-91.9	0	0	0	111.2	F1642 L1643 L1649 A1652 L1656 F1707 L1708 N1709 E1713 A1714 I1715 L1756	F1642-F1711 HydrophobicContact CE1-CZ 4.35Å; L1643-F1711 HydrophobicContact CD2-CE2 4.14Å; L1643-F1711 HydrophobicContact CD2-CZ 4.11Å; L1649-F1711 HydrophobicContact CD1-CD2 4.05Å; L1649-F1711 HydrophobicContact CD1-CE1 4.47Å; L1649-F1711 HydrophobicContact CD1-CE2 3.52Å; L1649-F1711 HydrophobicContact CD1-CZ 3.78Å; L1649-F1711 HydrophobicContact CG-CE2 4.03Å; L1649-F1711 HydrophobicContact CG-CZ 4.4Å; A1652-F1711 HydrophobicContact CB-CB 4.16Å; A1652-F1711 HydrophobicContact CB-CD2 3.77Å; A1652-F1711 HydrophobicContact CB-CG 4.45Å; L1656-F1711 HydrophobicContact CD1-CB 3.6Å; L1656-F1711 HydrophobicContact CD1-CD1 4.17Å; L1656-F1711 HydrophobicContact CD1-CD2 4.11Å; L1656-F1711 HydrophobicContact CD1-CG 3.69Å; L1656-F1711 HydrophobicContact CG-CB 4.41Å; F1707-F1711 VanDerWaalsContact O-CB 3.3Å; F1707-F1711 WeakPolarHBondContact O-CB 3.4Å; F1707-F1711 PolarHBondContact O-N 3.32Å; L1708-F1711 PolarHBondContact O-N 2.94Å; N1709-F1711 VanDerWaalsContact C-N 3.33Å; N1709-F1711 PolarHBondContact O-N 2.96Å; F1711-E1713 VanDerWaalsContact C-N 3.34Å; F1711-A1714 WeakPolarHBondContact O-CB 3.39Å; F1711-A1714 PolarHBondContact O-N 3.22Å; F1711-I1715 HydrophobicContact CD1-CD1 4.03Å; F1711-I1715 HydrophobicContact CD1-CG1 4.39Å; F1711-I1715 HydrophobicContact CE1-CD1 3.44Å; F1711-I1715 VanDerWaalsContact CE1-CD1 3.44Å; F1711-I1715 HydrophobicContact CE1-CG1 3.93Å; F1711-I1715 HydrophobicContact CZ-CD1 4.16Å; F1711-I1715 HydrophobicContact CZ-CG1 4.33Å; F1711-I1715 WeakPolarHBondContact O-CB 3.37Å; F1711-I1715 PolarHBondContact O-N 3.24Å; F1711-L1756 HydrophobicContact CD1-CD1 4.03Å; F1711-L1756 HydrophobicContact CD1-CD2 3.43Å; F1711-L1756 VanDerWaalsContact CD1-CD2 3.43Å; F1711-L1756 HydrophobicContact CD1-CG 4.36Å; F1711-L1756 HydrophobicContact CE1-CD1 3.42Å; F1711-L1756 VanDerWaalsContact CE1-CD1 3.42Å; F1711-L1756 HydrophobicContact CE1-CD2 3.54Å; F1711-L1756 HydrophobicContact CE1-CG 4.03Å; F1711-L1756 HydrophobicContact CZ-CD1 3.88Å
1712	N	85.9	Confident	82.2	Confident	35 Å²	35	44.1 Å²	44.1	19%	0.187	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-37.6	171	-69.8	-24.1	0	0	0	111.6	L1708 N1709 I1710 I1715 D1716 R1753	L1708-N1712 WeakPolarHBondContact O-CB 3.34Å; L1708-N1712 PolarHBondContact O-N 3.29Å; L1708-N1712 PolarHBondContact O-ND2 2.93Å; L1708-N1712 VanDerWaalsContact O-ND2 3.14Å; N1709-N1712 CarbonylContact O-C 3.59Å; N1709-N1712 WeakPolarHBondContact O-CB 3.39Å; N1709-N1712 PolarHBondContact O-N 3.13Å; I1710-N1712 VanDerWaalsContact C-N 3.34Å; N1712-I1715 WeakPolarHBondContact O-CB 3.47Å; N1712-I1715 PolarHBondContact O-N 2.83Å; N1712-D1716 PolarHBondContact O-N 3.3Å; N1712-R1753 PolarHBondContact O-NH2 3.4Å; N1712-R1753 WeakPolarHBondContact OD1-CG 3.49Å
1713	E	84.6	Confident	81.1	Confident	110 Å²	110	41.4 Å²	41.4	51%	0.514	20%	0.196	S	C	.	.	H	α-helix	trans	-70.8	-32	170.6	-71.8	-176	-176.7	0	0	112.5	L1329 N1709 I1710 F1711 I1715 D1716 Y1717	L1329-E1713 HydrophobicContact CD1-CB 4.13Å; L1329-E1713 HydrophobicContact CG-CB 4.5Å; N1709-E1713 PolarHBondContact O-N 3.44Å; I1710-E1713 CarbonylContact O-C 3.56Å; I1710-E1713 PolarHBondContact O-N 3.4Å; F1711-E1713 VanDerWaalsContact C-N 3.34Å; E1713-I1715 VanDerWaalsContact C-N 3.35Å; E1713-D1716 PolarHBondContact O-N 3.32Å; E1713-Y1717 WeakPolarHBondContact O-CA 3.32Å; E1713-Y1717 WeakPolarHBondContact O-CB 3.23Å; E1713-Y1717 PolarHBondContact O-N 3.43Å
1714	A	86.2	Confident	79.5	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.5	-39.5	173.7	0	0	0	0	0	109.9	L1329 I1648 L1649 A1652 I1710 F1711 V1718	L1329-A1714 HydrophobicContact CD2-CB 3.63Å; I1648-A1714 HydrophobicContact CG2-CB 4.29Å; L1649-A1714 HydrophobicContact CD1-CB 3.91Å; A1652-A1714 HydrophobicContact CB-CB 4.02Å; I1710-A1714 WeakPolarHBondContact O-CB 3.44Å; I1710-A1714 PolarHBondContact O-N 2.91Å; F1711-A1714 WeakPolarHBondContact O-CB 3.39Å; F1711-A1714 PolarHBondContact O-N 3.22Å; A1714-V1718 WeakPolarHBondContact O-CB 3.32Å; A1714-V1718 WeakPolarHBondContact O-CG2 3.4Å; A1714-V1718 PolarHBondContact O-N 3.45Å
1715	I	83.1	Confident	77.8	Confident	0 Å²	0	47 Å²	47	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.5	-47.7	169.6	-91.6	-178	0	0	0	110.9	L1649 F1711 N1712 E1713 V1718 A1719 A1749 R1752 R1753	L1649-I1715 HydrophobicContact CD1-CB 4.49Å; L1649-I1715 HydrophobicContact CD1-CG1 3.73Å; F1711-I1715 HydrophobicContact CD1-CD1 4.03Å; F1711-I1715 HydrophobicContact CD1-CG1 4.39Å; F1711-I1715 HydrophobicContact CE1-CD1 3.44Å; F1711-I1715 VanDerWaalsContact CE1-CD1 3.44Å; F1711-I1715 HydrophobicContact CE1-CG1 3.93Å; F1711-I1715 HydrophobicContact CZ-CD1 4.16Å; F1711-I1715 HydrophobicContact CZ-CG1 4.33Å; F1711-I1715 WeakPolarHBondContact O-CB 3.37Å; F1711-I1715 PolarHBondContact O-N 3.24Å; N1712-I1715 WeakPolarHBondContact O-CB 3.47Å; N1712-I1715 PolarHBondContact O-N 2.83Å; E1713-I1715 VanDerWaalsContact C-N 3.35Å; I1715-V1718 CarbonylContact O-C 3.48Å; I1715-A1719 WeakPolarHBondContact O-CB 3.1Å; I1715-A1719 PolarHBondContact O-N 3.31Å; I1715-A1749 HydrophobicContact CG2-CB 3.71Å; I1715-R1752 HydrophobicContact CD1-CB 3.82Å; I1715-R1753 HydrophobicContact CD1-CG 3.87Å; I1715-R1753 HydrophobicContact CG2-CG 4.12Å
1716	D	80.1	Confident	76	Confident	50 Å²	50	42.9 Å²	42.9	27%	0.267	21%	0.206	S	C	.	.	H	α-helix	trans	-80.1	-31	-176.8	-86.1	3.1	0	0	0	113.2	N1712 E1713 A1719 I1720 R1753	N1712-D1716 PolarHBondContact O-N 3.3Å; E1713-D1716 PolarHBondContact O-N 3.32Å; D1716-A1719 PolarHBondContact O-N 2.57Å; D1716-I1720 WeakPolarHBondContact O-CG1 3.46Å; D1716-I1720 PolarHBondContact O-N 3.1Å; D1716-R1753 VanDerWaalsContact CG-NH1 3.34Å; D1716-R1753 IonicContact OD1-CZ 2.65Å; D1716-R1753 VanDerWaalsContact OD1-CZ 3.31Å; D1716-R1753 IonicContact OD1-NH1 2.75Å; D1716-R1753 PolarHBondContact OD1-NH1 3.2Å; D1716-R1753 IonicContact OD1-NH2 3.78Å; D1716-R1753 PolarHBondContact OD1-NH2 2.88Å; D1716-R1753 IonicContact OD2-CZ 2.57Å; D1716-R1753 VanDerWaalsContact OD2-CZ 3.3Å; D1716-R1753 IonicContact OD2-NH1 3.68Å; D1716-R1753 PolarHBondContact OD2-NH1 3.18Å; D1716-R1753 IonicContact OD2-NH2 3.88Å; D1716-R1753 PolarHBondContact OD2-NH2 3.45Å
1717	Y	79.9	Confident	74.1	Confident	122 Å²	122	44.3 Å²	44.3	48%	0.478	22%	0.217	S	C	.	.	H	α-helix	trans	-61.7	-55.2	168.5	179.2	-92.3	0	0	0	108.3	L1329 I1648 E1713 A1719 I1720 E1721	L1329-Y1717 HydrophobicContact CD1-CG 4.32Å; I1648-Y1717 HydrophobicContact CD1-CD1 4.22Å; I1648-Y1717 HydrophobicContact CD1-CE1 3.89Å; E1713-Y1717 WeakPolarHBondContact O-CA 3.32Å; E1713-Y1717 WeakPolarHBondContact O-CB 3.23Å; E1713-Y1717 PolarHBondContact O-N 3.43Å; Y1717-A1719 PolarHBondContact O-N 3.39Å; Y1717-A1719 VanDerWaalsContact O-N 3.16Å; Y1717-I1720 PolarHBondContact O-N 3.37Å; Y1717-E1721 VanDerWaalsContact CE1-OE1 3.3Å; Y1717-E1721 WeakPolarHBondContact CE1-OE1 3.39Å; Y1717-E1721 WeakPolarHBondContact O-CA 3.38Å; Y1717-E1721 WeakPolarHBondContact O-CB 3.46Å; Y1717-E1721 PolarHBondContact O-N 2.86Å
1718	V	74.5	Confident	71.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-55.1	-29.4	172.1	170.2	0	0	0	0	111.2	S1507 H1646 L1649 A1714 I1715 E1721	S1507-V1718 WeakPolarHBondContact OG-CG1 3.44Å; S1507-V1718 PolarHBondContact OG-O 3Å; H1646-V1718 HydrophobicContact CB-CG1 4.46Å; H1646-V1718 HydrophobicContact CB-CG2 3.83Å; L1649-V1718 HydrophobicContact CB-CG2 4.12Å; A1714-V1718 WeakPolarHBondContact O-CB 3.32Å; A1714-V1718 WeakPolarHBondContact O-CG2 3.4Å; A1714-V1718 PolarHBondContact O-N 3.45Å; I1715-V1718 CarbonylContact O-C 3.48Å; V1718-E1721 WeakPolarHBondContact CA-OE2 3.41Å; V1718-E1721 CarbonylContact O-C 3.2Å; V1718-E1721 WeakPolarHBondContact O-CA 3.46Å; V1718-E1721 VanDerWaalsContact O-CB 3.28Å; V1718-E1721 WeakPolarHBondContact O-CB 3.37Å
1719	A	75.5	Confident	69.6	Low	2 Å²	2	52.1 Å²	52.1	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-83	-46	-179.7	0	0	0	0	0	116	T1508 L1510 I1715 D1716 Y1717 E1721 T1722 A1749	T1508-A1719 VanDerWaalsContact CG2-CA 3.48Å; T1508-A1719 HydrophobicContact CG2-CB 3.61Å; T1508-A1719 WeakPolarHBondContact CG2-O 3.26Å; T1508-A1719 PolarHBondContact OG1-O 3.05Å; L1510-A1719 HydrophobicContact CD2-CB 3.4Å; L1510-A1719 VanDerWaalsContact CD2-CB 3.4Å; I1715-A1719 WeakPolarHBondContact O-CB 3.1Å; I1715-A1719 PolarHBondContact O-N 3.31Å; D1716-A1719 PolarHBondContact O-N 2.57Å; Y1717-A1719 PolarHBondContact O-N 3.39Å; Y1717-A1719 VanDerWaalsContact O-N 3.16Å; A1719-E1721 CarbonylContact O-C 3.51Å; A1719-E1721 PolarHBondContact O-N 3.46Å; A1719-T1722 PolarHBondContact O-N 3.24Å; A1719-A1749 HydrophobicContact CB-CB 4.49Å
1720	I	70.6	Confident	67.2	Low	106 Å²	106	53.1 Å²	53.1	54%	0.544	26%	0.261	S	S	.	.	H	α-helix	trans	-58.4	-34.7	167.9	-67.4	165.6	0	0	0	108.1	D1716 Y1717 T1722 T1723	D1716-I1720 WeakPolarHBondContact O-CG1 3.46Å; D1716-I1720 PolarHBondContact O-N 3.1Å; Y1717-I1720 PolarHBondContact O-N 3.37Å; I1720-T1722 PolarHBondContact O-N 3.38Å; I1720-T1723 PolarHBondContact O-N 3.19Å; I1720-T1723 PolarHBondContact O-OG1 3.46Å
1721	E	68.3	Low	64.7	Low	36 Å²	36	57.3 Å²	57.3	17%	0.168	29%	0.29	C	S	.	.	H	α-helix	trans	-66.4	47.5	158.5	-169.1	-154.1	-111.9	0	0	113.2	L1506 S1507 H1646 Y1717 V1718 A1719	L1506-E1721 CarbonylContact C-O 3.48Å; L1506-E1721 VanDerWaalsContact C-O 3.3Å; L1506-E1721 WeakPolarHBondContact CA-O 3.46Å; L1506-E1721 HydrophobicContact CB-CG 4.33Å; L1506-E1721 WeakPolarHBondContact CB-O 3.39Å; L1506-E1721 HydrophobicContact CD1-CB 3.8Å; L1506-E1721 HydrophobicContact CD1-CG 3.17Å; L1506-E1721 VanDerWaalsContact CD2-CA 3.46Å; L1506-E1721 HydrophobicContact CD2-CB 4.37Å; L1506-E1721 HydrophobicContact CD2-CG 4.49Å; L1506-E1721 HydrophobicContact CG-CB 3.79Å; L1506-E1721 HydrophobicContact CG-CG 3.46Å; L1506-E1721 VanDerWaalsContact CG-CG 3.46Å; L1506-E1721 WeakPolarHBondContact CG-O 3.39Å; S1507-E1721 WeakPolarHBondContact CA-O 3.18Å; S1507-E1721 WeakPolarHBondContact CB-O 3.23Å; S1507-E1721 PolarHBondContact N-O 2.7Å; S1507-E1721 PolarHBondContact OG-O 3.25Å; H1646-E1721 IonicContact CE1-OE2 2.68Å; H1646-E1721 PolarHBondContact CE1-OE2 2.84Å; H1646-E1721 IonicContact CG-OE2 2.66Å; H1646-E1721 IonicContact ND1-OE2 3.91Å; H1646-E1721 PolarHBondContact ND1-OE2 3.02Å; Y1717-E1721 VanDerWaalsContact CE1-OE1 3.3Å; Y1717-E1721 WeakPolarHBondContact CE1-OE1 3.39Å; Y1717-E1721 WeakPolarHBondContact O-CA 3.38Å; Y1717-E1721 WeakPolarHBondContact O-CB 3.46Å; Y1717-E1721 PolarHBondContact O-N 2.86Å; V1718-E1721 WeakPolarHBondContact CA-OE2 3.41Å; V1718-E1721 CarbonylContact O-C 3.2Å; V1718-E1721 WeakPolarHBondContact O-CA 3.46Å; V1718-E1721 VanDerWaalsContact O-CB 3.28Å; V1718-E1721 WeakPolarHBondContact O-CB 3.37Å; A1719-E1721 CarbonylContact O-C 3.51Å; A1719-E1721 PolarHBondContact O-N 3.46Å
1722	T	64.9	Low	62	Low	4 Å²	4	64.5 Å²	64.5	3%	0.025	33%	0.327	C	S	.	.	H	α-helix		-114.8	-44	121.8	-36.5	0	0	0	0	114.2	L1506 S1507 T1508 A1719 I1720 Q1724 L1725 K1726 E1745	L1506-T1722 VanDerWaalsContact CB-CA 3.49Å; L1506-T1722 HydrophobicContact CB-CG2 4.09Å; L1506-T1722 WeakPolarHBondContact CB-O 3.45Å; L1506-T1722 WeakPolarHBondContact CD2-O 3.05Å; S1507-T1722 WeakPolarHBondContact CA-OG1 3.49Å; S1507-T1722 PolarHBondContact N-OG1 3.4Å; S1507-T1722 VanDerWaalsContact N-OG1 3.16Å; S1507-T1722 PolarHBondContact O-OG1 3.06Å; T1508-T1722 WeakPolarHBondContact CA-OG1 3.43Å; T1508-T1722 WeakPolarHBondContact CB-OG1 3.12Å; T1508-T1722 PolarHBondContact N-OG1 3.42Å; T1508-T1722 PolarHBondContact O-OG1 3.28Å; T1508-T1722 WeakPolarHBondContact OG1-CA 2.95Å; T1508-T1722 VanDerWaalsContact OG1-CB 3.27Å; T1508-T1722 WeakPolarHBondContact OG1-CB 3.28Å; T1508-T1722 PolarHBondContact OG1-N 3.33Å; T1508-T1722 PolarHBondContact OG1-OG1 3.14Å; A1719-T1722 PolarHBondContact O-N 3.24Å; I1720-T1722 PolarHBondContact O-N 3.38Å; T1722-Q1724 CarbonylContact O-C 3.49Å; T1722-Q1724 PolarHBondContact O-N 3.4Å; T1722-L1725 HydrophobicContact CG2-CB 4.08Å; T1722-L1725 PolarHBondContact O-N 3.35Å; T1722-K1726 VanDerWaalsContact CB-NZ 3.3Å; T1722-K1726 HydrophobicContact CG2-CD 3.63Å; T1722-K1726 HydrophobicContact CG2-CG 3.91Å; T1722-K1726 VanDerWaalsContact CG2-NZ 3.34Å; T1722-K1726 PolarHBondContact OG1-NZ 3.17Å; T1722-K1726 VanDerWaalsContact OG1-NZ 3.11Å; T1722-E1745 WeakPolarHBondContact CA-OE2 3.33Å; T1722-E1745 WeakPolarHBondContact CB-OE1 3.44Å; T1722-E1745 WeakPolarHBondContact CB-OE2 3.33Å; T1722-E1745 PolarHBondContact N-OE2 3.39Å; T1722-E1745 PolarHBondContact OG1-OE2 3.02Å
1723	T	60.3	Low	59.3	Low	23 Å²	23	69.2 Å²	69.2	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-32.3	-50.8	-164.5	58.1	0	0	0	0	113.1	I1720 L1725 K1726 I1727 E1745	I1720-T1723 PolarHBondContact O-N 3.19Å; I1720-T1723 PolarHBondContact O-OG1 3.46Å; T1723-L1725 PolarHBondContact O-N 3.38Å; T1723-K1726 PolarHBondContact O-N 3.47Å; T1723-I1727 VanDerWaalsContact O-CB 3.3Å; T1723-I1727 WeakPolarHBondContact O-CB 3.39Å; T1723-I1727 WeakPolarHBondContact O-CD1 3.37Å; T1723-I1727 WeakPolarHBondContact O-CG1 3.3Å; T1723-I1727 PolarHBondContact O-N 2.93Å; T1723-E1745 WeakPolarHBondContact CA-OE2 3.39Å; T1723-E1745 HydrophobicContact CG2-CB 4.09Å; T1723-E1745 HydrophobicContact CG2-CG 4.32Å; T1723-E1745 WeakPolarHBondContact CG2-OE2 3.32Å; T1723-E1745 PolarHBondContact N-OE2 3.43Å
1724	Q	52.8	Low	56.8	Low	101 Å²	101	71.3 Å²	71.3	47%	0.472	37%	0.367	S	S	.	.	H	α-helix	trans	-67.6	-22	-177	-32.9	176.4	3.1	0	0	116	L1506 T1722 N1728	L1506-Q1724 HydrophobicContact CD2-CB 3.41Å; L1506-Q1724 VanDerWaalsContact CD2-CB 3.41Å; L1506-Q1724 HydrophobicContact CD2-CG 3.7Å; L1506-Q1724 VanDerWaalsContact CD2-N 3.33Å; T1722-Q1724 CarbonylContact O-C 3.49Å; T1722-Q1724 PolarHBondContact O-N 3.4Å; Q1724-N1728 WeakPolarHBondContact O-CB 3.46Å; Q1724-N1728 PolarHBondContact O-N 2.88Å; Q1724-N1728 PolarHBondContact O-ND2 3.37Å
1725	L	53	Low	54.2	Low	48 Å²	48	79.7 Å²	79.7	25%	0.251	41%	0.405	S	S	.	.	H	α-helix	trans	-69.3	-51.6	167.7	-126.1	-168.6	0	0	0	109.8	S1505 L1506 T1722 T1723 I1727 N1728 N1729	S1505-L1725 VanDerWaalsContact C-CG 3.46Å; S1505-L1725 WeakPolarHBondContact OG-CA 3.47Å; S1505-L1725 WeakPolarHBondContact OG-CG 3.23Å; S1505-L1725 PolarHBondContact OG-N 2.95Å; L1506-L1725 HydrophobicContact CB-CB 3.61Å; L1506-L1725 HydrophobicContact CB-CD1 4.28Å; L1506-L1725 HydrophobicContact CB-CG 3.93Å; L1506-L1725 VanDerWaalsContact N-CD1 3.34Å; T1722-L1725 HydrophobicContact CG2-CB 4.08Å; T1722-L1725 PolarHBondContact O-N 3.35Å; T1723-L1725 PolarHBondContact O-N 3.38Å; L1725-I1727 VanDerWaalsContact C-N 3.32Å; L1725-N1728 PolarHBondContact O-N 3.28Å; L1725-N1729 WeakPolarHBondContact CD2-ND2 3.36Å; L1725-N1729 WeakPolarHBondContact O-CB 3.44Å; L1725-N1729 PolarHBondContact O-N 3.44Å; L1725-N1729 PolarHBondContact O-ND2 2.87Å
1726	K	49.4	Very low	51.7	Low	63 Å²	63	86.3 Å²	86.3	27%	0.274	44%	0.441	S	S	.	.	H	α-helix	trans	-66.8	-41	-175.4	-70	159	-173.7	156.3	0	109.1	T1508 T1722 T1723 N1729 Q1730 Y1741 E1745	T1508-K1726 PolarHBondContact O-NZ 3Å; T1722-K1726 VanDerWaalsContact CB-NZ 3.3Å; T1722-K1726 HydrophobicContact CG2-CD 3.63Å; T1722-K1726 HydrophobicContact CG2-CG 3.91Å; T1722-K1726 VanDerWaalsContact CG2-NZ 3.34Å; T1722-K1726 PolarHBondContact OG1-NZ 3.17Å; T1722-K1726 VanDerWaalsContact OG1-NZ 3.11Å; T1723-K1726 PolarHBondContact O-N 3.47Å; K1726-N1729 CarbonylContact O-C 2.85Å; K1726-N1729 PolarHBondContact O-N 2.8Å; K1726-Q1730 WeakPolarHBondContact O-CB 3.16Å; K1726-Q1730 WeakPolarHBondContact O-CG 3.13Å; K1726-Q1730 PolarHBondContact O-N 3.27Å; K1726-Y1741 HydrophobicContact CD-CE1 4.32Å; K1726-E1745 VanDerWaalsContact CD-OE1 3.25Å; K1726-E1745 WeakPolarHBondContact CD-OE1 3.42Å; K1726-E1745 IonicContact NZ-OE1 3.03Å; K1726-E1745 PolarHBondContact NZ-OE1 3.02Å
1727	I	47.4	Very low	49.5	Very low	91 Å²	91	90.3 Å²	90.3	47%	0.467	46%	0.462	S	S	.	.	H	α-helix	trans	-66.7	-48.8	176.1	-68	165	0	0	0	111.5	T1723 L1725 N1729 Q1730 S1731	T1723-I1727 VanDerWaalsContact O-CB 3.3Å; T1723-I1727 WeakPolarHBondContact O-CB 3.39Å; T1723-I1727 WeakPolarHBondContact O-CD1 3.37Å; T1723-I1727 WeakPolarHBondContact O-CG1 3.3Å; T1723-I1727 PolarHBondContact O-N 2.93Å; L1725-I1727 VanDerWaalsContact C-N 3.32Å; I1727-N1729 PolarHBondContact O-N 3.15Å; I1727-Q1730 PolarHBondContact O-N 3.17Å; I1727-S1731 PolarHBondContact O-N 2.78Å
1728	N	41.3	Very low	47.4	Very low	93 Å²	93	90.7 Å²	90.7	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-65.9	-21.5	178.6	-71.4	-8.5	0	0	0	113	Q1724 L1725	Q1724-N1728 WeakPolarHBondContact O-CB 3.46Å; Q1724-N1728 PolarHBondContact O-N 2.88Å; Q1724-N1728 PolarHBondContact O-ND2 3.37Å; L1725-N1728 PolarHBondContact O-N 3.28Å
1729	N	40.7	Very low	45.9	Very low	125 Å²	125	98.2 Å²	98.2	67%	0.668	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	6.6	171.1	-70.6	-63.3	0	0	0	114.3	L1725 K1726 I1727	L1725-N1729 WeakPolarHBondContact CD2-ND2 3.36Å; L1725-N1729 WeakPolarHBondContact O-CB 3.44Å; L1725-N1729 PolarHBondContact O-N 3.44Å; L1725-N1729 PolarHBondContact O-ND2 2.87Å; K1726-N1729 CarbonylContact O-C 2.85Å; K1726-N1729 PolarHBondContact O-N 2.8Å; I1727-N1729 PolarHBondContact O-N 3.15Å
1730	Q	38.2	Very low	44.5	Very low	105 Å²	105	105 Å²	105	49%	0.491	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128	-4.3	178.1	-71.6	177.7	24.3	0	0	114	K1726 I1727 I1732 N1733 Y1741	K1726-Q1730 WeakPolarHBondContact O-CB 3.16Å; K1726-Q1730 WeakPolarHBondContact O-CG 3.13Å; K1726-Q1730 PolarHBondContact O-N 3.27Å; I1727-Q1730 PolarHBondContact O-N 3.17Å; Q1730-I1732 PolarHBondContact O-N 3.11Å; Q1730-N1733 PolarHBondContact O-N 3.26Å; Q1730-Y1741 PolarHBondContact NE2-OH 3.37Å; Q1730-Y1741 PolarHBondContact OE1-OH 2.82Å; Q1730-Y1741 VanDerWaalsContact OE1-OH 3.04Å
1731	S	33.8	Very low	43.4	Very low	89 Å²	89	104.9 Å²	104.9	62%	0.622	54%	0.538	S	S	*	.			trans	-72.1	18.7	-179.2	57.7	0	0	0	0	115.8	I1727	I1727-S1731 PolarHBondContact O-N 2.78Å
1732	I	32.4	Very low	42.6	Very low	152 Å²	152	108.3 Å²	108.3	78%	0.779	56%	0.556	S	S	*	*	S	Bend	trans	-130.4	66.1	160.9	-46.1	179.9	0	0	0	109.9	Q1730	Q1730-I1732 PolarHBondContact O-N 3.11Å
1733	N	29.3	Very low	42.5	Very low	133 Å²	133	110.5 Å²	110.5	71%	0.711	57%	0.572	S	S	*	*	S	Bend		-179.2	142.2	125.7	-94.6	-58.7	0	0	0	112.3	Q1730	Q1730-N1733 PolarHBondContact O-N 3.26Å
1734	N	31.5	Very low	42.4	Very low	155 Å²	155	114.1 Å²	114.1	83%	0.829	59%	0.587	S	S	*	*			trans	60.1	105.9	172.3	-66.2	-4	0	0	0	118.5	N1736	N1734-N1736 PolarHBondContact O-N 3.07Å
1735	H	31.2	Very low	42.8	Very low	175 Å²	175	109.9 Å²	109.9	81%	0.81	57%	0.567	S	S	*	*			trans	-56.8	119	148.4	-84.8	-68.5	0	0	0	110.3
1736	N	31.5	Very low	43.3	Very low	140 Å²	140	113 Å²	113	75%	0.749	58%	0.581	S	S	*	*			trans	152.2	86.4	137.5	-78	-17.3	0	0	0	111	N1734	N1734-N1736 PolarHBondContact O-N 3.07Å
1737	N	33.6	Very low	44.1	Very low	133 Å²	133	113.3 Å²	113.3	71%	0.711	58%	0.584	S	S	*	*			trans	171.5	65.3	144.9	-88.7	-15	0	0	0	112	N1739	N1737-N1739 PolarHBondContact O-N 3.11Å
1738	N	35.8	Very low	44.9	Very low	131 Å²	131	111 Å²	111	70%	0.701	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-7.5	-173.3	-72.7	19.9	0	0	0	115.2
1739	N	43.2	Very low	46.2	Very low	157 Å²	157	106.6 Å²	106.6	84%	0.84	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-7.6	-171.3	-70.4	10.3	0	0	0	115.1	N1737	N1737-N1739 PolarHBondContact O-N 3.11Å
1740	Q	45.9	Very low	47.4	Very low	144 Å²	144	103.2 Å²	103.2	67%	0.673	53%	0.532	S	S	*	.	S	Bend	trans	-103.9	-18	-171.5	-161.2	169.4	10.2	0	0	114.6	S1743	Q1740-S1743 PolarHBondContact O-OG 2.91Å
1741	Y	46.5	Very low	48.9	Very low	105 Å²	105	100 Å²	100	41%	0.412	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-34.7	177.8	-103.1	-80.3	0	0	0	113	K1726 Q1730 Q1744 E1745	K1726-Y1741 HydrophobicContact CD-CE1 4.32Å; Q1730-Y1741 PolarHBondContact NE2-OH 3.37Å; Q1730-Y1741 PolarHBondContact OE1-OH 2.82Å; Q1730-Y1741 VanDerWaalsContact OE1-OH 3.04Å; Y1741-Q1744 CarbonylContact O-C 3.57Å; Y1741-Q1744 PolarHBondContact O-N 3.31Å; Y1741-E1745 PolarHBondContact O-N 3.46Å
1742	I	52.7	Low	50.5	Low	107 Å²	107	97.6 Å²	97.6	55%	0.549	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-38.4	-175.1	-62.2	175.9	0	0	0	111.3	E1745 Q1746	I1742-E1745 CarbonylContact O-C 3.55Å; I1742-E1745 VanDerWaalsContact O-CA 3.29Å; I1742-E1745 WeakPolarHBondContact O-CA 3.47Å; I1742-E1745 PolarHBondContact O-N 3.19Å; I1742-Q1746 WeakPolarHBondContact O-CB 3.49Å; I1742-Q1746 PolarHBondContact O-N 2.74Å
1743	S	61.2	Low	52.4	Low	51 Å²	51	93.4 Å²	93.4	36%	0.357	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-69.3	-41.2	175.2	56.4	0	0	0	0	112	N1511 Q1740 E1745 Q1746	N1511-S1743 VanDerWaalsContact CB-O 3.23Å; N1511-S1743 WeakPolarHBondContact CB-O 3.38Å; N1511-S1743 PolarHBondContact N-O 3.18Å; N1511-S1743 VanDerWaalsContact N-O 3.11Å; Q1740-S1743 PolarHBondContact O-OG 2.91Å; S1743-E1745 PolarHBondContact O-N 3.27Å; S1743-Q1746 PolarHBondContact O-N 3.45Å
1744	Q	58	Low	54.3	Low	99 Å²	99	91.7 Å²	91.7	46%	0.463	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-65.2	-4	169.9	-162.9	55.5	74.9	0	0	113.3	S1509 L1510 N1511 Y1741	S1509-Q1744 VanDerWaalsContact O-O 3.1Å; L1510-Q1744 CarbonylContact C-O 3.54Å; L1510-Q1744 WeakPolarHBondContact CA-O 3.5Å; L1510-Q1744 PolarHBondContact N-O 2.77Å; N1511-Q1744 HydrophobicContact CB-CB 4.39Å; N1511-Q1744 PolarHBondContact N-O 3.4Å; N1511-Q1744 PolarHBondContact O-NE2 3.19Å; Y1741-Q1744 CarbonylContact O-C 3.57Å; Y1741-Q1744 PolarHBondContact O-N 3.31Å
1745	E	62.6	Low	56	Low	12 Å²	12	88 Å²	88	6%	0.056	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-124.5	31.5	163.8	-60	-161.8	-158	0	0	112.5	T1508 L1510 T1722 T1723 K1726 Y1741 I1742 S1743	T1508-E1745 HydrophobicContact CG2-CB 4.3Å; T1508-E1745 HydrophobicContact CG2-CG 4.43Å; T1508-E1745 PolarHBondContact OG1-OE2 2.82Å; L1510-E1745 HydrophobicContact CD2-CB 4.44Å; L1510-E1745 WeakPolarHBondContact CD2-O 3.44Å; T1722-E1745 WeakPolarHBondContact CA-OE2 3.33Å; T1722-E1745 WeakPolarHBondContact CB-OE1 3.44Å; T1722-E1745 WeakPolarHBondContact CB-OE2 3.33Å; T1722-E1745 PolarHBondContact N-OE2 3.39Å; T1722-E1745 PolarHBondContact OG1-OE2 3.02Å; T1723-E1745 WeakPolarHBondContact CA-OE2 3.39Å; T1723-E1745 HydrophobicContact CG2-CB 4.09Å; T1723-E1745 HydrophobicContact CG2-CG 4.32Å; T1723-E1745 WeakPolarHBondContact CG2-OE2 3.32Å; T1723-E1745 PolarHBondContact N-OE2 3.43Å; K1726-E1745 VanDerWaalsContact CD-OE1 3.25Å; K1726-E1745 WeakPolarHBondContact CD-OE1 3.42Å; K1726-E1745 IonicContact NZ-OE1 3.03Å; K1726-E1745 PolarHBondContact NZ-OE1 3.02Å; Y1741-E1745 PolarHBondContact O-N 3.46Å; I1742-E1745 CarbonylContact O-C 3.55Å; I1742-E1745 VanDerWaalsContact O-CA 3.29Å; I1742-E1745 WeakPolarHBondContact O-CA 3.47Å; I1742-E1745 PolarHBondContact O-N 3.19Å; S1743-E1745 PolarHBondContact O-N 3.27Å
1746	Q	63.9	Low	57.9	Low	114 Å²	114	79.9 Å²	79.9	53%	0.533	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	-0	165.3	-139	-166.2	-23.1	0	0	120.3	L1510 I1742 S1743 N1750	L1510-Q1746 VanDerWaalsContact CD1-O 3.26Å; L1510-Q1746 WeakPolarHBondContact CD1-O 3.36Å; L1510-Q1746 VanDerWaalsContact CG-N 3.27Å; I1742-Q1746 WeakPolarHBondContact O-CB 3.49Å; I1742-Q1746 PolarHBondContact O-N 2.74Å; S1743-Q1746 PolarHBondContact O-N 3.45Å; Q1746-N1750 PolarHBondContact O-ND2 3.21Å; Q1746-N1750 VanDerWaalsContact O-ND2 3.15Å
1747	I	65.6	Low	59.7	Low	69 Å²	69	77.6 Å²	77.6	35%	0.354	40%	0.4	S	S	.	.	S	Bend	trans	-123.4	-25.5	176.4	-23.1	-169.5	0	0	0	123.5	L1510 N1511 N1750 S1751	L1510-I1747 VanDerWaalsContact CD1-CA 3.49Å; N1511-I1747 HydrophobicContact CB-CG1 4.47Å; N1511-I1747 WeakPolarHBondContact OD1-CD1 3.49Å; N1511-I1747 WeakPolarHBondContact OD1-CG1 3.25Å; I1747-N1750 HydrophobicContact CG2-CB 4.04Å; I1747-N1750 CarbonylContact O-C 3.23Å; I1747-N1750 WeakPolarHBondContact O-CA 3.48Å; I1747-N1750 VanDerWaalsContact O-CB 3.23Å; I1747-N1750 WeakPolarHBondContact O-CB 3.37Å; I1747-N1750 PolarHBondContact O-N 3.38Å; I1747-S1751 PolarHBondContact O-N 3.14Å
1748	V	64.9	Low	61.4	Low	43 Å²	43	77.1 Å²	77.1	26%	0.261	39%	0.394	S	S	.	.	H	α-helix	trans	-70.4	-23.9	166.8	159.7	0	0	0	0	117	L1510 S1751 R1752	L1510-V1748 HydrophobicContact CB-CB 3.75Å; L1510-V1748 WeakPolarHBondContact O-CA 3.36Å; L1510-V1748 WeakPolarHBondContact O-CB 3.37Å; L1510-V1748 WeakPolarHBondContact O-CG2 3.31Å; L1510-V1748 PolarHBondContact O-N 2.77Å; V1748-S1751 VanDerWaalsContact C-N 3.28Å; V1748-S1751 WeakPolarHBondContact CA-OG 3.44Å; V1748-S1751 CarbonylContact O-C 3.56Å; V1748-S1751 VanDerWaalsContact O-CA 3.26Å; V1748-S1751 WeakPolarHBondContact O-CA 3.38Å; V1748-S1751 WeakPolarHBondContact O-CB 3.31Å; V1748-S1751 PolarHBondContact O-N 2.91Å; V1748-S1751 VanDerWaalsContact O-N 3.08Å; V1748-S1751 PolarHBondContact O-OG 3.35Å; V1748-R1752 WeakPolarHBondContact O-CG 3.39Å; V1748-R1752 PolarHBondContact O-N 3.32Å
1749	A	67.5	Low	63.1	Low	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-84.1	-15.2	165	0	0	0	0	0	112	L1510 I1715 A1719 S1751 R1752 R1753	L1510-A1749 HydrophobicContact CB-CB 4.47Å; L1510-A1749 VanDerWaalsContact CB-N 3.26Å; L1510-A1749 VanDerWaalsContact CD1-CA 3.44Å; L1510-A1749 HydrophobicContact CD1-CB 3.56Å; L1510-A1749 HydrophobicContact CD2-CB 4.07Å; L1510-A1749 HydrophobicContact CG-CB 4.21Å; I1715-A1749 HydrophobicContact CG2-CB 3.71Å; A1719-A1749 HydrophobicContact CB-CB 4.49Å; A1749-S1751 VanDerWaalsContact C-N 3.34Å; A1749-R1752 HydrophobicContact CB-CB 4.18Å; A1749-R1752 HydrophobicContact CB-CG 4.11Å; A1749-R1752 CarbonylContact O-C 3.58Å; A1749-R1752 PolarHBondContact O-N 3.36Å; A1749-R1753 VanDerWaalsContact O-CG 3.29Å; A1749-R1753 WeakPolarHBondContact O-CG 3.35Å; A1749-R1753 PolarHBondContact O-N 3.23Å
1750	N	67.1	Low	64.5	Low	53 Å²	53	64.8 Å²	64.8	28%	0.283	33%	0.327	S	S	.	.	H	α-helix	trans	-65.5	-39.2	149.6	-67.4	-15.2	0	0	0	109.8	L1510 Q1746 I1747 R1752 R1753 T1754	L1510-N1750 VanDerWaalsContact CD1-N 3.33Å; Q1746-N1750 PolarHBondContact O-ND2 3.21Å; Q1746-N1750 VanDerWaalsContact O-ND2 3.15Å; I1747-N1750 HydrophobicContact CG2-CB 4.04Å; I1747-N1750 CarbonylContact O-C 3.23Å; I1747-N1750 WeakPolarHBondContact O-CA 3.48Å; I1747-N1750 VanDerWaalsContact O-CB 3.23Å; I1747-N1750 WeakPolarHBondContact O-CB 3.37Å; I1747-N1750 PolarHBondContact O-N 3.38Å; N1750-R1752 VanDerWaalsContact C-N 3.3Å; N1750-R1752 PolarHBondContact O-N 3.3Å; N1750-R1753 CarbonylContact O-C 3.18Å; N1750-R1753 WeakPolarHBondContact O-CA 3.34Å; N1750-R1753 VanDerWaalsContact O-CB 3.26Å; N1750-R1753 WeakPolarHBondContact O-CB 3.3Å; N1750-R1753 PolarHBondContact O-N 3.44Å; N1750-R1753 PolarHBondContact OD1-NH1 3.42Å; N1750-T1754 PolarHBondContact O-N 2.73Å; N1750-T1754 PolarHBondContact O-OG1 3.32Å
1751	S	67.7	Low	65.8	Low	37 Å²	37	63.4 Å²	63.4	26%	0.259	32%	0.321	S	S	.	.	H	α-helix	trans	-68.4	-22.9	168.9	97.5	0	0	0	0	113.9	I1747 V1748 A1749 T1754 M1755	I1747-S1751 PolarHBondContact O-N 3.14Å; V1748-S1751 VanDerWaalsContact C-N 3.28Å; V1748-S1751 WeakPolarHBondContact CA-OG 3.44Å; V1748-S1751 CarbonylContact O-C 3.56Å; V1748-S1751 VanDerWaalsContact O-CA 3.26Å; V1748-S1751 WeakPolarHBondContact O-CA 3.38Å; V1748-S1751 WeakPolarHBondContact O-CB 3.31Å; V1748-S1751 PolarHBondContact O-N 2.91Å; V1748-S1751 VanDerWaalsContact O-N 3.08Å; V1748-S1751 PolarHBondContact O-OG 3.35Å; A1749-S1751 VanDerWaalsContact C-N 3.34Å; S1751-T1754 PolarHBondContact O-N 3.33Å; S1751-M1755 VanDerWaalsContact O-CB 3.28Å; S1751-M1755 WeakPolarHBondContact O-CB 3.43Å; S1751-M1755 VanDerWaalsContact O-CE 3.29Å; S1751-M1755 WeakPolarHBondContact O-CE 3.12Å; S1751-M1755 VanDerWaalsContact O-CG 3.22Å; S1751-M1755 WeakPolarHBondContact O-CG 3.22Å; S1751-M1755 PolarHBondContact O-N 3.34Å
1752	R	68.8	Low	67	Low	40 Å²	40	60.3 Å²	60.3	15%	0.151	31%	0.308	C	S	.	.	H	α-helix	trans	-71.4	-31.5	166	-62.6	-178.6	-179.9	156.3	-8.1	111.2	F1642 I1715 V1748 A1749 N1750 M1755 L1756	F1642-R1752 HydrophobicContact CD2-CG 4.29Å; F1642-R1752 HydrophobicContact CE2-CB 3.63Å; F1642-R1752 HydrophobicContact CE2-CG 3.6Å; F1642-R1752 HydrophobicContact CZ-CB 3.86Å; F1642-R1752 HydrophobicContact CZ-CG 4.31Å; I1715-R1752 HydrophobicContact CD1-CB 3.82Å; V1748-R1752 WeakPolarHBondContact O-CG 3.39Å; V1748-R1752 PolarHBondContact O-N 3.32Å; A1749-R1752 HydrophobicContact CB-CB 4.18Å; A1749-R1752 HydrophobicContact CB-CG 4.11Å; A1749-R1752 CarbonylContact O-C 3.58Å; A1749-R1752 PolarHBondContact O-N 3.36Å; N1750-R1752 VanDerWaalsContact C-N 3.3Å; N1750-R1752 PolarHBondContact O-N 3.3Å; R1752-M1755 HydrophobicContact CG-CE 4.39Å; R1752-L1756 WeakPolarHBondContact O-CB 3.36Å; R1752-L1756 PolarHBondContact O-N 2.6Å
1753	R	72	Confident	68	Low	64 Å²	64	55.2 Å²	55.2	24%	0.242	28%	0.282	C	S	.	.	H	α-helix	trans	-69.3	-40	168.3	-67.1	166.2	164.3	153	-7.8	111.3	N1712 I1715 D1716 A1749 N1750 L1756	N1712-R1753 PolarHBondContact O-NH2 3.4Å; N1712-R1753 WeakPolarHBondContact OD1-CG 3.49Å; I1715-R1753 HydrophobicContact CD1-CG 3.87Å; I1715-R1753 HydrophobicContact CG2-CG 4.12Å; D1716-R1753 VanDerWaalsContact CG-NH1 3.34Å; D1716-R1753 IonicContact OD1-CZ 2.65Å; D1716-R1753 VanDerWaalsContact OD1-CZ 3.31Å; D1716-R1753 IonicContact OD1-NH1 2.75Å; D1716-R1753 PolarHBondContact OD1-NH1 3.2Å; D1716-R1753 IonicContact OD1-NH2 3.78Å; D1716-R1753 PolarHBondContact OD1-NH2 2.88Å; D1716-R1753 IonicContact OD2-CZ 2.57Å; D1716-R1753 VanDerWaalsContact OD2-CZ 3.3Å; D1716-R1753 IonicContact OD2-NH1 3.68Å; D1716-R1753 PolarHBondContact OD2-NH1 3.18Å; D1716-R1753 IonicContact OD2-NH2 3.88Å; D1716-R1753 PolarHBondContact OD2-NH2 3.45Å; A1749-R1753 VanDerWaalsContact O-CG 3.29Å; A1749-R1753 WeakPolarHBondContact O-CG 3.35Å; A1749-R1753 PolarHBondContact O-N 3.23Å; N1750-R1753 CarbonylContact O-C 3.18Å; N1750-R1753 WeakPolarHBondContact O-CA 3.34Å; N1750-R1753 VanDerWaalsContact O-CB 3.26Å; N1750-R1753 WeakPolarHBondContact O-CB 3.3Å; N1750-R1753 PolarHBondContact O-N 3.44Å; N1750-R1753 PolarHBondContact OD1-NH1 3.42Å; R1753-L1756 VanDerWaalsContact O-CB 3.23Å; R1753-L1756 WeakPolarHBondContact O-CB 3.32Å; R1753-L1756 PolarHBondContact O-N 3Å
1754	T	69	Low	68.8	Low	97 Å²	97	56.1 Å²	56.1	60%	0.595	28%	0.278	S	S	*	.	H	α-helix	trans	-66.1	-50.2	175.6	-50.7	0	0	0	0	111.3	N1750 S1751 L1756	N1750-T1754 PolarHBondContact O-N 2.73Å; N1750-T1754 PolarHBondContact O-OG1 3.32Å; S1751-T1754 PolarHBondContact O-N 3.33Å; T1754-L1756 PolarHBondContact O-N 2.69Å
1755	M	66.3	Low	69.6	Low	76 Å²	76	55.5 Å²	55.5	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-67.6	-10.7	174.5	-68.5	-179.3	-63.1	0	0	113.1	F1642 S1751 R1752 T1757 F1759	F1642-M1755 HydrophobicContact CE2-CE 4.35Å; S1751-M1755 VanDerWaalsContact O-CB 3.28Å; S1751-M1755 WeakPolarHBondContact O-CB 3.43Å; S1751-M1755 VanDerWaalsContact O-CE 3.29Å; S1751-M1755 WeakPolarHBondContact O-CE 3.12Å; S1751-M1755 VanDerWaalsContact O-CG 3.22Å; S1751-M1755 WeakPolarHBondContact O-CG 3.22Å; S1751-M1755 PolarHBondContact O-N 3.34Å; R1752-M1755 HydrophobicContact CG-CE 4.39Å; M1755-T1757 VanDerWaalsContact C-N 3.32Å; M1755-T1757 PolarHBondContact O-N 2.65Å; M1755-F1759 WeakPolarHBondContact O-CB 3.25Å; M1755-F1759 PolarHBondContact O-N 2.89Å
1756	L	72.4	Confident	70.2	Confident	5 Å²	5	55 Å²	55	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-38.3	-180	-177.9	59.4	0	0	0	111.6	L1708 F1711 R1752 R1753 T1754 F1759 L1760	L1708-L1756 HydrophobicContact CD1-CD2 3.63Å; F1711-L1756 HydrophobicContact CD1-CD1 4.03Å; F1711-L1756 HydrophobicContact CD1-CD2 3.43Å; F1711-L1756 VanDerWaalsContact CD1-CD2 3.43Å; F1711-L1756 HydrophobicContact CD1-CG 4.36Å; F1711-L1756 HydrophobicContact CE1-CD1 3.42Å; F1711-L1756 VanDerWaalsContact CE1-CD1 3.42Å; F1711-L1756 HydrophobicContact CE1-CD2 3.54Å; F1711-L1756 HydrophobicContact CE1-CG 4.03Å; F1711-L1756 HydrophobicContact CZ-CD1 3.88Å; R1752-L1756 WeakPolarHBondContact O-CB 3.36Å; R1752-L1756 PolarHBondContact O-N 2.6Å; R1753-L1756 VanDerWaalsContact O-CB 3.23Å; R1753-L1756 WeakPolarHBondContact O-CB 3.32Å; R1753-L1756 PolarHBondContact O-N 3Å; T1754-L1756 PolarHBondContact O-N 2.69Å; L1756-F1759 PolarHBondContact O-N 3.19Å; L1756-L1760 HydrophobicContact CD1-CD1 4.07Å; L1756-L1760 HydrophobicContact CD1-CG 4.02Å; L1756-L1760 HydrophobicContact CD2-CD1 4.46Å; L1756-L1760 HydrophobicContact CG-CD1 3.86Å; L1756-L1760 HydrophobicContact CG-CG 4.26Å; L1756-L1760 WeakPolarHBondContact O-CB 3.46Å; L1756-L1760 WeakPolarHBondContact O-CG 3.38Å; L1756-L1760 PolarHBondContact O-N 3.18Å
1757	T	69.9	Low	70.9	Confident	92 Å²	92	49.9 Å²	49.9	56%	0.564	25%	0.249	S	C	*	.	H	α-helix	trans	-65.1	-51.8	-178.6	-38.7	0	0	0	0	110.4	M1755 F1759 L1760 E1761	M1755-T1757 VanDerWaalsContact C-N 3.32Å; M1755-T1757 PolarHBondContact O-N 2.65Å; T1757-F1759 PolarHBondContact O-N 3.24Å; T1757-L1760 PolarHBondContact O-N 3.4Å; T1757-E1761 VanDerWaalsContact O-CB 3.32Å; T1757-E1761 WeakPolarHBondContact O-CB 3.39Å; T1757-E1761 PolarHBondContact O-N 2.94Å
1758	E	68	Low	71.5	Confident	124 Å²	124	52.5 Å²	52.5	58%	0.579	26%	0.26	S	S	*	.	H	α-helix	trans	-53.9	-42.5	173.2	-59.8	170.6	-176.4	0	0	111.3	E1761 W1762	E1758-E1761 PolarHBondContact O-N 3.4Å; E1758-W1762 WeakPolarHBondContact O-CB 3.33Å; E1758-W1762 PolarHBondContact O-N 3.35Å
1759	F	70.9	Confident	71.9	Confident	15 Å²	15	51.3 Å²	51.3	7%	0.066	25%	0.252	C	S	.	.	H	α-helix	trans	-77.3	-26.5	-176.4	-167.9	-95.9	0	0	0	114.1	Y1635 Q1638 L1639 F1642 Y1653 M1755 L1756 T1757 W1762 G1763	Y1635-F1759 HydrophobicContact CE2-CZ 4.13Å; Q1638-F1759 HydrophobicContact CB-CE2 3.87Å; L1639-F1759 HydrophobicContact CB-CZ 3.94Å; L1639-F1759 HydrophobicContact CD1-CE1 3.34Å; L1639-F1759 HydrophobicContact CD1-CZ 3.36Å; L1639-F1759 HydrophobicContact CG-CZ 4.28Å; F1642-F1759 HydrophobicContact CD1-CD1 4.31Å; F1642-F1759 HydrophobicContact CD1-CE1 4.42Å; F1642-F1759 HydrophobicContact CE1-CD1 4.28Å; Y1653-F1759 HydrophobicContact CE1-CE1 4.37Å; Y1653-F1759 AromaticContact CE2-CD1 3.72Å; Y1653-F1759 HydrophobicContact CE2-CD1 3.72Å; Y1653-F1759 AromaticContact CE2-CE1 3.71Å; Y1653-F1759 HydrophobicContact CE2-CE1 3.71Å; Y1653-F1759 AromaticContact CZ-CE1 3.59Å; Y1653-F1759 WeakPolarHBondContact OH-CE1 3.25Å; M1755-F1759 WeakPolarHBondContact O-CB 3.25Å; M1755-F1759 PolarHBondContact O-N 2.89Å; L1756-F1759 PolarHBondContact O-N 3.19Å; T1757-F1759 PolarHBondContact O-N 3.24Å; F1759-W1762 HydrophobicContact CD2-CE3 4.29Å; F1759-W1762 HydrophobicContact CD2-CZ3 4.45Å; F1759-W1762 HydrophobicContact CE2-CE3 4.15Å; F1759-W1762 AromaticContact CE2-CZ3 3.93Å; F1759-W1762 HydrophobicContact CE2-CZ3 3.93Å; F1759-G1763 WeakPolarHBondContact O-CA 3.21Å; F1759-G1763 PolarHBondContact O-N 2.85Å; F1759-G1763 VanDerWaalsContact O-N 3.13Å
1760	L	73.9	Confident	72.5	Confident	14 Å²	14	51.7 Å²	51.7	7%	0.073	25%	0.254	C	S	.	.	H	α-helix	trans	-75.1	-41.6	168.5	-75.5	169.4	0	0	0	110.7	Y1653 L1756 T1757 G1763 R1764	Y1653-L1760 HydrophobicContact CD2-CD2 4.32Å; Y1653-L1760 HydrophobicContact CE2-CD2 3.7Å; Y1653-L1760 HydrophobicContact CE2-CG 4.48Å; L1756-L1760 HydrophobicContact CD1-CD1 4.07Å; L1756-L1760 HydrophobicContact CD1-CG 4.02Å; L1756-L1760 HydrophobicContact CD2-CD1 4.46Å; L1756-L1760 HydrophobicContact CG-CD1 3.86Å; L1756-L1760 HydrophobicContact CG-CG 4.26Å; L1756-L1760 WeakPolarHBondContact O-CB 3.46Å; L1756-L1760 WeakPolarHBondContact O-CG 3.38Å; L1756-L1760 PolarHBondContact O-N 3.18Å; T1757-L1760 PolarHBondContact O-N 3.4Å; L1760-G1763 CarbonylContact O-C 3.58Å; L1760-G1763 WeakPolarHBondContact O-CA 3.35Å; L1760-G1763 PolarHBondContact O-N 3.23Å; L1760-R1764 WeakPolarHBondContact O-CG 3.28Å; L1760-R1764 PolarHBondContact O-N 2.89Å
1761	E	72.8	Confident	73	Confident	115 Å²	115	50.5 Å²	50.5	54%	0.537	25%	0.25	S	C	.	.	H	α-helix	trans	-64.4	-54.6	-180	-176.1	163.5	-144.4	0	0	112.5	T1757 E1758 G1763 R1764 E1765	T1757-E1761 VanDerWaalsContact O-CB 3.32Å; T1757-E1761 WeakPolarHBondContact O-CB 3.39Å; T1757-E1761 PolarHBondContact O-N 2.94Å; E1758-E1761 PolarHBondContact O-N 3.4Å; E1761-G1763 PolarHBondContact O-N 3.39Å; E1761-R1764 WeakPolarHBondContact O-CB 3.25Å; E1761-R1764 PolarHBondContact O-N 2.81Å; E1761-E1765 PolarHBondContact O-N 3.18Å
1762	W	71.9	Confident	73.6	Confident	39 Å²	39	52.3 Å²	52.3	15%	0.148	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-28.6	170.9	178.4	63.6	0	0	0	112.5	Y1631 A1634 Y1635 Q1638 E1758 F1759 R1764 E1765 F1766	Y1631-W1762 HydrophobicContact CD1-CZ2 4.12Å; Y1631-W1762 AromaticContact CD1-NE1 3.44Å; Y1631-W1762 AromaticContact CE1-NE1 3.5Å; Y1631-W1762 HydrophobicContact CG-CZ2 4.43Å; Y1631-W1762 AromaticContact CG-NE1 3.78Å; Y1631-W1762 AromaticContact CZ-NE1 3.84Å; A1634-W1762 HydrophobicContact CB-CH2 3.96Å; A1634-W1762 HydrophobicContact CB-CZ2 3.94Å; Y1635-W1762 AromaticContact CD2-CE3 3.99Å; Y1635-W1762 HydrophobicContact CD2-CE3 3.99Å; Y1635-W1762 HydrophobicContact CD2-CH2 4.06Å; Y1635-W1762 AromaticContact CD2-CZ3 3.63Å; Y1635-W1762 HydrophobicContact CD2-CZ3 3.63Å; Y1635-W1762 HydrophobicContact CG-CH2 4.43Å; Y1635-W1762 HydrophobicContact CG-CZ3 4.37Å; Q1638-W1762 HydrophobicContact CB-CH2 4.46Å; Q1638-W1762 HydrophobicContact CB-CZ3 4.09Å; Q1638-W1762 HydrophobicContact CG-CH2 4.34Å; Q1638-W1762 HydrophobicContact CG-CZ3 4.3Å; E1758-W1762 WeakPolarHBondContact O-CB 3.33Å; E1758-W1762 PolarHBondContact O-N 3.35Å; F1759-W1762 HydrophobicContact CD2-CE3 4.29Å; F1759-W1762 HydrophobicContact CD2-CZ3 4.45Å; F1759-W1762 HydrophobicContact CE2-CE3 4.15Å; F1759-W1762 AromaticContact CE2-CZ3 3.93Å; F1759-W1762 HydrophobicContact CE2-CZ3 3.93Å; W1762-R1764 VanDerWaalsContact C-N 3.26Å; W1762-R1764 PolarHBondContact O-N 3.24Å; W1762-E1765 PolarHBondContact O-N 3.34Å; W1762-F1766 PolarHBondContact O-N 2.98Å
1763	G	74.4	Confident	74.3	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.9	-35.3	169.3	0	0	0	0	0	113.1	K1657 F1759 L1760 E1761 D1767	K1657-G1763 PolarHBondContact NZ-O 3.21Å; F1759-G1763 WeakPolarHBondContact O-CA 3.21Å; F1759-G1763 PolarHBondContact O-N 2.85Å; F1759-G1763 VanDerWaalsContact O-N 3.13Å; L1760-G1763 CarbonylContact O-C 3.58Å; L1760-G1763 WeakPolarHBondContact O-CA 3.35Å; L1760-G1763 PolarHBondContact O-N 3.23Å; E1761-G1763 PolarHBondContact O-N 3.39Å; G1763-D1767 PolarHBondContact O-N 2.75Å; G1763-D1767 VanDerWaalsContact O-OD2 3.07Å
1764	R	77.8	Confident	74.7	Confident	71 Å²	71	48 Å²	48	27%	0.268	24%	0.238	S	C	.	.	H	α-helix	trans	-78.7	-35.4	177.4	-72.5	179.1	-69.1	-113.3	2.1	112.8	D1660 I1662 L1760 E1761 W1762 F1766 D1767 Q1768	D1660-R1764 IonicContact OD2-CZ 2.68Å; D1660-R1764 IonicContact OD2-NH1 3.89Å; D1660-R1764 PolarHBondContact OD2-NH1 3.02Å; I1662-R1764 VanDerWaalsContact CD1-CZ 3.49Å; L1760-R1764 WeakPolarHBondContact O-CG 3.28Å; L1760-R1764 PolarHBondContact O-N 2.89Å; E1761-R1764 WeakPolarHBondContact O-CB 3.25Å; E1761-R1764 PolarHBondContact O-N 2.81Å; W1762-R1764 VanDerWaalsContact C-N 3.26Å; W1762-R1764 PolarHBondContact O-N 3.24Å; R1764-F1766 PolarHBondContact O-N 3Å; R1764-D1767 PolarHBondContact O-N 3.3Å; R1764-Q1768 WeakPolarHBondContact O-CB 2.41Å; R1764-Q1768 PolarHBondContact O-N 2.78Å
1765	E	73.1	Confident	75.4	Confident	86 Å²	86	45.6 Å²	45.6	40%	0.402	22%	0.22	S	C	.	.	H	α-helix	trans	-55.1	-42	169.6	-66.8	-168.6	170.8	0	0	111.2	Y1631 E1761 W1762 T1769	Y1631-E1765 HydrophobicContact CE2-CB 4.45Å; Y1631-E1765 WeakPolarHBondContact CE2-OE2 3.26Å; Y1631-E1765 PolarHBondContact OH-OE2 3.43Å; E1761-E1765 PolarHBondContact O-N 3.18Å; W1762-E1765 PolarHBondContact O-N 3.34Å; E1765-T1769 WeakPolarHBondContact O-CB 2.44Å; E1765-T1769 PolarHBondContact O-N 3.35Å; E1765-T1769 VanDerWaalsContact O-N 3.14Å; E1765-T1769 PolarHBondContact O-OG1 2.97Å
1766	F	76.7	Confident	76.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-52.2	175.6	-175	-77.7	0	0	0	111.5	P1483 I1628 L1632 Y1635 W1762 R1764 Q1768 T1769 W1770	P1483-F1766 HydrophobicContact CB-CE1 3.88Å; P1483-F1766 HydrophobicContact CB-CZ 4.45Å; P1483-F1766 HydrophobicContact CG-CD1 4.06Å; P1483-F1766 HydrophobicContact CG-CE1 3.44Å; P1483-F1766 VanDerWaalsContact CG-CE1 3.44Å; P1483-F1766 HydrophobicContact CG-CZ 4.34Å; I1628-F1766 HydrophobicContact CD1-CD2 4.49Å; I1628-F1766 HydrophobicContact CD1-CE1 4.01Å; I1628-F1766 HydrophobicContact CD1-CE2 3.93Å; I1628-F1766 HydrophobicContact CD1-CZ 3.64Å; I1628-F1766 HydrophobicContact CG1-CD2 4.03Å; I1628-F1766 HydrophobicContact CG1-CE1 4.45Å; I1628-F1766 HydrophobicContact CG1-CE2 3.46Å; I1628-F1766 VanDerWaalsContact CG1-CE2 3.46Å; I1628-F1766 HydrophobicContact CG1-CZ 3.69Å; L1632-F1766 HydrophobicContact CB-CE2 4.28Å; L1632-F1766 HydrophobicContact CD1-CE2 3.8Å; L1632-F1766 HydrophobicContact CD1-CZ 3.63Å; Y1635-F1766 HydrophobicContact CD2-CB 4.5Å; Y1635-F1766 HydrophobicContact CD2-CG 4.49Å; Y1635-F1766 HydrophobicContact CG-CD2 4.23Å; Y1635-F1766 HydrophobicContact CG-CG 4.42Å; W1762-F1766 PolarHBondContact O-N 2.98Å; R1764-F1766 PolarHBondContact O-N 3Å; F1766-Q1768 VanDerWaalsContact C-N 3.34Å; F1766-Q1768 PolarHBondContact O-N 2.94Å; F1766-T1769 PolarHBondContact O-N 3.44Å; F1766-W1770 HydrophobicContact CD1-CB 4.48Å; F1766-W1770 HydrophobicContact CE1-CB 4.07Å; F1766-W1770 WeakPolarHBondContact O-CB 3.44Å; F1766-W1770 PolarHBondContact O-N 3.42Å
1767	D	77.7	Confident	76.6	Confident	8 Å²	8	44.4 Å²	44.4	4%	0.043	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-42.5	-177.5	-54.8	-31.2	0	0	0	112.2	D1480 K1657 G1763 R1764 W1770 S1771	D1480-D1767 HydrophobicContact CB-CB 4.15Å; K1657-D1767 IonicContact NZ-OD1 3.54Å; K1657-D1767 PolarHBondContact NZ-OD1 2.99Å; K1657-D1767 IonicContact NZ-OD2 3.33Å; K1657-D1767 PolarHBondContact NZ-OD2 3.36Å; G1763-D1767 PolarHBondContact O-N 2.75Å; G1763-D1767 VanDerWaalsContact O-OD2 3.07Å; R1764-D1767 PolarHBondContact O-N 3.3Å; D1767-W1770 PolarHBondContact O-N 2.69Å; D1767-S1771 WeakPolarHBondContact O-CB 3.39Å; D1767-S1771 PolarHBondContact O-N 2.96Å; D1767-S1771 PolarHBondContact O-OG 2.88Å
1768	Q	77.7	Confident	77.4	Confident	124 Å²	124	40.7 Å²	40.7	58%	0.579	19%	0.191	S	C	*	.	H	α-helix	trans	-64.1	-43.7	178.7	-171.7	-178.5	16.4	0	0	110.7	R1764 F1766 W1770 S1771 H1772	R1764-Q1768 WeakPolarHBondContact O-CB 2.41Å; R1764-Q1768 PolarHBondContact O-N 2.78Å; F1766-Q1768 VanDerWaalsContact C-N 3.34Å; F1766-Q1768 PolarHBondContact O-N 2.94Å; Q1768-W1770 VanDerWaalsContact C-N 3.32Å; Q1768-W1770 PolarHBondContact O-N 3.02Å; Q1768-S1771 PolarHBondContact O-N 3.38Å; Q1768-H1772 PolarHBondContact O-N 3.34Å; Q1768-H1772 PolarHBondContact O-ND1 2.95Å
1769	T	74.8	Confident	78.2	Confident	18 Å²	18	37.3 Å²	37.3	11%	0.11	18%	0.177	C	C	.	.	H	α-helix	trans	-67.9	-34.1	176.1	-45.6	0	0	0	0	112	Y1626 I1628 E1765 F1766 F1773	Y1626-T1769 HydrophobicContact CD1-CG2 4.41Å; I1628-T1769 HydrophobicContact CB-CG2 3.59Å; I1628-T1769 HydrophobicContact CG2-CG2 3.94Å; E1765-T1769 WeakPolarHBondContact O-CB 2.44Å; E1765-T1769 PolarHBondContact O-N 3.35Å; E1765-T1769 VanDerWaalsContact O-N 3.14Å; E1765-T1769 PolarHBondContact O-OG1 2.97Å; F1766-T1769 PolarHBondContact O-N 3.44Å; T1769-F1773 PolarHBondContact O-N 2.88Å
1770	W	78.9	Confident	78.7	Confident	8 Å²	8	38.9 Å²	38.9	3%	0.03	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-42.6	176.1	177.4	-100.8	0	0	0	111.1	L1369 W1373 I1628 F1766 D1767 Q1768 F1773 Q1774	L1369-W1770 HydrophobicContact CD2-CH2 4.12Å; L1369-W1770 HydrophobicContact CD2-CZ3 4.31Å; L1369-W1770 HydrophobicContact CG-CH2 4.36Å; W1373-W1770 HydrophobicContact CB-CZ2 4.04Å; W1373-W1770 AromaticContact CD2-CE2 3.89Å; W1373-W1770 AromaticContact CD2-CH2 3.52Å; W1373-W1770 HydrophobicContact CD2-CH2 3.52Å; W1373-W1770 AromaticContact CD2-CZ2 3.23Å; W1373-W1770 HydrophobicContact CD2-CZ2 3.23Å; W1373-W1770 HydrophobicContact CD2-CZ3 4.4Å; W1373-W1770 AromaticContact CE2-CH2 3.62Å; W1373-W1770 AromaticContact CE2-CZ2 3.87Å; W1373-W1770 AromaticContact CE3-CD2 3.93Å; W1373-W1770 HydrophobicContact CE3-CD2 3.93Å; W1373-W1770 AromaticContact CE3-CE2 3.15Å; W1373-W1770 HydrophobicContact CE3-CE3 4.4Å; W1373-W1770 AromaticContact CE3-CH2 3.62Å; W1373-W1770 HydrophobicContact CE3-CH2 3.62Å; W1373-W1770 AromaticContact CE3-CZ2 3.02Å; W1373-W1770 HydrophobicContact CE3-CZ2 3.02Å; W1373-W1770 HydrophobicContact CE3-CZ3 4.26Å; W1373-W1770 AromaticContact CE3-NE1 3.48Å; W1373-W1770 HydrophobicContact CG-CH2 4.06Å; W1373-W1770 AromaticContact CG-CZ2 3.71Å; W1373-W1770 HydrophobicContact CG-CZ2 3.71Å; W1373-W1770 HydrophobicContact CH2-CD2 4.11Å; W1373-W1770 AromaticContact CH2-CE3 3.94Å; W1373-W1770 HydrophobicContact CH2-CE3 3.94Å; W1373-W1770 AromaticContact CH2-CH2 3.93Å; W1373-W1770 HydrophobicContact CH2-CH2 3.93Å; W1373-W1770 HydrophobicContact CH2-CZ2 4.11Å; W1373-W1770 AromaticContact CH2-CZ3 3.83Å; W1373-W1770 HydrophobicContact CH2-CZ3 3.83Å; W1373-W1770 AromaticContact CZ2-CH2 3.83Å; W1373-W1770 HydrophobicContact CZ2-CH2 3.83Å; W1373-W1770 HydrophobicContact CZ2-CZ2 4.27Å; W1373-W1770 AromaticContact CZ2-CZ3 3.97Å; W1373-W1770 HydrophobicContact CZ2-CZ3 3.97Å; W1373-W1770 AromaticContact CZ3-CD2 3.55Å; W1373-W1770 HydrophobicContact CZ3-CD2 3.55Å; W1373-W1770 AromaticContact CZ3-CE2 3.3Å; W1373-W1770 AromaticContact CZ3-CE3 3.86Å; W1373-W1770 HydrophobicContact CZ3-CE3 3.86Å; W1373-W1770 HydrophobicContact CZ3-CG 4.24Å; W1373-W1770 AromaticContact CZ3-CH2 3.82Å; W1373-W1770 HydrophobicContact CZ3-CH2 3.82Å; W1373-W1770 AromaticContact CZ3-CZ2 3.51Å; W1373-W1770 HydrophobicContact CZ3-CZ2 3.51Å; W1373-W1770 AromaticContact CZ3-CZ3 3.98Å; W1373-W1770 HydrophobicContact CZ3-CZ3 3.98Å; W1373-W1770 AromaticContact CZ3-NE1 3.71Å; I1628-W1770 VanDerWaalsContact CD1-CA 3.43Å; I1628-W1770 HydrophobicContact CD1-CB 3.51Å; I1628-W1770 HydrophobicContact CD1-CD2 4.29Å; I1628-W1770 HydrophobicContact CD1-CE3 3.69Å; I1628-W1770 HydrophobicContact CD1-CG 4.28Å; F1766-W1770 HydrophobicContact CD1-CB 4.48Å; F1766-W1770 HydrophobicContact CE1-CB 4.07Å; F1766-W1770 WeakPolarHBondContact O-CB 3.44Å; F1766-W1770 PolarHBondContact O-N 3.42Å; D1767-W1770 PolarHBondContact O-N 2.69Å; Q1768-W1770 VanDerWaalsContact C-N 3.32Å; Q1768-W1770 PolarHBondContact O-N 3.02Å; W1770-F1773 HydrophobicContact CD2-CD1 4.5Å; W1770-F1773 AromaticContact CE3-CD1 3.9Å; W1770-F1773 HydrophobicContact CE3-CD1 3.9Å; W1770-F1773 HydrophobicContact CE3-CE1 4.49Å; W1770-F1773 AromaticContact CH2-CD1 3.71Å; W1770-F1773 HydrophobicContact CH2-CD1 3.71Å; W1770-F1773 AromaticContact CH2-CE1 3.59Å; W1770-F1773 HydrophobicContact CH2-CE1 3.59Å; W1770-F1773 HydrophobicContact CZ2-CD1 4.29Å; W1770-F1773 HydrophobicContact CZ2-CE1 4.41Å; W1770-F1773 AromaticContact CZ3-CD1 3.5Å; W1770-F1773 HydrophobicContact CZ3-CD1 3.5Å; W1770-F1773 VanDerWaalsContact CZ3-CD1 3.5Å; W1770-F1773 AromaticContact CZ3-CE1 3.65Å; W1770-F1773 HydrophobicContact CZ3-CE1 3.65Å; W1770-F1773 WeakPolarHBondContact O-CB 3.42Å; W1770-F1773 PolarHBondContact O-N 3.35Å; W1770-Q1774 HydrophobicContact CD2-CG 4.41Å; W1770-Q1774 HydrophobicContact CH2-CG 4.43Å; W1770-Q1774 HydrophobicContact CZ2-CG 3.53Å; W1770-Q1774 PolarHBondContact O-N 3.26Å
1771	S	79.3	Confident	79	Confident	28 Å²	28	38.2 Å²	38.2	20%	0.196	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-44	176.6	-60.9	0	0	0	0	112	D1767 Q1768 Q1774 Q1775	D1767-S1771 WeakPolarHBondContact O-CB 3.39Å; D1767-S1771 PolarHBondContact O-N 2.96Å; D1767-S1771 PolarHBondContact O-OG 2.88Å; Q1768-S1771 PolarHBondContact O-N 3.38Å; S1771-Q1774 PolarHBondContact O-N 3.03Å; S1771-Q1775 WeakPolarHBondContact O-CB 3.43Å; S1771-Q1775 PolarHBondContact O-N 3.03Å
1772	H	80.1	Confident	79.3	Confident	75 Å²	75	34.1 Å²	34.1	35%	0.347	16%	0.162	S	C	.	.	H	α-helix	trans	-61.2	-45	172.2	-67.8	141.1	0	0	0	111.9	Y1626 Q1768 Q1774 Q1775 D1776	Y1626-H1772 HydrophobicContact CE1-CB 4.41Å; Q1768-H1772 PolarHBondContact O-N 3.34Å; Q1768-H1772 PolarHBondContact O-ND1 2.95Å; H1772-Q1774 PolarHBondContact O-N 2.92Å; H1772-Q1775 PolarHBondContact O-N 3.29Å; H1772-D1776 WeakPolarHBondContact O-CB 3.18Å; H1772-D1776 PolarHBondContact O-N 3.26Å
1773	F	82.4	Confident	79.7	Confident	11 Å²	11	39.1 Å²	39.1	5%	0.048	19%	0.185	C	C	.	.	H	α-helix	trans	-57.4	-45	175.9	166.6	-98.5	0	0	0	112.4	C1366 L1369 L1592 T1769 W1770 I1777	C1366-F1773 HydrophobicContact CB-CE2 4.27Å; C1366-F1773 HydrophobicContact CB-CZ 4.07Å; L1369-F1773 HydrophobicContact CD2-CE1 4.18Å; L1369-F1773 HydrophobicContact CD2-CZ 4.26Å; L1592-F1773 HydrophobicContact CD2-CD2 4.48Å; L1592-F1773 HydrophobicContact CD2-CE1 4.44Å; L1592-F1773 HydrophobicContact CD2-CE2 3.54Å; L1592-F1773 HydrophobicContact CD2-CZ 3.52Å; T1769-F1773 PolarHBondContact O-N 2.88Å; W1770-F1773 HydrophobicContact CD2-CD1 4.5Å; W1770-F1773 AromaticContact CE3-CD1 3.9Å; W1770-F1773 HydrophobicContact CE3-CD1 3.9Å; W1770-F1773 HydrophobicContact CE3-CE1 4.49Å; W1770-F1773 AromaticContact CH2-CD1 3.71Å; W1770-F1773 HydrophobicContact CH2-CD1 3.71Å; W1770-F1773 AromaticContact CH2-CE1 3.59Å; W1770-F1773 HydrophobicContact CH2-CE1 3.59Å; W1770-F1773 HydrophobicContact CZ2-CD1 4.29Å; W1770-F1773 HydrophobicContact CZ2-CE1 4.41Å; W1770-F1773 AromaticContact CZ3-CD1 3.5Å; W1770-F1773 HydrophobicContact CZ3-CD1 3.5Å; W1770-F1773 VanDerWaalsContact CZ3-CD1 3.5Å; W1770-F1773 AromaticContact CZ3-CE1 3.65Å; W1770-F1773 HydrophobicContact CZ3-CE1 3.65Å; W1770-F1773 WeakPolarHBondContact O-CB 3.42Å; W1770-F1773 PolarHBondContact O-N 3.35Å; F1773-I1777 HydrophobicContact CD2-CG1 4.03Å; F1773-I1777 HydrophobicContact CE1-CG1 4.48Å; F1773-I1777 HydrophobicContact CE2-CD1 4.13Å; F1773-I1777 HydrophobicContact CE2-CG1 3.59Å; F1773-I1777 HydrophobicContact CZ-CG1 3.85Å; F1773-I1777 WeakPolarHBondContact O-CB 3.48Å; F1773-I1777 VanDerWaalsContact O-CG1 3.27Å; F1773-I1777 WeakPolarHBondContact O-CG1 3.5Å; F1773-I1777 PolarHBondContact O-N 3.03Å; F1773-I1777 VanDerWaalsContact O-N 3.08Å
1774	Q	81.7	Confident	79.6	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-42.5	176.6	-67	-162.7	-92.1	0	0	112.2	S1374 W1770 S1771 H1772 W1778 L1794 Y1798	S1374-Q1774 PolarHBondContact OG-NE2 3.49Å; W1770-Q1774 HydrophobicContact CD2-CG 4.41Å; W1770-Q1774 HydrophobicContact CH2-CG 4.43Å; W1770-Q1774 HydrophobicContact CZ2-CG 3.53Å; W1770-Q1774 PolarHBondContact O-N 3.26Å; S1771-Q1774 PolarHBondContact O-N 3.03Å; H1772-Q1774 PolarHBondContact O-N 2.92Å; Q1774-W1778 WeakPolarHBondContact O-CB 3.35Å; Q1774-W1778 PolarHBondContact O-N 3.37Å; Q1774-L1794 HydrophobicContact CB-CD1 4.17Å; Q1774-Y1798 HydrophobicContact CB-CD2 4.38Å; Q1774-Y1798 HydrophobicContact CB-CE2 3.46Å; Q1774-Y1798 VanDerWaalsContact CB-CE2 3.46Å; Q1774-Y1798 HydrophobicContact CG-CE2 4.5Å
1775	Q	83.1	Confident	78.7	Confident	47 Å²	47	46 Å²	46	22%	0.22	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-42.7	178.7	-171.5	-179.4	-18.9	0	0	112	S1771 H1772 W1778 N1779 Y1798	S1771-Q1775 WeakPolarHBondContact O-CB 3.43Å; S1771-Q1775 PolarHBondContact O-N 3.03Å; H1772-Q1775 PolarHBondContact O-N 3.29Å; Q1775-W1778 WeakPolarHBondContact O-CB 3.24Å; Q1775-W1778 PolarHBondContact O-N 2.99Å; Q1775-N1779 WeakPolarHBondContact O-CB 3.48Å; Q1775-N1779 PolarHBondContact O-N 3.33Å; Q1775-N1779 PolarHBondContact O-ND2 3.44Å; Q1775-Y1798 HydrophobicContact CB-CD1 3.63Å; Q1775-Y1798 HydrophobicContact CB-CE1 3.76Å; Q1775-Y1798 HydrophobicContact CB-CG 4.29Å; Q1775-Y1798 HydrophobicContact CG-CD1 3.79Å; Q1775-Y1798 HydrophobicContact CG-CE1 4.35Å; Q1775-Y1798 HydrophobicContact CG-CG 4.44Å
1776	D	81.8	Confident	77.8	Confident	47 Å²	47	50.7 Å²	50.7	25%	0.251	25%	0.246	S	C	.	.	H	α-helix	trans	-73.1	-36.5	-178.7	-69.9	-31.5	0	0	0	112.5	Y1626 H1772 W1778 N1779 E1780	Y1626-D1776 WeakPolarHBondContact CE1-OD2 2.75Å; Y1626-D1776 WeakPolarHBondContact OH-CB 3.5Å; Y1626-D1776 VanDerWaalsContact OH-CG 3.3Å; Y1626-D1776 PolarHBondContact OH-OD2 2.97Å; H1772-D1776 WeakPolarHBondContact O-CB 3.18Å; H1772-D1776 PolarHBondContact O-N 3.26Å; D1776-W1778 VanDerWaalsContact C-N 3.32Å; D1776-N1779 PolarHBondContact O-N 2.77Å; D1776-N1779 PolarHBondContact OD1-ND2 2.91Å; D1776-E1780 WeakPolarHBondContact O-CG 3.37Å; D1776-E1780 PolarHBondContact O-N 2.92Å
1777	I	82.2	Confident	77	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.051	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-35.7	170.7	-68.6	-58.9	0	0	0	111.4	L1363 C1366 L1367 A1370 F1773 S1781	L1363-I1777 HydrophobicContact CD1-CD1 4.09Å; L1363-I1777 HydrophobicContact CD1-CG2 4.4Å; C1366-I1777 HydrophobicContact CB-CD1 3.43Å; C1366-I1777 VanDerWaalsContact CB-CD1 3.43Å; C1366-I1777 HydrophobicContact CB-CG1 3.94Å; C1366-I1777 HydrophobicContact CB-CG2 4.41Å; L1367-I1777 HydrophobicContact CB-CG2 4.01Å; L1367-I1777 HydrophobicContact CD1-CG2 4.19Å; A1370-I1777 HydrophobicContact CB-CG2 4.12Å; F1773-I1777 HydrophobicContact CD2-CG1 4.03Å; F1773-I1777 HydrophobicContact CE1-CG1 4.48Å; F1773-I1777 HydrophobicContact CE2-CD1 4.13Å; F1773-I1777 HydrophobicContact CE2-CG1 3.59Å; F1773-I1777 HydrophobicContact CZ-CG1 3.85Å; F1773-I1777 WeakPolarHBondContact O-CB 3.48Å; F1773-I1777 VanDerWaalsContact O-CG1 3.27Å; F1773-I1777 WeakPolarHBondContact O-CG1 3.5Å; F1773-I1777 PolarHBondContact O-N 3.03Å; F1773-I1777 VanDerWaalsContact O-N 3.08Å; I1777-S1781 VanDerWaalsContact O-CB 3.26Å; I1777-S1781 WeakPolarHBondContact O-CB 3.34Å; I1777-S1781 PolarHBondContact O-N 2.81Å; I1777-S1781 PolarHBondContact O-OG 3.45Å
1778	W	87	Confident	76.5	Confident	13 Å²	13	59 Å²	59	5%	0.049	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-48.3	170.8	177.7	89.5	0	0	0	111.3	Q1774 Q1775 D1776 E1780 S1781 M1782 L1794 N1795 N1799	Q1774-W1778 WeakPolarHBondContact O-CB 3.35Å; Q1774-W1778 PolarHBondContact O-N 3.37Å; Q1775-W1778 WeakPolarHBondContact O-CB 3.24Å; Q1775-W1778 PolarHBondContact O-N 2.99Å; D1776-W1778 VanDerWaalsContact C-N 3.32Å; W1778-E1780 PolarHBondContact O-N 2.78Å; W1778-S1781 PolarHBondContact O-N 3.23Å; W1778-S1781 VanDerWaalsContact O-N 3.14Å; W1778-M1782 HydrophobicContact CD2-CG 3.98Å; W1778-M1782 HydrophobicContact CE3-CG 4.37Å; W1778-M1782 HydrophobicContact CG-CG 4.48Å; W1778-M1782 HydrophobicContact CH2-CE 4.32Å; W1778-M1782 HydrophobicContact CH2-CG 4.2Å; W1778-M1782 HydrophobicContact CZ2-CE 3.65Å; W1778-M1782 HydrophobicContact CZ2-CG 3.82Å; W1778-M1782 HydrophobicContact CZ2-SD 4.18Å; W1778-M1782 HydrophobicContact CZ3-CG 4.47Å; W1778-M1782 WeakPolarHBondContact O-CG 3.27Å; W1778-M1782 PolarHBondContact O-N 3.27Å; W1778-L1794 HydrophobicContact CB-CG 4.4Å; W1778-N1795 PolarHBondContact NE1-OD1 3.4Å; W1778-N1799 HydrophobicContact CH2-CB 4.5Å; W1778-N1799 VanDerWaalsContact CZ2-CA 3.44Å; W1778-N1799 HydrophobicContact CZ2-CB 3.76Å
1779	N	83.8	Confident	76.2	Confident	54 Å²	54	62.1 Å²	62.1	29%	0.289	30%	0.295	S	S	.	.	H	α-helix	trans	-53.6	-51.4	177.2	-73	-32.5	0	0	0	111.8	Q1775 D1776 M1782 K1783	Q1775-N1779 WeakPolarHBondContact O-CB 3.48Å; Q1775-N1779 PolarHBondContact O-N 3.33Å; Q1775-N1779 PolarHBondContact O-ND2 3.44Å; D1776-N1779 PolarHBondContact O-N 2.77Å; D1776-N1779 PolarHBondContact OD1-ND2 2.91Å; N1779-M1782 PolarHBondContact O-N 2.63Å; N1779-K1783 WeakPolarHBondContact O-CG 3.4Å; N1779-K1783 PolarHBondContact O-N 3.16Å
1780	E	81.2	Confident	76.3	Confident	48 Å²	48	62.9 Å²	62.9	22%	0.224	30%	0.298	C	S	.	.	H	α-helix	trans	-64.8	-40.1	177.5	-70.1	-55.1	137.1	0	0	112.1	L1363 D1776 W1778 M1782 K1783 H1784	L1363-E1780 HydrophobicContact CD1-CB 3.74Å; L1363-E1780 HydrophobicContact CD2-CB 4.27Å; D1776-E1780 WeakPolarHBondContact O-CG 3.37Å; D1776-E1780 PolarHBondContact O-N 2.92Å; W1778-E1780 PolarHBondContact O-N 2.78Å; E1780-M1782 VanDerWaalsContact C-N 3.31Å; E1780-M1782 PolarHBondContact O-N 2.84Å; E1780-K1783 WeakPolarHBondContact O-CB 3.49Å; E1780-K1783 PolarHBondContact O-N 3.1Å; E1780-K1783 IonicContact OE1-NZ 3.9Å; E1780-K1783 PolarHBondContact OE1-NZ 2.94Å; E1780-K1783 IonicContact OE2-NZ 2.78Å; E1780-H1784 PolarHBondContact O-CD2 3.33Å; E1780-H1784 PolarHBondContact O-N 2.84Å
1781	S	81.7	Confident	76.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.3	-34.2	178.5	-57	0	0	0	0	112.4	I1777 W1778 H1784 H1785	I1777-S1781 VanDerWaalsContact O-CB 3.26Å; I1777-S1781 WeakPolarHBondContact O-CB 3.34Å; I1777-S1781 PolarHBondContact O-N 2.81Å; I1777-S1781 PolarHBondContact O-OG 3.45Å; W1778-S1781 PolarHBondContact O-N 3.23Å; W1778-S1781 VanDerWaalsContact O-N 3.14Å; S1781-H1784 CarbonylContact O-C 3.5Å; S1781-H1784 VanDerWaalsContact O-C 3.23Å; S1781-H1784 PolarHBondContact O-N 2.74Å; S1781-H1785 PolarHBondContact O-N 3.38Å
1782	M	78.9	Confident	75.9	Confident	29 Å²	29	68.2 Å²	68.2	14%	0.143	32%	0.32	C	S	.	.	H	α-helix	trans	-68.8	-37.6	173.7	-64	-66.5	-92.3	0	0	111.5	W1778 N1779 E1780 H1784 H1785 I1790	W1778-M1782 HydrophobicContact CD2-CG 3.98Å; W1778-M1782 HydrophobicContact CE3-CG 4.37Å; W1778-M1782 HydrophobicContact CG-CG 4.48Å; W1778-M1782 HydrophobicContact CH2-CE 4.32Å; W1778-M1782 HydrophobicContact CH2-CG 4.2Å; W1778-M1782 HydrophobicContact CZ2-CE 3.65Å; W1778-M1782 HydrophobicContact CZ2-CG 3.82Å; W1778-M1782 HydrophobicContact CZ2-SD 4.18Å; W1778-M1782 HydrophobicContact CZ3-CG 4.47Å; W1778-M1782 WeakPolarHBondContact O-CG 3.27Å; W1778-M1782 PolarHBondContact O-N 3.27Å; N1779-M1782 PolarHBondContact O-N 2.63Å; E1780-M1782 VanDerWaalsContact C-N 3.31Å; E1780-M1782 PolarHBondContact O-N 2.84Å; M1782-H1784 PolarHBondContact O-N 2.8Å; M1782-H1785 WeakPolarHBondContact CE-CE1 3.31Å; M1782-H1785 WeakPolarHBondContact O-CB 3.29Å; M1782-H1785 PolarHBondContact O-CD2 2.95Å; M1782-H1785 PolarHBondContact O-N 2.98Å; M1782-H1785 VanDerWaalsContact O-N 3.08Å; M1782-H1785 PolarHBondContact SD-CE1 3.15Å; M1782-I1790 HydrophobicContact CG-CD1 3.89Å; M1782-I1790 HydrophobicContact SD-CD1 3.34Å; M1782-I1790 WeakPolarHBondContact SD-CD1 3.45Å
1783	K	80.3	Confident	75.6	Confident	144 Å²	144	64.8 Å²	64.8	63%	0.626	31%	0.305	S	S	*	.	H	α-helix	trans	-57.7	-31.8	171.2	-65	172.9	-169.5	174.6	0	112.3	N1779 E1780	N1779-K1783 WeakPolarHBondContact O-CG 3.4Å; N1779-K1783 PolarHBondContact O-N 3.16Å; E1780-K1783 WeakPolarHBondContact O-CB 3.49Å; E1780-K1783 PolarHBondContact O-N 3.1Å; E1780-K1783 IonicContact OE1-NZ 3.9Å; E1780-K1783 PolarHBondContact OE1-NZ 2.94Å; E1780-K1783 IonicContact OE2-NZ 2.78Å
1784	H	71.7	Confident	75.5	Confident	87 Å²	87	64.3 Å²	64.3	40%	0.403	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	33.5	176.8	-66.7	-85	0	0	0	113.6	E1780 S1781 M1782 L1786 E1787 Y1788	E1780-H1784 PolarHBondContact O-CD2 3.33Å; E1780-H1784 PolarHBondContact O-N 2.84Å; S1781-H1784 CarbonylContact O-C 3.5Å; S1781-H1784 VanDerWaalsContact O-C 3.23Å; S1781-H1784 PolarHBondContact O-N 2.74Å; M1782-H1784 PolarHBondContact O-N 2.8Å; H1784-L1786 PolarHBondContact O-N 3.39Å; H1784-E1787 PolarHBondContact O-N 2.73Å; H1784-Y1788 HydrophobicContact CB-CD2 3.65Å; H1784-Y1788 HydrophobicContact CB-CE2 3.98Å
1785	H	59.4	Low	75.3	Confident	128 Å²	128	66.6 Å²	66.6	59%	0.593	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.7	-27.9	-174.3	-104.9	-53.6	0	0	0	118.5	S1781 M1782	S1781-H1785 PolarHBondContact O-N 3.38Å; M1782-H1785 WeakPolarHBondContact CE-CE1 3.31Å; M1782-H1785 WeakPolarHBondContact O-CB 3.29Å; M1782-H1785 PolarHBondContact O-CD2 2.95Å; M1782-H1785 PolarHBondContact O-N 2.98Å; M1782-H1785 VanDerWaalsContact O-N 3.08Å; M1782-H1785 PolarHBondContact SD-CE1 3.15Å
1786	L	54.3	Low	75	Confident	185 Å²	185	65 Å²	65	97%	0.969	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-14.5	-175.8	-75.6	162.4	0	0	0	114.6	H1784	H1784-L1786 PolarHBondContact O-N 3.39Å
1787	E	58.4	Low	74.8	Confident	137 Å²	137	63.8 Å²	63.8	64%	0.64	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-23.3	-170.6	-170.2	170.5	-141.8	0	0	113.5	H1784	H1784-E1787 PolarHBondContact O-N 2.73Å
1788	Y	67.3	Low	74.8	Confident	44 Å²	44	64.6 Å²	64.6	17%	0.173	30%	0.304	C	S	.	.			trans	-126	125.6	-171.4	-63.8	-77	0	0	0	113.8	L1363 K1364 L1367 H1784 I1790	L1363-Y1788 HydrophobicContact CD2-CD2 4.25Å; L1363-Y1788 HydrophobicContact CD2-CE2 4.13Å; K1364-Y1788 HydrophobicContact CB-CE1 3.99Å; K1364-Y1788 HydrophobicContact CG-CE1 4.3Å; L1367-Y1788 HydrophobicContact CD2-CG 4.45Å; H1784-Y1788 HydrophobicContact CB-CD2 3.65Å; H1784-Y1788 HydrophobicContact CB-CE2 3.98Å; Y1788-I1790 PolarHBondContact O-N 3.24Å
1789	K	71.2	Confident	74.2	Confident	190 Å²	190	65.5 Å²	65.5	83%	0.826	31%	0.31	S	S	*	.			trans	-80.9	96.9	179.1	-168.9	175.1	-177.1	178.5	0	111.2	N1371	N1371-K1789 PolarHBondContact ND2-O 3.49Å
1790	I	77.1	Confident	72.9	Confident	35 Å²	35	68.1 Å²	68.1	18%	0.179	32%	0.319	C	S	.	.			trans	-69.7	139.1	170.3	-59.3	170.7	0	0	0	109.3	L1367 M1782 Y1788 L1794 N1795	L1367-I1790 HydrophobicContact CD1-CG1 4.28Å; L1367-I1790 HydrophobicContact CD2-CG1 4.34Å; M1782-I1790 HydrophobicContact CG-CD1 3.89Å; M1782-I1790 HydrophobicContact SD-CD1 3.34Å; M1782-I1790 WeakPolarHBondContact SD-CD1 3.45Å; Y1788-I1790 PolarHBondContact O-N 3.24Å; I1790-L1794 HydrophobicContact CG2-CB 4.38Å; I1790-L1794 HydrophobicContact CG2-CD2 4.33Å; I1790-N1795 HydrophobicContact CG2-CB 4.24Å
1791	S	76.6	Confident	71.2	Confident	16 Å²	16	73.4 Å²	73.4	11%	0.112	34%	0.344	C	S	.	.			trans	-80.6	161	179.1	81	0	0	0	0	112.9	N1371 D1375 L1794 N1795	N1371-S1791 WeakPolarHBondContact CA-OG 3.23Å; N1371-S1791 VanDerWaalsContact CG-CB 3.48Å; N1371-S1791 WeakPolarHBondContact OD1-CB 3.42Å; N1371-S1791 PolarHBondContact OD1-N 2.82Å; N1371-S1791 PolarHBondContact OD1-OG 3.16Å; D1375-S1791 VanDerWaalsContact CG-CB 3.42Å; D1375-S1791 WeakPolarHBondContact OD1-CB 3.13Å; D1375-S1791 PolarHBondContact OD1-OG 3.18Å; D1375-S1791 WeakPolarHBondContact OD2-CB 3.39Å; S1791-L1794 PolarHBondContact O-N 3.47Å; S1791-L1794 WeakPolarHBondContact OG-CB 3.21Å; S1791-L1794 PolarHBondContact OG-N 3.34Å; S1791-N1795 PolarHBondContact O-N 3.25Å; S1791-N1795 VanDerWaalsContact O-N 3.14Å
1792	K	73.4	Confident	69.2	Low	131 Å²	131	77.5 Å²	77.5	57%	0.57	37%	0.365	S	S	*	.	H	α-helix	trans	-62.7	-49.7	-177.1	-88.3	-166.7	160.3	-139.3	0	111	D1375 L1794 N1795 I1796 D1811	D1375-K1792 PolarHBondContact OD2-N 2.87Å; K1792-L1794 VanDerWaalsContact C-N 3.35Å; K1792-L1794 PolarHBondContact O-N 3.41Å; K1792-N1795 PolarHBondContact O-N 2.94Å; K1792-I1796 HydrophobicContact CB-CD1 4.4Å; K1792-I1796 WeakPolarHBondContact O-CD1 3.42Å; K1792-I1796 VanDerWaalsContact O-CG1 3.22Å; K1792-I1796 WeakPolarHBondContact O-CG1 3.47Å; K1792-I1796 PolarHBondContact O-N 3.06Å; K1792-D1811 IonicContact NZ-OD1 3.73Å; K1792-D1811 IonicContact NZ-OD2 2.71Å; K1792-D1811 PolarHBondContact NZ-OD2 3.42Å
1793	G	74.2	Confident	66.8	Low	4 Å²	4	82.7 Å²	82.7	4%	0.041	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-37.6	-179.6	0	0	0	0	0	113.1	S1374 D1375 N1795 I1796 L1797	S1374-G1793 WeakPolarHBondContact O-CA 3.04Å; D1375-G1793 VanDerWaalsContact OD1-CA 3.26Å; D1375-G1793 WeakPolarHBondContact OD1-CA 3.1Å; D1375-G1793 PolarHBondContact OD1-N 3.11Å; G1793-N1795 VanDerWaalsContact C-N 3.29Å; G1793-N1795 PolarHBondContact O-N 3.3Å; G1793-I1796 PolarHBondContact O-N 2.96Å; G1793-L1797 WeakPolarHBondContact O-CG 3.35Å; G1793-L1797 PolarHBondContact O-N 2.87Å; G1793-L1797 VanDerWaalsContact O-N 3.1Å
1794	L	80.2	Confident	64.7	Low	0 Å²	0	85.6 Å²	85.6	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-66.8	-36.1	177.1	-172.4	65.1	0	0	0	110.9	L1367 A1370 N1371 S1374 Q1774 W1778 I1790 S1791 K1792 Y1798	L1367-L1794 HydrophobicContact CD1-CD2 3.56Å; A1370-L1794 HydrophobicContact CB-CD1 4.05Å; A1370-L1794 HydrophobicContact CB-CD2 3.73Å; N1371-L1794 WeakPolarHBondContact OD1-CD2 3.45Å; S1374-L1794 WeakPolarHBondContact OG-CD1 3.13Å; Q1774-L1794 HydrophobicContact CB-CD1 4.17Å; W1778-L1794 HydrophobicContact CB-CG 4.4Å; I1790-L1794 HydrophobicContact CG2-CB 4.38Å; I1790-L1794 HydrophobicContact CG2-CD2 4.33Å; S1791-L1794 PolarHBondContact O-N 3.47Å; S1791-L1794 WeakPolarHBondContact OG-CB 3.21Å; S1791-L1794 PolarHBondContact OG-N 3.34Å; K1792-L1794 VanDerWaalsContact C-N 3.35Å; K1792-L1794 PolarHBondContact O-N 3.41Å; L1794-Y1798 HydrophobicContact CD1-CD2 3.89Å; L1794-Y1798 HydrophobicContact CD1-CE2 3.98Å; L1794-Y1798 PolarHBondContact O-N 3.42Å
1795	N	78.1	Confident	63	Low	50 Å²	50	85 Å²	85	27%	0.267	40%	0.396	S	S	.	.	H	α-helix	trans	-71.5	-40	175.7	-148.7	20.7	0	0	0	112.2	W1778 I1790 S1791 K1792 G1793 L1797 Y1798 N1799	W1778-N1795 PolarHBondContact NE1-OD1 3.4Å; I1790-N1795 HydrophobicContact CG2-CB 4.24Å; S1791-N1795 PolarHBondContact O-N 3.25Å; S1791-N1795 VanDerWaalsContact O-N 3.14Å; K1792-N1795 PolarHBondContact O-N 2.94Å; G1793-N1795 VanDerWaalsContact C-N 3.29Å; G1793-N1795 PolarHBondContact O-N 3.3Å; N1795-L1797 VanDerWaalsContact C-N 3.29Å; N1795-L1797 PolarHBondContact O-N 3.23Å; N1795-Y1798 PolarHBondContact O-N 3.21Å; N1795-N1799 WeakPolarHBondContact O-CB 3.33Å; N1795-N1799 PolarHBondContact O-N 2.69Å
1796	I	75.8	Confident	62.3	Low	14 Å²	14	83.9 Å²	83.9	7%	0.072	39%	0.394	C	S	.	.	H	α-helix	trans	-60.5	-36.4	176.3	-71.7	159	0	0	0	112	K1792 G1793 I1808 D1811 L1812	K1792-I1796 HydrophobicContact CB-CD1 4.4Å; K1792-I1796 WeakPolarHBondContact O-CD1 3.42Å; K1792-I1796 VanDerWaalsContact O-CG1 3.22Å; K1792-I1796 WeakPolarHBondContact O-CG1 3.47Å; K1792-I1796 PolarHBondContact O-N 3.06Å; G1793-I1796 PolarHBondContact O-N 2.96Å; I1796-I1808 HydrophobicContact CB-CG2 4.44Å; I1796-I1808 HydrophobicContact CG1-CG2 4.4Å; I1796-I1808 HydrophobicContact CG2-CG2 4.2Å; I1796-D1811 HydrophobicContact CD1-CB 3.75Å; I1796-D1811 HydrophobicContact CG1-CB 4.36Å; I1796-L1812 HydrophobicContact CG2-CB 3.99Å; I1796-L1812 HydrophobicContact CG2-CD1 4.17Å; I1796-L1812 HydrophobicContact CG2-CD2 4.46Å; I1796-L1812 HydrophobicContact CG2-CG 4.43Å
1797	L	78.5	Confident	62.3	Low	21 Å²	21	79.7 Å²	79.7	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-72	-42.5	179.2	-73.7	170.8	0	0	0	113.4	L1378 T1479 G1793 N1795	L1378-L1797 HydrophobicContact CD1-CD1 3.86Å; L1378-L1797 HydrophobicContact CD1-CD2 4.39Å; L1378-L1797 HydrophobicContact CD1-CG 4.17Å; T1479-L1797 HydrophobicContact CG2-CD1 3.81Å; T1479-L1797 HydrophobicContact CG2-CD2 4.22Å; G1793-L1797 WeakPolarHBondContact O-CG 3.35Å; G1793-L1797 PolarHBondContact O-N 2.87Å; G1793-L1797 VanDerWaalsContact O-N 3.1Å; N1795-L1797 VanDerWaalsContact C-N 3.29Å; N1795-L1797 PolarHBondContact O-N 3.23Å
1798	Y	81	Confident	62.1	Low	27 Å²	27	74.8 Å²	74.8	11%	0.106	35%	0.351	C	S	.	.	H	α-helix	trans	-115.3	-10.2	-165	-63.8	-71	0	0	0	116.1	Q1774 Q1775 L1794 N1795 K1800	Q1774-Y1798 HydrophobicContact CB-CD2 4.38Å; Q1774-Y1798 HydrophobicContact CB-CE2 3.46Å; Q1774-Y1798 VanDerWaalsContact CB-CE2 3.46Å; Q1774-Y1798 HydrophobicContact CG-CE2 4.5Å; Q1775-Y1798 HydrophobicContact CB-CD1 3.63Å; Q1775-Y1798 HydrophobicContact CB-CE1 3.76Å; Q1775-Y1798 HydrophobicContact CB-CG 4.29Å; Q1775-Y1798 HydrophobicContact CG-CD1 3.79Å; Q1775-Y1798 HydrophobicContact CG-CE1 4.35Å; Q1775-Y1798 HydrophobicContact CG-CG 4.44Å; L1794-Y1798 HydrophobicContact CD1-CD2 3.89Å; L1794-Y1798 HydrophobicContact CD1-CE2 3.98Å; L1794-Y1798 PolarHBondContact O-N 3.42Å; N1795-Y1798 PolarHBondContact O-N 3.21Å; Y1798-K1800 PolarHBondContact O-N 2.92Å
1799	N	75.2	Confident	61.7	Low	32 Å²	32	77.6 Å²	77.6	17%	0.171	37%	0.365	C	S	.	.			trans	-70.2	101.9	179.8	-173.1	-0.4	0	0	0	112.7	W1778 N1795 Q1801 I1808	W1778-N1799 HydrophobicContact CH2-CB 4.5Å; W1778-N1799 VanDerWaalsContact CZ2-CA 3.44Å; W1778-N1799 HydrophobicContact CZ2-CB 3.76Å; N1795-N1799 WeakPolarHBondContact O-CB 3.33Å; N1795-N1799 PolarHBondContact O-N 2.69Å; N1799-Q1801 PolarHBondContact OD1-N 2.76Å; N1799-I1808 HydrophobicContact CB-CD1 4.18Å
1800	K	57.1	Low	61.5	Low	109 Å²	109	70.5 Å²	70.5	47%	0.474	34%	0.336	S	S	.	.			trans	-87.2	-8.6	175.3	-62.9	-169.8	-179.5	-172.8	0	114.6	Y1798 L1802	Y1798-K1800 PolarHBondContact O-N 2.92Å; K1800-L1802 VanDerWaalsContact C-N 3.34Å; K1800-L1802 PolarHBondContact O-N 3.38Å
1801	Q	45.8	Very low	61.2	Low	159 Å²	159	71.2 Å²	71.2	74%	0.743	34%	0.341	S	S	*	.	S	Bend	trans	-88.1	3.1	-171.2	-74.9	177.3	-73.1	0	0	114.5	N1799	N1799-Q1801 PolarHBondContact OD1-N 2.76Å
1802	L	38.1	Very low	61.1	Low	85 Å²	85	70.9 Å²	70.9	45%	0.445	34%	0.337	S	S	.	.			trans	-112.4	67.9	169.3	-66.9	175.1	0	0	0	110.7	K1800 F1804 D1805 I1808	K1800-L1802 VanDerWaalsContact C-N 3.34Å; K1800-L1802 PolarHBondContact O-N 3.38Å; L1802-F1804 PolarHBondContact O-N 3.28Å; L1802-D1805 HydrophobicContact CB-CB 4.11Å; L1802-D1805 HydrophobicContact CD1-CB 4.4Å; L1802-D1805 HydrophobicContact CD2-CB 4.06Å; L1802-D1805 HydrophobicContact CG-CB 4.41Å; L1802-I1808 HydrophobicContact CB-CD1 4.38Å; L1802-I1808 HydrophobicContact CD1-CD1 3.86Å; L1802-I1808 HydrophobicContact CD1-CG1 4.45Å
1803	R	30	Very low	61.3	Low	138 Å²	138	65.8 Å²	65.8	52%	0.521	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	116.6	157.1	-72.8	-172.2	178.5	-168.2	4.5	106.8	H1670	H1670-R1803 PolarHBondContact CD2-NH2 3.28Å; H1670-R1803 PolarHBondContact CE1-NH2 3.48Å; H1670-R1803 PolarHBondContact ND1-NH2 3.33Å; H1670-R1803 PolarHBondContact NE2-NE 3.44Å; H1670-R1803 PolarHBondContact NE2-NH2 3.01Å; H1670-R1803 VanDerWaalsContact NE2-NH2 3.12Å; H1670-R1803 PolarHBondContact O-NH2 3.01Å
1804	F	35	Very low	61.3	Low	206 Å²	206	68.8 Å²	68.8	90%	0.904	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	60.9	-179.1	-52	-79.6	0	0	0	116	L1802	L1802-F1804 PolarHBondContact O-N 3.28Å
1805	D	36.1	Very low	61.2	Low	74 Å²	74	71.2 Å²	71.2	40%	0.396	34%	0.344	S	S	.	.			trans	-135.1	112.7	158.7	-159.5	38	0	0	0	108.7	L1802 N1807	L1802-D1805 HydrophobicContact CB-CB 4.11Å; L1802-D1805 HydrophobicContact CD1-CB 4.4Å; L1802-D1805 HydrophobicContact CD2-CB 4.06Å; L1802-D1805 HydrophobicContact CG-CB 4.41Å; D1805-N1807 PolarHBondContact O-N 3.09Å; D1805-N1807 PolarHBondContact OD1-ND2 3.15Å; D1805-N1807 PolarHBondContact OD2-ND2 3.43Å
1806	D	45.6	Very low	61.4	Low	104 Å²	104	68.8 Å²	68.8	56%	0.556	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.2	-166.1	-64	-37.3	0	0	0	113.7	I1808 N1810	D1806-I1808 PolarHBondContact O-N 3.12Å; D1806-N1810 WeakPolarHBondContact O-CB 3.08Å; D1806-N1810 VanDerWaalsContact O-CG 3.29Å; D1806-N1810 PolarHBondContact O-N 3.01Å; D1806-N1810 VanDerWaalsContact O-N 3.11Å; D1806-N1810 PolarHBondContact O-ND2 3.25Å; D1806-N1810 VanDerWaalsContact O-ND2 3.07Å
1807	N	52.9	Low	61.6	Low	98 Å²	98	73 Å²	73	52%	0.524	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-34.8	-170	-60.9	-54.2	0	0	0	114.5	D1805 D1811	D1805-N1807 PolarHBondContact O-N 3.09Å; D1805-N1807 PolarHBondContact OD1-ND2 3.15Å; D1805-N1807 PolarHBondContact OD2-ND2 3.43Å; N1807-D1811 PolarHBondContact O-N 3.44Å
1808	I	54.4	Low	61.6	Low	34 Å²	34	75.5 Å²	75.5	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-76.7	-41.5	-177	-70.7	-175.6	0	0	0	112.1	I1796 N1799 L1802 D1806 N1810 D1811 L1812	I1796-I1808 HydrophobicContact CB-CG2 4.44Å; I1796-I1808 HydrophobicContact CG1-CG2 4.4Å; I1796-I1808 HydrophobicContact CG2-CG2 4.2Å; N1799-I1808 HydrophobicContact CB-CD1 4.18Å; L1802-I1808 HydrophobicContact CB-CD1 4.38Å; L1802-I1808 HydrophobicContact CD1-CD1 3.86Å; L1802-I1808 HydrophobicContact CD1-CG1 4.45Å; D1806-I1808 PolarHBondContact O-N 3.12Å; I1808-N1810 VanDerWaalsContact C-N 3.31Å; I1808-D1811 PolarHBondContact O-N 2.96Å; I1808-L1812 PolarHBondContact O-N 2.94Å
1809	E	60.2	Low	61.6	Low	102 Å²	102	74.3 Å²	74.3	48%	0.477	36%	0.355	S	S	.	.	H	α-helix	trans	-69	-34.7	174.8	-62.4	-156.8	159.4	0	0	110.8	L1812 L1813	E1809-L1812 PolarHBondContact O-N 3.27Å; E1809-L1813 WeakPolarHBondContact O-CB 3.16Å; E1809-L1813 PolarHBondContact O-N 2.9Å
1810	N	66.2	Low	61.9	Low	42 Å²	42	74.8 Å²	74.8	23%	0.225	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-45.5	170.4	-76.1	-34	0	0	0	112.8	D1806 I1808 L1812 L1813 N1814	D1806-N1810 WeakPolarHBondContact O-CB 3.08Å; D1806-N1810 VanDerWaalsContact O-CG 3.29Å; D1806-N1810 PolarHBondContact O-N 3.01Å; D1806-N1810 VanDerWaalsContact O-N 3.11Å; D1806-N1810 PolarHBondContact O-ND2 3.25Å; D1806-N1810 VanDerWaalsContact O-ND2 3.07Å; I1808-N1810 VanDerWaalsContact C-N 3.31Å; N1810-L1812 PolarHBondContact O-N 3.21Å; N1810-L1813 PolarHBondContact O-N 3.11Å; N1810-N1814 VanDerWaalsContact O-CB 3.29Å; N1810-N1814 WeakPolarHBondContact O-CB 3.48Å; N1810-N1814 PolarHBondContact O-N 2.9Å; N1810-N1814 PolarHBondContact O-ND2 3.45Å; N1810-N1814 VanDerWaalsContact O-ND2 3.1Å
1811	D	70.3	Confident	62.9	Low	50 Å²	50	73 Å²	73	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-64.5	-37.9	178.5	-106.4	5.3	0	0	0	112.1	K1792 I1796 N1807 I1808 I1815	K1792-D1811 IonicContact NZ-OD1 3.73Å; K1792-D1811 IonicContact NZ-OD2 2.71Å; K1792-D1811 PolarHBondContact NZ-OD2 3.42Å; I1796-D1811 HydrophobicContact CD1-CB 3.75Å; I1796-D1811 HydrophobicContact CG1-CB 4.36Å; N1807-D1811 PolarHBondContact O-N 3.44Å; I1808-D1811 PolarHBondContact O-N 2.96Å; D1811-I1815 WeakPolarHBondContact O-CG1 3.33Å; D1811-I1815 PolarHBondContact O-N 3.15Å
1812	L	75.2	Confident	64.2	Low	8 Å²	8	67 Å²	67	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-72.5	-39.5	175.2	-169.6	62.1	0	0	0	112.3	L1471 A1474 K1475 I1796 I1808 E1809 N1810 N1814 I1815 L1816	L1471-L1812 HydrophobicContact CD2-CB 4.3Å; L1471-L1812 HydrophobicContact CD2-CD2 4.19Å; L1471-L1812 HydrophobicContact CD2-CG 4.29Å; A1474-L1812 HydrophobicContact CB-CD1 4.25Å; A1474-L1812 HydrophobicContact CB-CD2 3.98Å; A1474-L1812 HydrophobicContact CB-CG 4.18Å; K1475-L1812 HydrophobicContact CB-CD2 4.08Å; I1796-L1812 HydrophobicContact CG2-CB 3.99Å; I1796-L1812 HydrophobicContact CG2-CD1 4.17Å; I1796-L1812 HydrophobicContact CG2-CD2 4.46Å; I1796-L1812 HydrophobicContact CG2-CG 4.43Å; I1808-L1812 PolarHBondContact O-N 2.94Å; E1809-L1812 PolarHBondContact O-N 3.27Å; N1810-L1812 PolarHBondContact O-N 3.21Å; L1812-N1814 VanDerWaalsContact C-N 3.33Å; L1812-I1815 PolarHBondContact O-N 3.24Å; L1812-L1816 PolarHBondContact O-N 3.05Å; L1812-L1816 VanDerWaalsContact O-N 3.13Å
1813	L	76.7	Confident	65.6	Low	25 Å²	25	63.7 Å²	63.7	13%	0.131	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-41.5	173.6	-177.5	67.2	0	0	0	110.8	L1403 W1467 L1471 E1809 N1810 I1815 L1816 W1817	L1403-L1813 HydrophobicContact CD1-CD2 4.04Å; L1403-L1813 HydrophobicContact CG-CD2 4.43Å; W1467-L1813 HydrophobicContact CE3-CD1 3.94Å; W1467-L1813 HydrophobicContact CZ3-CD1 4.14Å; L1471-L1813 HydrophobicContact CD1-CD1 4.35Å; L1471-L1813 HydrophobicContact CD2-CB 4.39Å; E1809-L1813 WeakPolarHBondContact O-CB 3.16Å; E1809-L1813 PolarHBondContact O-N 2.9Å; N1810-L1813 PolarHBondContact O-N 3.11Å; L1813-I1815 PolarHBondContact O-N 3.35Å; L1813-L1816 CarbonylContact O-C 3.59Å; L1813-L1816 WeakPolarHBondContact O-CB 3.12Å; L1813-L1816 PolarHBondContact O-N 3.01Å; L1813-L1816 VanDerWaalsContact O-N 3.14Å; L1813-W1817 WeakPolarHBondContact O-CB 3.28Å; L1813-W1817 PolarHBondContact O-N 3.37Å
1814	N	75.1	Confident	66.9	Low	67 Å²	67	61.9 Å²	61.9	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-59.1	-43.9	175.4	-75.1	-28.2	0	0	0	111.4	N1810 L1812 L1816 W1817 D1818	N1810-N1814 VanDerWaalsContact O-CB 3.29Å; N1810-N1814 WeakPolarHBondContact O-CB 3.48Å; N1810-N1814 PolarHBondContact O-N 2.9Å; N1810-N1814 PolarHBondContact O-ND2 3.45Å; N1810-N1814 VanDerWaalsContact O-ND2 3.1Å; L1812-N1814 VanDerWaalsContact C-N 3.33Å; N1814-L1816 VanDerWaalsContact C-N 3.31Å; N1814-L1816 PolarHBondContact O-N 2.93Å; N1814-W1817 PolarHBondContact O-N 3.44Å; N1814-D1818 WeakPolarHBondContact O-CB 3.35Å; N1814-D1818 PolarHBondContact O-N 3.29Å
1815	I	77.6	Confident	67.7	Low	50 Å²	50	55.2 Å²	55.2	26%	0.256	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-36.8	176	-65.4	166.2	0	0	0	111.4	S1382 D1811 L1812 L1813 A1819	S1382-I1815 WeakPolarHBondContact OG-CG2 3.36Å; D1811-I1815 WeakPolarHBondContact O-CG1 3.33Å; D1811-I1815 PolarHBondContact O-N 3.15Å; L1812-I1815 PolarHBondContact O-N 3.24Å; L1813-I1815 PolarHBondContact O-N 3.35Å; I1815-A1819 WeakPolarHBondContact O-CB 3.23Å; I1815-A1819 PolarHBondContact O-N 2.75Å; I1815-A1819 VanDerWaalsContact O-N 3.11Å
1816	L	82.8	Confident	68.1	Low	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-71.6	-34.2	174	-68.2	170.1	0	0	0	112.5	M1386 W1467 M1470 L1471 A1474 F1478 L1812 L1813 N1814 A1819 K1820	M1386-L1816 HydrophobicContact CG-CD2 4.42Å; M1386-L1816 HydrophobicContact SD-CD2 4.28Å; W1467-L1816 HydrophobicContact CZ3-CB 4.12Å; M1470-L1816 HydrophobicContact CE-CD2 4.15Å; M1470-L1816 HydrophobicContact CG-CD1 4.31Å; M1470-L1816 HydrophobicContact CG-CD2 4.47Å; L1471-L1816 HydrophobicContact CD2-CD1 4.41Å; L1471-L1816 HydrophobicContact CG-CD1 4.41Å; A1474-L1816 HydrophobicContact CB-CD1 4.01Å; A1474-L1816 HydrophobicContact CB-CD2 4.27Å; A1474-L1816 HydrophobicContact CB-CG 4.47Å; F1478-L1816 HydrophobicContact CE2-CD2 3.92Å; F1478-L1816 HydrophobicContact CZ-CD2 3.95Å; L1812-L1816 PolarHBondContact O-N 3.05Å; L1812-L1816 VanDerWaalsContact O-N 3.13Å; L1813-L1816 CarbonylContact O-C 3.59Å; L1813-L1816 WeakPolarHBondContact O-CB 3.12Å; L1813-L1816 PolarHBondContact O-N 3.01Å; L1813-L1816 VanDerWaalsContact O-N 3.14Å; N1814-L1816 VanDerWaalsContact C-N 3.31Å; N1814-L1816 PolarHBondContact O-N 2.93Å; L1816-A1819 WeakPolarHBondContact O-CB 3.13Å; L1816-A1819 PolarHBondContact O-N 3.19Å; L1816-K1820 PolarHBondContact O-N 3.36Å
1817	W	80.5	Confident	67.7	Low	102 Å²	102	51.4 Å²	51.4	39%	0.386	27%	0.27	S	S	.	.	H	α-helix	trans	-71.1	-44.6	177.2	-120.6	99.3	0	0	0	112	L1813 N1814 A1819 K1820 N1821	L1813-W1817 WeakPolarHBondContact O-CB 3.28Å; L1813-W1817 PolarHBondContact O-N 3.37Å; N1814-W1817 PolarHBondContact O-N 3.44Å; W1817-A1819 PolarHBondContact O-N 2.94Å; W1817-K1820 WeakPolarHBondContact O-CB 3.46Å; W1817-K1820 PolarHBondContact O-N 2.94Å; W1817-K1820 VanDerWaalsContact O-N 3.11Å; W1817-N1821 WeakPolarHBondContact CZ3-OD1 3.16Å; W1817-N1821 PolarHBondContact O-N 2.91Å; W1817-N1821 PolarHBondContact O-ND2 2.97Å
1818	D	78	Confident	66.7	Low	74 Å²	74	51.2 Å²	51.2	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-55.1	-43.2	168.7	-106.6	23.7	0	0	0	110.6	R1379 N1814 N1821 E1822	R1379-D1818 IonicContact CZ-OD2 3.8Å; R1379-D1818 IonicContact NH1-OD2 2.63Å; R1379-D1818 PolarHBondContact NH1-OD2 3.01Å; R1379-D1818 IonicContact NH2-OD2 3.59Å; R1379-D1818 PolarHBondContact NH2-OD2 3.16Å; N1814-D1818 WeakPolarHBondContact O-CB 3.35Å; N1814-D1818 PolarHBondContact O-N 3.29Å; D1818-N1821 PolarHBondContact O-N 2.82Å; D1818-E1822 WeakPolarHBondContact O-CB 3.48Å; D1818-E1822 PolarHBondContact O-N 3.17Å
1819	A	80.9	Confident	65.5	Low	1 Å²	1	53.7 Å²	53.7	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-40.1	175.2	0	0	0	0	0	112.8	V1383 M1386 I1815 L1816 W1817 N1821 E1822 C1823	V1383-A1819 HydrophobicContact CG2-CB 3.97Å; M1386-A1819 HydrophobicContact CB-CB 4.23Å; M1386-A1819 HydrophobicContact CG-CB 3.77Å; I1815-A1819 WeakPolarHBondContact O-CB 3.23Å; I1815-A1819 PolarHBondContact O-N 2.75Å; I1815-A1819 VanDerWaalsContact O-N 3.11Å; L1816-A1819 WeakPolarHBondContact O-CB 3.13Å; L1816-A1819 PolarHBondContact O-N 3.19Å; W1817-A1819 PolarHBondContact O-N 2.94Å; A1819-N1821 VanDerWaalsContact C-N 3.32Å; A1819-N1821 PolarHBondContact O-N 3.41Å; A1819-E1822 PolarHBondContact O-N 3.03Å; A1819-C1823 WeakPolarHBondContact O-CB 3.2Å; A1819-C1823 PolarHBondContact O-N 2.73Å; A1819-C1823 PolarHBondContact O-SG 2.87Å
1820	K	82.2	Confident	63.9	Low	43 Å²	43	54.2 Å²	54.2	19%	0.187	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-45.6	173	-163.1	173.4	179.8	-178	0	110.4	M1386 D1395 W1467 L1816 W1817 C1823 L1824	M1386-K1820 HydrophobicContact CE-CB 3.97Å; M1386-K1820 HydrophobicContact CE-CD 4.15Å; M1386-K1820 HydrophobicContact CE-CG 3.98Å; D1395-K1820 IonicContact OD1-NZ 2.78Å; D1395-K1820 PolarHBondContact OD1-NZ 3.13Å; D1395-K1820 IonicContact OD2-NZ 3.8Å; D1395-K1820 PolarHBondContact OD2-NZ 3.15Å; W1467-K1820 HydrophobicContact CH2-CD 4.07Å; W1467-K1820 HydrophobicContact CZ2-CD 3.85Å; L1816-K1820 PolarHBondContact O-N 3.36Å; W1817-K1820 WeakPolarHBondContact O-CB 3.46Å; W1817-K1820 PolarHBondContact O-N 2.94Å; W1817-K1820 VanDerWaalsContact O-N 3.11Å; K1820-C1823 PolarHBondContact O-N 3.47Å; K1820-L1824 HydrophobicContact CG-CD1 4.38Å; K1820-L1824 WeakPolarHBondContact O-CG 3.11Å; K1820-L1824 PolarHBondContact O-N 2.88Å
1821	N	76.7	Confident	61.9	Low	72 Å²	72	57.2 Å²	57.2	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-66.4	-44.8	178.2	-70.7	-24.3	0	0	0	113.2	W1817 D1818 A1819 C1823 L1824 S1825	W1817-N1821 WeakPolarHBondContact CZ3-OD1 3.16Å; W1817-N1821 PolarHBondContact O-N 2.91Å; W1817-N1821 PolarHBondContact O-ND2 2.97Å; D1818-N1821 PolarHBondContact O-N 2.82Å; A1819-N1821 VanDerWaalsContact C-N 3.32Å; A1819-N1821 PolarHBondContact O-N 3.41Å; N1821-C1823 VanDerWaalsContact C-N 3.28Å; N1821-C1823 PolarHBondContact O-N 3.37Å; N1821-L1824 PolarHBondContact O-N 3.06Å; N1821-S1825 PolarHBondContact O-N 2.96Å
1822	E	72.7	Confident	59.8	Low	32 Å²	32	59 Å²	59	15%	0.15	35%	0.354	C	S	.	.	H	α-helix	trans	-58.7	-42.5	176.7	-165.9	171.3	154.9	0	0	110.1	R1379 R1380 V1383 D1818 A1819 S1825 S1826	R1379-E1822 IonicContact NE-OE2 2.75Å; R1379-E1822 IonicContact NH2-OE2 3.15Å; R1380-E1822 IonicContact CZ-OE1 2.71Å; R1380-E1822 IonicContact NH1-OE1 2.72Å; R1380-E1822 PolarHBondContact NH1-OE1 3.48Å; R1380-E1822 IonicContact NH1-OE2 2.69Å; R1380-E1822 IonicContact NH2-OE1 2.85Å; V1383-E1822 HydrophobicContact CG2-CB 4.36Å; V1383-E1822 HydrophobicContact CG2-CG 4.36Å; D1818-E1822 WeakPolarHBondContact O-CB 3.48Å; D1818-E1822 PolarHBondContact O-N 3.17Å; A1819-E1822 PolarHBondContact O-N 3.03Å; E1822-S1825 PolarHBondContact O-N 2.85Å; E1822-S1825 PolarHBondContact O-OG 3.38Å; E1822-S1826 PolarHBondContact O-N 3.18Å; E1822-S1826 VanDerWaalsContact O-N 3.16Å
1823	C	67.4	Low	57.2	Low	16 Å²	16	64.3 Å²	64.3	11%	0.108	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-47.4	174.7	-64.6	0	0	0	0	112.7	V1383 S1387 A1819 K1820 N1821 S1825 S1826 T1827	V1383-C1823 PolarHBondContact O-SG 3.43Å; V1383-C1823 VanDerWaalsContact O-SG 3.41Å; S1387-C1823 PolarHBondContact OG-SG 3.36Å; A1819-C1823 WeakPolarHBondContact O-CB 3.2Å; A1819-C1823 PolarHBondContact O-N 2.73Å; A1819-C1823 PolarHBondContact O-SG 2.87Å; K1820-C1823 PolarHBondContact O-N 3.47Å; N1821-C1823 VanDerWaalsContact C-N 3.28Å; N1821-C1823 PolarHBondContact O-N 3.37Å; C1823-S1825 VanDerWaalsContact C-N 3.33Å; C1823-S1825 PolarHBondContact O-N 2.87Å; C1823-S1826 PolarHBondContact O-N 3.11Å; C1823-S1826 PolarHBondContact O-OG 2.65Å; C1823-T1827 PolarHBondContact O-OG1 2.7Å
1824	L	57.3	Low	54.8	Low	99 Å²	99	68.2 Å²	68.2	52%	0.518	43%	0.428	S	S	.	.	H	α-helix	trans	-61.6	-39.1	178.4	-72.1	165.2	0	0	0	112.3	K1820 N1821 S1826 T1827	K1820-L1824 HydrophobicContact CG-CD1 4.38Å; K1820-L1824 WeakPolarHBondContact O-CG 3.11Å; K1820-L1824 PolarHBondContact O-N 2.88Å; N1821-L1824 PolarHBondContact O-N 3.06Å; L1824-S1826 PolarHBondContact O-N 3.21Å; L1824-T1827 PolarHBondContact O-N 3.06Å; L1824-T1827 PolarHBondContact O-OG1 3.16Å
1825	S	51.8	Low	52.5	Low	67 Å²	67	70.2 Å²	70.2	47%	0.469	45%	0.454	S	S	.	.	H	α-helix	trans	-65.5	-35.5	176.7	77.2	0	0	0	0	113.2	N1821 E1822 C1823 T1827 T1828 S1829	N1821-S1825 PolarHBondContact O-N 2.96Å; E1822-S1825 PolarHBondContact O-N 2.85Å; E1822-S1825 PolarHBondContact O-OG 3.38Å; C1823-S1825 VanDerWaalsContact C-N 3.33Å; C1823-S1825 PolarHBondContact O-N 2.87Å; S1825-T1827 VanDerWaalsContact C-N 3.26Å; S1825-T1827 PolarHBondContact O-N 3.35Å; S1825-T1828 PolarHBondContact O-N 2.85Å; S1825-T1828 PolarHBondContact O-OG1 3.4Å; S1825-T1828 VanDerWaalsContact O-OG1 3.13Å; S1825-S1829 PolarHBondContact O-N 3.11Å
1826	S	44.4	Very low	50	Low	28 Å²	28	72.9 Å²	72.9	20%	0.196	48%	0.484	C	S	.	.	H	α-helix	trans	-60.7	-36.7	177.2	75.7	0	0	0	0	112	E1822 C1823 L1824 S1829	E1822-S1826 PolarHBondContact O-N 3.18Å; E1822-S1826 VanDerWaalsContact O-N 3.16Å; C1823-S1826 PolarHBondContact O-N 3.11Å; C1823-S1826 PolarHBondContact O-OG 2.65Å; L1824-S1826 PolarHBondContact O-N 3.21Å; S1826-S1829 PolarHBondContact O-OG 3.36Å
1827	T	38.1	Very low	47.1	Very low	69 Å²	69	76.1 Å²	76.1	42%	0.423	52%	0.517	S	S	.	.	H	α-helix	trans	-74.3	-20.4	-179.5	26.4	0	0	0	0	115.3	K1334 C1823 L1824 S1825	K1334-T1827 VanDerWaalsContact NZ-CG2 3.32Å; C1823-T1827 PolarHBondContact O-OG1 2.7Å; L1824-T1827 PolarHBondContact O-N 3.06Å; L1824-T1827 PolarHBondContact O-OG1 3.16Å; S1825-T1827 VanDerWaalsContact C-N 3.26Å; S1825-T1827 PolarHBondContact O-N 3.35Å
1828	T	31.5	Very low	44.5	Very low	95 Å²	95	82.6 Å²	82.6	58%	0.583	54%	0.543	S	S	*	.	H	α-helix	trans	-94.4	-15.9	177.4	54.3	0	0	0	0	113.3	S1825 S1830 S1831	S1825-T1828 PolarHBondContact O-N 2.85Å; S1825-T1828 PolarHBondContact O-OG1 3.4Å; S1825-T1828 VanDerWaalsContact O-OG1 3.13Å; T1828-S1830 PolarHBondContact O-N 3.41Å; T1828-S1831 PolarHBondContact O-N 3.49Å; T1828-S1831 PolarHBondContact O-OG 2.62Å
1829	S	29.1	Very low	42	Very low	86 Å²	86	84.7 Å²	84.7	60%	0.601	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-66.8	-14.1	-177.8	71.1	0	0	0	0	115.4	S1825 S1826 S1831	S1825-S1829 PolarHBondContact O-N 3.11Å; S1826-S1829 PolarHBondContact O-OG 3.36Å; S1829-S1831 PolarHBondContact O-N 3.42Å
1830	S	28	Very low	39.4	Very low	112 Å²	112	90.5 Å²	90.5	78%	0.783	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-76.6	0.9	178.8	56.2	0	0	0	0	115.1	T1828	T1828-S1830 PolarHBondContact O-N 3.41Å
1831	S	23.4	Very low	36.8	Very low	105 Å²	105	96.5 Å²	96.5	73%	0.734	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-138	29.6	-176.8	51.8	0	0	0	0	114.9	T1828 S1829	T1828-S1831 PolarHBondContact O-N 3.49Å; T1828-S1831 PolarHBondContact O-OG 2.62Å; S1829-S1831 PolarHBondContact O-N 3.42Å
1832	A	26	Very low	34.3	Very low	87 Å²	87	101.4 Å²	101.4	72%	0.719	65%	0.65	S	S	*	*			trans	-138.8	75.5	178.9	0	0	0	0	0	114.1
1833	S	21.9	Very low	32	Very low	121 Å²	121	106.9 Å²	106.9	85%	0.846	69%	0.685	S	S	*	*			trans	-91.3	119.9	166.4	60.8	0	0	0	0	111.6
1834	A	24.7	Very low	30.1	Very low	107 Å²	107	111.7 Å²	111.7	88%	0.884	72%	0.715	S	S	*	*			trans	72.7	90.9	170.4	0	0	0	0	0	118.3
1835	A	27.4	Very low	28.4	Very low	108 Å²	108	114.2 Å²	114.2	89%	0.893	73%	0.729	S	S	*	*			trans	-138	151.5	138.5	0	0	0	0	0	107.7
1836	A	24.3	Very low	27.1	Very low	107 Å²	107	117.2 Å²	117.2	88%	0.884	74%	0.743	S	S	*	*			trans	-122.5	150.8	-166	0	0	0	0	0	113.6
1837	G	23	Very low	26.1	Very low	68 Å²	68	121 Å²	121	70%	0.701	77%	0.77	S	S	*	*			trans	101	92.9	157.9	0	0	0	0	0	116
1838	Y	26.6	Very low	25.6	Very low	237 Å²	237	130.5 Å²	130.5	93%	0.929	81%	0.81	S	S	*	*			trans	-131.6	142.1	146	-94.3	-80.3	0	0	0	109.9
1839	T	25.2	Very low	25.3	Very low	118 Å²	118	132.3 Å²	132.3	72%	0.724	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-83.2	151.5	-176.3	44.7	0	0	0	0	111.9
1840	P	26.4	Very low	25.1	Very low	124 Å²	124	134.7 Å²	134.7	81%	0.805	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-63.3	140.7	167.1	30	-34.7	0	0	0	109.7
1841	L	27.1	Very low	24.9	Very low	169 Å²	169	135.9 Å²	135.9	89%	0.885	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-93.3	133	171.2	-103.4	163.6	0	0	0	109.4
1842	E	24.4	Very low	25	Very low	175 Å²	175	137.8 Å²	137.8	82%	0.818	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-71	143.3	-179.6	-65.6	171.1	115	0	0	111.1
1843	V	24.9	Very low	24.9	Very low	146 Å²	146	140.9 Å²	140.9	89%	0.885	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-87	122	164.2	177.2	0	0	0	0	107.6
1844	T	27.3	Very low	25.1	Very low	118 Å²	118	142.3 Å²	142.3	72%	0.724	85%	0.849	S	S	*	*			trans	-125.7	139	170.6	55.5	0	0	0	0	110.1
1845	D	21.8	Very low	25.2	Very low	152 Å²	152	144.8 Å²	144.8	81%	0.813	85%	0.847	S	S	*	*			trans	-65.4	173.8	-170.8	-65.7	-73.2	0	0	0	116.5
1846	V	23.4	Very low	25	Very low	129 Å²	129	147.6 Å²	147.6	78%	0.782	84%	0.843	S	S	*	*			trans	120.5	112.7	140.3	-176	0	0	0	0	115.9
1847	S	24	Very low	25.1	Very low	109 Å²	109	151 Å²	151	76%	0.762	84%	0.84	S	S	*	*			trans	48	115.6	161	67	0	0	0	0	117.9
1848	Q	26.6	Very low	25.2	Very low	267 Å²	267	158.5 Å²	158.5	100%	1.248	85%	0.852	S	S	*	*				-144.1	0	63	-135.4	172.4	-5.8	0	0	114.2

Retrieved 1,848 of 1,848 residues in 1863 ms (Link to these results)

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