A0A3Q0KRF0_SCHMA Loading...

Jumonji domain containing protein-related including hairless

AlphaFold DB , UniProt , Accession A0A3Q0KRF0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,575 aa.

						>A0A3Q0KRF0_SCHMA|A0A3Q0KRF0
MLPKKKRWMASAHTSSTNLISSPSTVNTISNIGSKKLCCDTPIQTVESLSRSLPNSVVSTQLPVRTLATGNLISTGDPYSLSMLQQQSLVDRSTSNLTTEYLHSDHKSQVVTSRQSSHPVKSTLPGRRNDVNPNLITTISHYPTELLQQQQQQPGLLLQVLPQEYLANYAQNLAKLNVNKNSGDLMHLPSNNCSTGSKINKMDTLSSVQNTGYSQGLLHQPDTQGRQTHISTHNNLPNLPLRIKSPDNSKIQRTSQSLRSSPMLNSPVFQYPAPNNSQRFSPPPHPPPRRLSGSGEQTRHNKPLTQSHQLPSGFDLPTISAVARAASMLSPSQLEAAAVLLSQWDNVNQLALLANNSSYRNLNNIVDSSGNKQPVNSSHNFSPPVSSEPNPVTSGGYIENHVHVMNRSGTGTDCKSRRVNDLSMTNTRTIPSVSTGTMSDLRYPSMKNSLSLPRSMDQLTNRLNSRSSTPGNEPMNKYDHMCCPPWSTTDQRAYSTDSSHSYKLQPSPHDHTVELADSRLAILHDAKLASLSVDWPSCTMPQNIPMSKANRIRSSGSLSSPVCLTPTSFSNTTSESSFSTNQLHTKAATTSSSQSLSSVSFVTSESLVRSPTSDHCSPTIPVNFNPKGPTLQTESPISSCCQTIKSLSPNTGITRVLNSSQSQFSAISGGKSPTGYSLCGQFLPTNTNSINNNDTIELSNHIESNRISNCPGKLSTLSEQYKRHPLVGTPNVMPTLLPQPKQECIRTKFTVDTNISDHRSQNTSMPLKKRLIQRYEADRVDMKPSELSTCNLVKTELPMDNSHNRSTNADDLKNKQYSPESRIAMKDNVIEKLDCQERKFKRKKRTKYETDGMSSLNTNKNKPTKIRTKSSLSSIRKSNSKSTRRLKHSLNDDVESKLSMNKQLSTMKLEFDDVTNDDEDEDVIVNDNNEEVVKEEQEENNDDDNNVDDEKIRPTVRRRRSRKHSSSANSTSSLSHTSLCNDLMRGSIKKRIAAVNGNLMMMVTAHAQRSTSSGSNNSNSSSSSLQSVGGEVSDDDNDVCLNSSSNSSVNTTRSKCSTDRQLSYSRLQSYKSTLKYLTMNSNTITNNNNNSIGNNNDNINSQSLNSNDGSPGITHSSIDSAQTVYGVGSGGNLRKPKRTATLAVASGTTIGSTIITAKKPRLSSVSSLTTTKPTTMMMEGKTVKTTSKQHRRGDNGKSRTTIHREDGDDSTVCMKFKTDLLNQDDYTLMCENSMADELSAALAEENFQFEKLVEQLPGPPDLNRTANKSLHSTHSLNFYKRSQRVFVQLINCNDPGLKQVPKCRACRQTKFSYHNSPSINTNGQMDSDNSDDDDGDDDDDDDVDEENPKLIISDIPSPTNSQNFSNGLNKDIQFKKPPGRRTTLGKNTRKENINDKSKNKRNSTHPSMSVFCRFWGFRKLCYNNRGVLKIADFCRSTESDALERSLWEMYHPVSPFLSTGAAKYLLECAGGLFCRLLHQELTSLNNNHAYQSQNEKINSLTGKNRISGHTMESNNKNDGIINSVAWKRPVKGVREMCDVCETTMFNTHWVCGKCGYSVCTDCLNESKSSNSVGGSNLDTRDHVKFNENGAVEKKGKLKYIRGRGCPYGWASCTTTRQHHDPNKLLLTSLLPSGIIGRLIHRLHRIANYYKINLGCNCSPSSSTVGNDATDLSNDTLLFMKPMKSLNNRECLDRNSLDLLADIALKADMGNTGSLTTGNSNNSSNGIIDNVVVETEFNASHNNPSFITTDNGVSLSDNDNNNERKMIMMDFPSHSWIHCTRRHINQRSCYQKINDAANTAKHKTKHNDNHGFDFHRESNLKIYKPSEIINRHHHHNPVFLRLHCPDSVGNLLAFQSEWRRNHPLVISGCQRKFTQELWTPQSFSNDFGDMKTTLIDCATGAEISRYTLKSFWDGFEKRERRITSKDGRPLCLKLKDWPTTDDFAELQPKRFNDLMLNLPMPNYTQRDGQLNLAARLSSFFVCPDLGPKLYVAYGTVGSCSISTTNLHVDIADAVNVMLYVGQPTDSLNEMLTNAESIVNTLTSAHIDDNYLERVLNWLNKIKSHQTDVHTNENNNNNTNNTTTTFSSTTHETDSEDIPGALWHIFLPEDSNGLREFLSRVSENETGTPVESGSDPIHDQLFYMDQSLLDRLYDCTGIQPCTIVQFHGDAVFIPAGAAHQVRNLNSCIKAAVDFVSPEHLPQCFQLMEEFRQLSPTHQNHEDKLQIKNMLFHGIKDALSVLLTSNDNNNNNNNDDNSTNNKENLVNLQSEVNSELRSHTRDRPFSTTSSTSEIIINNDHRMISNNSVIKSDSRSESSIHYNLQNYHVTNSVKSMNTNRGGRTRGRPGRPRAIDLTNHENIKLSSSSSPPPSSSIPPSNPMSNSNIFPVVPVLSVNAVVPGSGDCISDNDSTNNPGKFSNSFKISSRDSLSTISSSSSSSSLLYSSDIIKDIKSNIITTIATSSTSTCNTTTTVDCDKIPTTMIANVTSSSSLLSTSASGLSVNLDAPQLIPSVSFPCSSSFSLSSTSASISFSYSSSSSTPSFVSSALSSLSSACTAQKQHVSTNRLLNLTNNDYLS
					

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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	29.3	Very low	30.7	Very low	226 Å²	226	166.6 Å²	166.6	100%	1.113	81%	0.811	S	S	*	*				0	126	0	-59.7	-45.8	178.9	0	0	107.1
2	L	29.2	Very low	30.2	Very low	102 Å²	102	158.9 Å²	158.9	53%	0.534	79%	0.794	S	S	.	*			cis	59.1	131.7	35.6	-75.8	168.6	0	0	0	112	K4 K6	L2-K4 HydrophobicContact CD2-CG 4.38Å; L2-K6 HydrophobicContact CD2-CD 4.32Å
3	P	36.3	Very low	30.1	Very low	114 Å²	114	160.1 Å²	160.1	74%	0.74	80%	0.795	S	S	*	*			cis	-138.3	177.1	47.7	35.4	-16.3	0	0	0	115.7
4	K	32.6	Very low	29.6	Very low	169 Å²	169	157.3 Å²	157.3	74%	0.735	79%	0.792	S	S	*	*	S	Bend	cis	-173.6	137	-23.6	-96.5	163.4	-168.4	172.1	0	105.2	L2	L2-K4 HydrophobicContact CD2-CG 4.38Å
5	K	31.5	Very low	29.4	Very low	194 Å²	194	151.8 Å²	151.8	84%	0.843	77%	0.774	S	S	*	*	S	Bend	cis	-146.2	138.1	-15.6	-62.1	175.6	-177.7	175.2	0	107.7
6	K	30.5	Very low	29.5	Very low	171 Å²	171	149.9 Å²	149.9	74%	0.743	78%	0.778	S	S	*	*			cis	-146.3	83.5	-39	-152.5	-175.5	-178	-165	0	108	L2	L2-K6 HydrophobicContact CD2-CD 4.32Å
7	R	22.8	Very low	29.5	Very low	231 Å²	231	148.1 Å²	148.1	87%	0.872	78%	0.775	S	S	*	*	S	Bend	trans	-65.6	164.3	165.8	-170.4	171	179.4	168.7	-0.9	109.2	M9	R7-M9 PolarHBondContact O-N 2.83Å
8	W	36.6	Very low	29.7	Very low	248 Å²	248	147.4 Å²	147.4	94%	0.939	77%	0.773	S	S	*	*			trans	-43.1	127.7	-178.2	-54.7	-10.1	0	0	0	114.3
9	M	25.1	Very low	29.7	Very low	173 Å²	173	146.7 Å²	146.7	85%	0.852	77%	0.769	S	S	*	*			trans	-153.9	137.8	134.2	-73.4	-150.7	176.6	0	0	105.7	R7	R7-M9 PolarHBondContact O-N 2.83Å
10	A	31.1	Very low	29.5	Very low	91 Å²	91	146.5 Å²	146.5	75%	0.752	77%	0.767	S	S	*	*			cis	69.2	145.9	47.1	0	0	0	0	0	111.9
11	S	32.3	Very low	29.4	Very low	114 Å²	114	144.3 Å²	144.3	80%	0.797	76%	0.764	S	S	*	*			cis	-150.7	-172.9	6.2	-152.2	0	0	0	0	111.6
12	A	25.7	Very low	29.4	Very low	74 Å²	74	139 Å²	139	61%	0.612	75%	0.749	S	S	*	*			trans	70.9	160.4	169.1	0	0	0	0	0	115.1
13	H	28.7	Very low	29.4	Very low	174 Å²	174	139 Å²	139	81%	0.806	76%	0.756	S	S	*	*			cis	-124.1	-176.2	10.3	-89	-93.2	0	0	0	113.6
14	T	22.8	Very low	28.8	Very low	121 Å²	121	138.1 Å²	138.1	74%	0.742	75%	0.752	S	S	*	*			trans	-15	147.8	155.1	50.5	0	0	0	0	117.2
15	S	26.1	Very low	28.5	Very low	75 Å²	75	135.8 Å²	135.8	52%	0.524	75%	0.752	S	S	.	*			cis	-174.5	160.6	3.8	39.6	0	0	0	0	111.2	T17	S15-T17 VanDerWaalsContact O-CG2 3.26Å; S15-T17 WeakPolarHBondContact O-CG2 3.47Å; S15-T17 PolarHBondContact O-N 2.77Å
16	S	32.3	Very low	28.3	Very low	121 Å²	121	132.5 Å²	132.5	85%	0.846	75%	0.748	S	S	*	*			trans	52.9	48.8	159.7	54.4	0	0	0	0	115.2
17	T	28.5	Very low	28.1	Very low	119 Å²	119	130.1 Å²	130.1	73%	0.73	74%	0.743	S	S	*	*			trans	-132.9	136.3	-167.5	36.6	0	0	0	0	110.4	S15	S15-T17 VanDerWaalsContact O-CG2 3.26Å; S15-T17 WeakPolarHBondContact O-CG2 3.47Å; S15-T17 PolarHBondContact O-N 2.77Å
18	N	33.8	Very low	28.4	Very low	137 Å²	137	124.5 Å²	124.5	73%	0.733	74%	0.735	S	S	*	*			cis	70.5	142.1	-4.4	-135.5	-2.2	0	0	0	118.1
19	L	28.8	Very low	28.2	Very low	133 Å²	133	120.2 Å²	120.2	70%	0.696	73%	0.729	S	S	*	*			trans	78.8	114.4	163.5	-54	-176	0	0	0	122.4
20	I	26.7	Very low	28.4	Very low	142 Å²	142	116.3 Å²	116.3	73%	0.728	72%	0.718	S	S	*	*				88.5	141.2	122.9	-69.7	172.7	0	0	0	121.9
21	S	27.4	Very low	28.4	Very low	101 Å²	101	119.3 Å²	119.3	71%	0.706	72%	0.722	S	S	*	*			trans	81.1	112.5	157.2	64.8	0	0	0	0	121.6
22	S	28	Very low	28.4	Very low	114 Å²	114	122.1 Å²	122.1	80%	0.797	73%	0.726	S	S	*	*			trans	-72	138.6	137.4	52.4	0	0	0	0	110.5
23	P	30.1	Very low	28.7	Very low	104 Å²	104	121.2 Å²	121.2	68%	0.675	72%	0.724	S	S	*	*				-137.2	153.2	103.8	34.3	-21	0	0	0	111.8
24	S	24.5	Very low	28.8	Very low	94 Å²	94	117.7 Å²	117.7	66%	0.657	72%	0.719	S	S	*	*			cis	81.6	129.8	30.8	84.3	0	0	0	0	115.8
25	T	25.8	Very low	29.2	Very low	121 Å²	121	120.9 Å²	120.9	74%	0.742	72%	0.722	S	S	*	*			trans	62.3	164.6	174.6	64.2	0	0	0	0	114.8
26	V	26.6	Very low	29.5	Very low	125 Å²	125	126.8 Å²	126.8	76%	0.758	74%	0.739	S	S	*	*			cis	-139.3	141.5	17.5	167.1	0	0	0	0	110
27	N	26.4	Very low	29.2	Very low	120 Å²	120	128.7 Å²	128.7	64%	0.642	74%	0.738	S	S	*	*			cis	-137.3	-107.3	-25.6	-97.4	-17.2	0	0	0	107.5
28	T	29.3	Very low	29.2	Very low	113 Å²	113	127.9 Å²	127.9	69%	0.693	74%	0.736	S	S	*	*			cis	-163	143.9	-16.3	-25	0	0	0	0	109.1
29	I	31.6	Very low	29	Very low	159 Å²	159	126.3 Å²	126.3	82%	0.815	74%	0.735	S	S	*	*			trans	59.1	119	172.3	-50.9	167.1	0	0	0	115.4
30	S	30.6	Very low	28.8	Very low	90 Å²	90	127.7 Å²	127.7	63%	0.629	74%	0.743	S	S	*	*			cis	-167.9	139.6	-9.7	50	0	0	0	0	112
31	N	31.4	Very low	28.9	Very low	155 Å²	155	127.1 Å²	127.1	83%	0.829	75%	0.747	S	S	*	*			trans	66.3	167.6	167.2	-53.6	-28.3	0	0	0	116.6
32	I	31	Very low	29.4	Very low	172 Å²	172	127.9 Å²	127.9	88%	0.882	75%	0.749	S	S	*	*			cis	-139.7	-159.4	-5.1	-139.3	168.3	0	0	0	108.6
33	G	31.8	Very low	29.2	Very low	55 Å²	55	129.4 Å²	129.4	57%	0.567	75%	0.747	S	S	*	*			cis	-164.1	-141.2	20.5	0	0	0	0	0	114.5
34	S	30.4	Very low	29	Very low	100 Å²	100	132.6 Å²	132.6	70%	0.699	75%	0.752	S	S	*	*			trans	-170.3	165	-168.9	-79	0	0	0	0	114.3
35	K	32.3	Very low	29.1	Very low	188 Å²	188	133.4 Å²	133.4	82%	0.817	75%	0.754	S	S	*	*			cis	-148.3	-110.4	-11.7	-110.3	173.9	-169.9	80.4	0	114.2
36	K	31.3	Very low	29.1	Very low	200 Å²	200	134.1 Å²	134.1	87%	0.87	76%	0.758	S	S	*	*			trans	-161.6	148.5	-171.7	-64.8	-170.5	177.9	-168.9	0	116.2
37	L	27.6	Very low	29.1	Very low	160 Å²	160	136.2 Å²	136.2	84%	0.838	76%	0.759	S	S	*	*			trans	6.4	161.7	134.5	-82.2	61	0	0	0	121.4
38	C	27.9	Very low	29	Very low	102 Å²	102	134.1 Å²	134.1	69%	0.689	75%	0.754	S	S	*	*			cis	-167.3	174.3	15.4	-132.6	0	0	0	0	115.7
39	C	29.3	Very low	28.9	Very low	104 Å²	104	135.7 Å²	135.7	70%	0.703	76%	0.757	S	S	*	*			trans	66.7	123.7	149.8	-64.2	0	0	0	0	124
40	D	24.9	Very low	28.6	Very low	163 Å²	163	133.1 Å²	133.1	87%	0.872	75%	0.754	S	S	*	*				173.3	174.2	113.6	-85.9	-11.5	0	0	0	112.7
41	T	29.3	Very low	28.4	Very low	130 Å²	130	140 Å²	140	80%	0.798	77%	0.765	S	S	*	*			trans	-137.8	-178.6	-168.1	56.5	0	0	0	0	112.3
42	P	37.3	Very low	28.1	Very low	117 Å²	117	137.4 Å²	137.4	76%	0.76	76%	0.76	S	S	*	*			cis	-104.5	-139.3	-13.2	13.9	9.4	0	0	0	112.7
43	I	23.8	Very low	27.7	Very low	145 Å²	145	136.8 Å²	136.8	74%	0.744	76%	0.758	S	S	*	*			cis	-153.4	164.6	16.9	-65	171	0	0	0	110.2
44	Q	26.5	Very low	27.9	Very low	171 Å²	171	138.6 Å²	138.6	80%	0.799	76%	0.759	S	S	*	*			trans	86	130.8	159	-108.5	171.6	10.8	0	0	120.3
45	T	25.5	Very low	27.9	Very low	112 Å²	112	140.8 Å²	140.8	69%	0.687	76%	0.763	S	S	*	*			trans	20.6	124	144.2	50.1	0	0	0	0	118.1
46	V	26.2	Very low	27.6	Very low	135 Å²	135	136 Å²	136	82%	0.818	75%	0.753	S	S	*	*			cis	-159.3	-178.1	17.2	-105	0	0	0	0	108.5
47	E	26.8	Very low	27.6	Very low	170 Å²	170	130.6 Å²	130.6	79%	0.794	74%	0.737	S	S	*	*			cis	-145	-100.4	16.4	-156.7	-153.5	-85	0	0	114.4
48	S	24.9	Very low	27.6	Very low	76 Å²	76	128.7 Å²	128.7	53%	0.531	73%	0.732	S	S	.	*			trans	-124.3	155.5	-156.9	66.7	0	0	0	0	115.6
49	L	25.5	Very low	27.6	Very low	146 Å²	146	128.4 Å²	128.4	76%	0.764	73%	0.731	S	S	*	*			trans	62.1	95.4	148.2	-68.6	167.2	0	0	0	121.2
50	S	25.4	Very low	27.6	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	72%	0.717	S	S	*	*				104.4	125.3	108.4	78.1	0	0	0	0	121.2
51	R	26.8	Very low	27.9	Very low	233 Å²	233	123.4 Å²	123.4	88%	0.879	70%	0.696	S	S	*	*			trans	44	99.4	141.3	-73.3	-172.6	175.1	-173.1	-1.5	120.4
52	S	25	Very low	27.8	Very low	102 Å²	102	122.7 Å²	122.7	71%	0.713	69%	0.687	S	S	*	*				47.4	101.1	118.6	62.9	0	0	0	0	119.6
53	L	24.1	Very low	27.9	Very low	159 Å²	159	122.2 Å²	122.2	83%	0.832	68%	0.684	S	S	*	*				-24.3	162.8	129.2	-88.3	82.1	0	0	0	115.8
54	P	35.6	Very low	28.2	Very low	92 Å²	92	121.1 Å²	121.1	60%	0.597	68%	0.684	S	S	*	*			cis	-151.4	-177.3	-21.4	40.3	-20.8	0	0	0	117.6
55	N	29.5	Very low	28.4	Very low	146 Å²	146	123.5 Å²	123.5	78%	0.781	69%	0.686	S	S	*	*			trans	80.2	148.9	138.5	-78.8	-33.6	0	0	0	122.1
56	S	27.6	Very low	28.6	Very low	87 Å²	87	123.4 Å²	123.4	61%	0.608	69%	0.685	S	S	*	*			cis	178.1	-172	-34.4	51.4	0	0	0	0	110.5
57	V	29.2	Very low	28.7	Very low	88 Å²	88	125 Å²	125	53%	0.533	69%	0.688	S	S	.	*			trans	94.9	121.1	163	-178.3	0	0	0	0	116.3	K1594	V57-K1594 HydrophobicContact CG1-CD 4.07Å
58	V	29.3	Very low	28.8	Very low	120 Å²	120	120.3 Å²	120.3	73%	0.727	68%	0.678	S	S	*	*			cis	-170.4	159.7	-9.3	76.2	0	0	0	0	113.3
59	S	27.9	Very low	29.1	Very low	96 Å²	96	123.7 Å²	123.7	67%	0.671	70%	0.696	S	S	*	*			trans	66	149.7	155.2	-67.3	0	0	0	0	120.7
60	T	29.5	Very low	29.4	Very low	67 Å²	67	120.3 Å²	120.3	41%	0.411	70%	0.696	S	S	.	*			cis	-172.9	168.1	-10	32.2	0	0	0	0	109.1	N1586	T60-N1586 WeakPolarHBondContact CB-O 3.36Å; T60-N1586 PolarHBondContact OG1-O 3.23Å
61	Q	29.8	Very low	29.6	Very low	94 Å²	94	122.9 Å²	122.9	44%	0.439	70%	0.702	S	S	.	*			cis	-149	-100.5	-47.5	-125.1	169.3	-53.8	0	0	113	E1587 N1588	Q61-E1587 VanDerWaalsContact CB-C 3.47Å; Q61-E1587 WeakPolarHBondContact CB-O 3.44Å; Q61-N1588 VanDerWaalsContact CD-O 3.24Å; Q61-N1588 PolarHBondContact NE2-O 2.74Å; Q61-N1588 PolarHBondContact OE1-O 3.25Å
62	L	27.8	Very low	29.6	Very low	116 Å²	116	119.7 Å²	119.7	61%	0.607	70%	0.701	S	S	*	*			trans	-137.8	160.4	-171.3	-38.3	93.4	0	0	0	113.7	E1587	L62-E1587 PolarHBondContact N-O 3.48Å; L62-E1587 VanDerWaalsContact N-O 3.11Å; L62-E1587 VanDerWaalsContact O-O 3.12Å
63	P	39.9	Very low	29.8	Very low	106 Å²	106	123.1 Å²	123.1	69%	0.688	71%	0.71	S	S	*	*				-150.1	141.3	82.3	41.6	-22.9	0	0	0	116.6
64	V	30.4	Very low	29.9	Very low	122 Å²	122	120.6 Å²	120.6	74%	0.739	71%	0.706	S	S	*	*				70.3	124.9	104.6	177.8	0	0	0	0	116.5
65	R	29.2	Very low	29.4	Very low	222 Å²	222	123 Å²	123	84%	0.838	72%	0.719	S	S	*	*			cis	-141.4	-108.2	-12.2	-110.7	178.5	177.7	171.8	-2.4	109.9
66	T	29.7	Very low	29.3	Very low	109 Å²	109	118.8 Å²	118.8	67%	0.669	71%	0.709	S	S	*	*			cis	-167.8	130.6	-12.5	-22.1	0	0	0	0	112.3
67	L	28.3	Very low	29.4	Very low	169 Å²	169	121.9 Å²	121.9	89%	0.885	72%	0.719	S	S	*	*			trans	60.9	146	160.1	-71	164.1	0	0	0	119
68	A	30.7	Very low	29.4	Very low	71 Å²	71	123.7 Å²	123.7	59%	0.587	73%	0.733	S	S	*	*			cis	-159.9	171.2	-7.7	0	0	0	0	0	112.8
69	T	31.1	Very low	29.3	Very low	148 Å²	148	127.8 Å²	127.8	91%	0.908	74%	0.737	S	S	*	*			trans	59	133.5	156	49	0	0	0	0	121.4
70	G	30.2	Very low	29.1	Very low	75 Å²	75	128.2 Å²	128.2	77%	0.773	74%	0.739	S	S	*	*			trans	143	74.5	160.1	0	0	0	0	0	115.2
71	N	30	Very low	29	Very low	159 Å²	159	133.3 Å²	133.3	85%	0.85	76%	0.763	S	S	*	*			trans	-71.1	138.3	-179.7	-64.9	-9.7	0	0	0	112.5
72	L	27.7	Very low	28.8	Very low	166 Å²	166	133.2 Å²	133.2	87%	0.869	77%	0.773	S	S	*	*				174	107.4	122.1	-95.7	167.4	0	0	0	111.6
73	I	28.5	Very low	28.8	Very low	174 Å²	174	135.2 Å²	135.2	89%	0.892	78%	0.781	S	S	*	*	S	Bend	trans	-162.9	145.7	134.5	-98.7	155.8	0	0	0	106.6
74	S	27.1	Very low	28.2	Very low	106 Å²	106	137 Å²	137	74%	0.741	78%	0.784	S	S	*	*			trans	-66	143.5	-154.5	-165.9	0	0	0	0	116.6
75	T	24.6	Very low	28.1	Very low	143 Å²	143	137.6 Å²	137.6	88%	0.877	78%	0.779	S	S	*	*			trans	-118	130.3	143.7	53	0	0	0	0	108.3
76	G	28.1	Very low	28.1	Very low	56 Å²	56	133.9 Å²	133.9	58%	0.577	77%	0.771	S	S	*	*			trans	148.5	112.4	166.7	0	0	0	0	0	114.2
77	D	28.2	Very low	28.1	Very low	153 Å²	153	137.2 Å²	137.2	82%	0.818	78%	0.779	S	S	*	*			trans	63.7	147.4	150.7	-60.3	-15.4	0	0	0	117.4
78	P	30.4	Very low	28.2	Very low	126 Å²	126	134 Å²	134	82%	0.818	77%	0.771	S	S	*	*			cis	-119.6	151.3	46.4	40.3	-31.1	0	0	0	117.2
79	Y	27.2	Very low	28	Very low	206 Å²	206	138 Å²	138	81%	0.808	78%	0.781	S	S	*	*			trans	-73.1	154	150.8	-103.7	-101.2	0	0	0	110.7
80	S	22.7	Very low	27.9	Very low	104 Å²	104	136.6 Å²	136.6	73%	0.727	77%	0.772	S	S	*	*			trans	23.9	112.3	153.4	61.2	0	0	0	0	119.5
81	L	26.7	Very low	27.6	Very low	175 Å²	175	140.2 Å²	140.2	92%	0.916	77%	0.774	S	S	*	*			trans	-147.8	166.5	140.8	-117.4	173.7	0	0	0	111.4
82	S	26.5	Very low	27.4	Very low	92 Å²	92	144.2 Å²	144.2	64%	0.643	78%	0.777	S	S	*	*			trans	-122.6	166.3	-165.8	55.2	0	0	0	0	112.4
83	M	27	Very low	27.3	Very low	158 Å²	158	141.8 Å²	141.8	78%	0.778	77%	0.774	S	S	*	*			trans	67.3	119.8	155.8	-73.3	-100	169.6	0	0	119.1
84	L	28.2	Very low	27	Very low	142 Å²	142	139.6 Å²	139.6	74%	0.743	77%	0.769	S	S	*	*			trans	69.6	139.5	145.9	-59.1	166.3	0	0	0	117
85	Q	28.7	Very low	27.1	Very low	136 Å²	136	140.1 Å²	140.1	64%	0.636	77%	0.772	S	S	*	*			cis	-155.5	149.7	8.3	-153.8	165.7	-81.4	0	0	112.7
86	Q	29.3	Very low	27.2	Very low	143 Å²	143	138.3 Å²	138.3	67%	0.668	76%	0.757	S	S	*	*			trans	59.8	118.4	162	-79	151.6	-29.9	0	0	118.4
87	Q	28.8	Very low	27.2	Very low	179 Å²	179	138.6 Å²	138.6	84%	0.836	75%	0.745	S	S	*	*				70.5	133.4	81.2	-71.8	178.1	-12.1	0	0	113.9
88	S	29.6	Very low	27.2	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	75%	0.75	S	S	*	*			cis	-150	-179.4	7.3	63.1	0	0	0	0	113.6
89	L	27.8	Very low	27	Very low	155 Å²	155	138 Å²	138	81%	0.812	75%	0.745	S	S	*	*			trans	-77.1	178.3	172.3	-59.4	92.7	0	0	0	111.2
90	V	28.1	Very low	27	Very low	118 Å²	118	136.6 Å²	136.6	72%	0.715	75%	0.746	S	S	*	*			cis	-156	146.5	37.5	175.7	0	0	0	0	113
91	D	24.9	Very low	27.2	Very low	151 Å²	151	139 Å²	139	81%	0.807	74%	0.74	S	S	*	*			trans	37.5	144.4	158.2	-55.5	-14.8	0	0	0	125.1
92	R	26	Very low	27	Very low	244 Å²	244	135.2 Å²	135.2	92%	0.921	72%	0.721	S	S	*	*			trans	-156.1	124.2	161.5	-166.5	-176.3	-163.9	-171	6.4	110.3
93	S	24	Very low	26.9	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	72%	0.716	S	S	*	*			trans	-153	120.7	167.9	60.1	0	0	0	0	112.6
94	T	24.2	Very low	26.7	Very low	127 Å²	127	133.8 Å²	133.8	78%	0.779	71%	0.713	S	S	*	*			trans	-144.5	144.6	165.4	49.3	0	0	0	0	108.8
95	S	27.2	Very low	26.6	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	71%	0.711	S	S	*	*			trans	-172.8	152	151.4	17.4	0	0	0	0	110.2
96	N	28.5	Very low	26.5	Very low	105 Å²	105	132.3 Å²	132.3	56%	0.561	71%	0.706	S	S	*	*			trans	-113.6	174.7	-162.7	-76.4	28.3	0	0	0	111.5	D1670	N96-D1670 HydrophobicContact CB-CB 4.24Å; N96-D1670 VanDerWaalsContact CB-CG 3.47Å; N96-D1670 WeakPolarHBondContact CB-OD2 3.44Å; N96-D1670 VanDerWaalsContact ND2-CG 3.34Å; N96-D1670 PolarHBondContact ND2-OD2 2.92Å
97	L	26.9	Very low	26.3	Very low	62 Å²	62	132.6 Å²	132.6	33%	0.325	71%	0.705	S	S	.	*			trans	-80.9	155.2	-177.3	-72.6	81.8	0	0	0	112.7	D1670	L97-D1670 WeakPolarHBondContact CB-OD1 3.25Å; L97-D1670 HydrophobicContact CD1-CB 4.5Å; L97-D1670 WeakPolarHBondContact CD1-OD1 3.41Å; L97-D1670 PolarHBondContact N-OD1 3.26Å
98	T	29.3	Very low	26.1	Very low	149 Å²	149	127.1 Å²	127.1	91%	0.914	69%	0.686	S	S	*	*			trans	-143.6	153.5	135.5	17.4	0	0	0	0	108.6
99	T	24.9	Very low	26	Very low	117 Å²	117	129.9 Å²	129.9	72%	0.718	69%	0.688	S	S	*	*			trans	-131.3	127.8	-173.7	-52.7	0	0	0	0	110.6
100	E	27.2	Very low	25.9	Very low	177 Å²	177	126.6 Å²	126.6	83%	0.827	67%	0.674	S	S	*	*			trans	-128.4	123	167.3	-77.9	-139.3	118.5	0	0	114.2
101	Y	26.8	Very low	26	Very low	155 Å²	155	125.1 Å²	125.1	61%	0.608	67%	0.665	S	S	*	*			trans	42.1	100.2	134.1	-72.2	-88.4	0	0	0	122.5
102	L	23.1	Very low	26.3	Very low	96 Å²	96	122 Å²	122	50%	0.503	65%	0.651	S	S	.	*				55	141.5	112.5	-59.7	-175.7	0	0	0	122.9	K1683 S1684	L102-K1683 HydrophobicContact CD2-CB 4.47Å; L102-K1683 VanDerWaalsContact CD2-O 3.27Å; L102-K1683 WeakPolarHBondContact CD2-O 3.34Å; L102-S1684 VanDerWaalsContact CD1-CB 3.48Å
103	H	25.1	Very low	26.4	Very low	120 Å²	120	115.3 Å²	115.3	56%	0.556	64%	0.642	S	S	*	*			trans	98.8	108.6	143	-92.5	30.3	0	0	0	121.3	S1684	H103-S1684 WeakPolarHBondContact CE1-CB 3.43Å; H103-S1684 PolarHBondContact CE1-OG 3.46Å; H103-S1684 PolarHBondContact NE2-OG 2.98Å
104	S	23.1	Very low	26.6	Very low	100 Å²	100	119.7 Å²	119.7	70%	0.699	64%	0.641	S	S	*	*				34.6	126.1	125.8	-48.9	0	0	0	0	120.7
105	D	24.2	Very low	26.8	Very low	131 Å²	131	120.7 Å²	120.7	70%	0.701	64%	0.637	S	S	*	*			trans	-41.4	142	156.9	-80.3	-85.8	0	0	0	113.2
106	H	27.3	Very low	26.7	Very low	115 Å²	115	120.6 Å²	120.6	53%	0.532	64%	0.636	S	S	.	*				-159.7	154.4	106.1	-115.2	-81	0	0	0	115.5
107	K	25.4	Very low	26.6	Very low	150 Å²	150	120.9 Å²	120.9	65%	0.652	65%	0.647	S	S	*	*			trans	-73.6	163.2	-178.1	-63.8	145.8	-175.7	157.8	0	111
108	S	25.5	Very low	26.9	Very low	64 Å²	64	126.5 Å²	126.5	45%	0.448	67%	0.671	S	S	.	*			cis	-157.4	157.1	26.4	-28.2	0	0	0	0	113.8
109	Q	26.3	Very low	27.3	Very low	159 Å²	159	124.7 Å²	124.7	74%	0.743	66%	0.661	S	S	*	*			trans	21.4	148.8	136	-44.6	176.2	-35	0	0	120.2
110	V	25.9	Very low	27.4	Very low	86 Å²	86	125 Å²	125	52%	0.521	66%	0.663	S	S	.	*			cis	-149.4	147.9	24.4	-150.8	0	0	0	0	107.9	T1579	V110-T1579 VanDerWaalsContact CG2-O 3.31Å; V110-T1579 WeakPolarHBondContact CG2-O 3.18Å
111	V	30.7	Very low	27.4	Very low	88 Å²	88	126 Å²	126	53%	0.533	66%	0.664	S	S	.	*				174.3	121.7	96.9	158.1	0	0	0	0	110.8
112	T	30	Very low	27.4	Very low	84 Å²	84	123.5 Å²	123.5	52%	0.515	67%	0.67	S	S	.	*			trans	41.5	136.3	152.7	65.6	0	0	0	0	126.1
113	S	29.7	Very low	27.8	Very low	104 Å²	104	124.6 Å²	124.6	73%	0.727	68%	0.681	S	S	*	*			trans	64.4	130.6	145.3	45.8	0	0	0	0	120.2
114	R	28	Very low	27.8	Very low	208 Å²	208	126.5 Å²	126.5	79%	0.785	69%	0.694	S	S	*	*				66.5	140	55.5	-80	-161	175.7	179.9	-1.6	114.5
115	Q	27	Very low	28.3	Very low	148 Å²	148	127.6 Å²	127.6	69%	0.692	70%	0.699	S	S	*	*			cis	-175.2	141.8	-20.4	-160.8	166.7	-1.2	0	0	108.7
116	S	26.3	Very low	28.5	Very low	115 Å²	115	124.8 Å²	124.8	80%	0.804	70%	0.701	S	S	*	*			trans	61.7	154	169.7	29.2	0	0	0	0	117.4
117	S	26.6	Very low	28.5	Very low	111 Å²	111	128.5 Å²	128.5	78%	0.776	71%	0.71	S	S	*	*			cis	-152.5	163.6	-2	44.1	0	0	0	0	112.6
118	H	32.7	Very low	28.5	Very low	179 Å²	179	131 Å²	131	83%	0.829	72%	0.715	S	S	*	*			trans	-53.9	177.8	162	-57.2	-72.8	0	0	0	113.4
119	P	37.5	Very low	28.5	Very low	111 Å²	111	132.6 Å²	132.6	72%	0.721	72%	0.719	S	S	*	*			cis	-139.9	-179.6	10.5	32.3	-8.3	0	0	0	117
120	V	26.6	Very low	28.5	Very low	124 Å²	124	131.3 Å²	131.3	75%	0.752	72%	0.717	S	S	*	*				166.8	141	114.3	160.2	0	0	0	0	112.1
121	K	26.9	Very low	28.6	Very low	197 Å²	197	133.3 Å²	133.3	86%	0.857	73%	0.729	S	S	*	*			trans	-12.4	152.7	160.7	-51.8	169.1	-175.3	177.8	0	117.7
122	S	28.3	Very low	28.5	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	74%	0.736	S	S	*	*			cis	-129.2	-144.8	18.3	51	0	0	0	0	112.2
123	T	31	Very low	28.6	Very low	119 Å²	119	135.7 Å²	135.7	73%	0.73	74%	0.741	S	S	*	*			cis	-158.4	154.9	11.9	-29.2	0	0	0	0	111.6
124	L	25.4	Very low	28.4	Very low	160 Å²	160	137.1 Å²	137.1	84%	0.838	74%	0.74	S	S	*	*			trans	-137.6	172.5	166.1	-116.4	85.8	0	0	0	107.1
125	P	33	Very low	28.5	Very low	123 Å²	123	134.1 Å²	134.1	80%	0.799	74%	0.739	S	S	*	*			cis	-149	-168.6	32.6	44.4	-23.7	0	0	0	117.2
126	G	28.1	Very low	28.4	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	74%	0.739	S	S	*	*			trans	97.5	107.5	161.2	0	0	0	0	0	114.4
127	R	26.8	Very low	28.5	Very low	193 Å²	193	132.5 Å²	132.5	73%	0.728	73%	0.728	S	S	*	*			cis	90.2	122.6	26.5	-149.4	-158.8	-139.6	-51.9	-5.2	114.2	E1735	R127-E1735 IonicContact CZ-OE2 3.96Å; R127-E1735 IonicContact NH1-OE2 3.82Å; R127-E1735 PolarHBondContact NH1-OE2 2.94Å; R127-E1735 IonicContact NH2-OE2 2.72Å; R127-E1735 PolarHBondContact NH2-OE2 2.98Å
128	R	26.7	Very low	28.7	Very low	203 Å²	203	134.1 Å²	134.1	77%	0.766	73%	0.734	S	S	*	*			trans	98.4	117.4	164.5	-69.2	-165.5	167.4	159.9	-3.4	119.9
129	N	26.1	Very low	28.5	Very low	97 Å²	97	131.5 Å²	131.5	52%	0.519	73%	0.725	S	S	.	*				75.9	126.2	124	-72.9	72.3	0	0	0	122.1
130	D	24.7	Very low	27.9	Very low	132 Å²	132	130.4 Å²	130.4	71%	0.706	72%	0.72	S	S	*	*			trans	75.1	139.5	131	-59.3	-28.1	0	0	0	122.5
131	V	28.5	Very low	28.1	Very low	128 Å²	128	133.1 Å²	133.1	78%	0.776	72%	0.724	S	S	*	*			trans	71.8	97.7	153.5	174.3	0	0	0	0	118.4
132	N	28.1	Very low	28	Very low	126 Å²	126	133.8 Å²	133.8	67%	0.674	72%	0.722	S	S	*	*			trans	-60.7	133.4	146.6	177.6	14	0	0	0	109.9
133	P	32.6	Very low	28.3	Very low	96 Å²	96	134.1 Å²	134.1	62%	0.623	72%	0.722	S	S	*	*				-149.3	158.7	117.1	37.7	-21.7	0	0	0	116.1
134	N	26.2	Very low	28	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	72%	0.723	S	S	*	*			trans	-68.6	141.2	156.5	-62.1	-75.5	0	0	0	111.5
135	L	29.1	Very low	28	Very low	146 Å²	146	134 Å²	134	76%	0.764	72%	0.718	S	S	*	*			trans	-142.7	130.1	136.2	-85.6	112.7	0	0	0	107.2
136	I	25.8	Very low	27.7	Very low	132 Å²	132	134.8 Å²	134.8	68%	0.677	71%	0.714	S	S	*	*				66.2	119.9	60.6	-56.7	163.8	0	0	0	108.1
137	T	27.5	Very low	27.6	Very low	96 Å²	96	137.9 Å²	137.9	59%	0.589	71%	0.713	S	S	*	*				-159.9	133.7	52.3	-32.5	0	0	0	0	112.8	I139	T137-I139 HydrophobicContact CG2-CD1 3.86Å; T137-I139 HydrophobicContact CG2-CG1 4.29Å
138	T	31.9	Very low	27.6	Very low	145 Å²	145	135.6 Å²	135.6	89%	0.89	71%	0.711	S	S	*	*			trans	-161.4	80.4	137.9	-2.2	0	0	0	0	111.9
139	I	28.7	Very low	27.6	Very low	124 Å²	124	133 Å²	133	64%	0.636	71%	0.707	S	S	*	*			trans	-29.6	125.5	151.5	-70.3	155.4	0	0	0	110.8	T137	T137-I139 HydrophobicContact CG2-CD1 3.86Å; T137-I139 HydrophobicContact CG2-CG1 4.29Å
140	S	24.4	Very low	27.5	Very low	88 Å²	88	135.6 Å²	135.6	62%	0.615	72%	0.716	S	S	*	*			cis	81.3	150.7	39.8	88.2	0	0	0	0	114.8
141	H	30.7	Very low	27.6	Very low	181 Å²	181	136.7 Å²	136.7	84%	0.838	72%	0.717	S	S	*	*			trans	-162.6	149.1	153.9	-103.7	-70.5	0	0	0	112.7
142	Y	23.8	Very low	27.5	Very low	211 Å²	211	139.2 Å²	139.2	83%	0.827	72%	0.721	S	S	*	*			trans	-117.5	-160.9	178.2	-90.5	-109.8	0	0	0	107.9
143	P	35.4	Very low	27.3	Very low	111 Å²	111	141.9 Å²	141.9	72%	0.721	73%	0.729	S	S	*	*			cis	-133.5	-159.9	-15.4	23.3	3.9	0	0	0	113.7
144	T	24.1	Very low	27.4	Very low	121 Å²	121	142 Å²	142	74%	0.742	73%	0.73	S	S	*	*			trans	-46.8	168.8	153.8	1.3	0	0	0	0	114
145	E	26.6	Very low	27.5	Very low	156 Å²	156	137.6 Å²	137.6	73%	0.729	72%	0.716	S	S	*	*			cis	-160.8	153.1	20.1	-151.5	170.6	-110.5	0	0	108.6
146	L	26.1	Very low	27.5	Very low	140 Å²	140	136 Å²	136	73%	0.733	71%	0.707	S	S	*	*				167.7	165.8	87.5	-104.5	172.5	0	0	0	111.6
147	L	26.5	Very low	27.7	Very low	136 Å²	136	133.1 Å²	133.1	71%	0.712	69%	0.693	S	S	*	*			trans	58.4	109.2	160.4	-102.7	72.6	0	0	0	122
148	Q	25.3	Very low	27.8	Very low	145 Å²	145	135.1 Å²	135.1	68%	0.678	70%	0.7	S	S	*	*				73.3	132.9	114.8	-169.2	164	-16.8	0	0	122.8
149	Q	26.5	Very low	27.7	Very low	147 Å²	147	135.3 Å²	135.3	69%	0.687	69%	0.691	S	S	*	*			trans	77.1	126.8	158.1	-85.4	162.4	-34.4	0	0	122.2
150	Q	25.3	Very low	27.8	Very low	152 Å²	152	134.7 Å²	134.7	71%	0.71	69%	0.692	S	S	*	*			trans	62.2	108.9	140.4	-70.7	174	-46.4	0	0	123
151	Q	25.6	Very low	27.7	Very low	156 Å²	156	138.7 Å²	138.7	73%	0.729	71%	0.706	S	S	*	*				73.4	139.8	122.1	-69.2	-171.6	-3.8	0	0	123.4
152	Q	27.9	Very low	27.7	Very low	180 Å²	180	135.4 Å²	135.4	84%	0.841	70%	0.701	S	S	*	*			trans	80.9	161.7	155.7	-68.4	177.4	34.5	0	0	120.9
153	Q	22.4	Very low	27.6	Very low	182 Å²	182	134.3 Å²	134.3	85%	0.85	70%	0.703	S	S	*	*			trans	-106.2	-161.6	-168.7	-53	-169.8	0.9	0	0	111
154	P	34.7	Very low	27.2	Very low	99 Å²	99	137.4 Å²	137.4	64%	0.643	71%	0.708	S	S	*	*			cis	-147.8	148.3	-1.5	38.5	-15.7	0	0	0	120.8	R1192	P154-R1192 PolarHBondContact O-NH2 3.01Å
155	G	28.3	Very low	27.2	Very low	41 Å²	41	141.8 Å²	141.8	42%	0.423	71%	0.712	S	S	.	*				109.9	114.7	105.3	0	0	0	0	0	124.3	R1192	G155-R1192 PolarHBondContact O-NH2 3.11Å
156	L	30	Very low	27.2	Very low	112 Å²	112	139.9 Å²	139.9	59%	0.586	71%	0.707	S	S	*	*			trans	78.1	163.9	135.7	-45.6	-178.8	0	0	0	118.4	R1191 R1192	L156-R1191 PolarHBondContact O-NH1 2.92Å; L156-R1191 PolarHBondContact O-NH2 2.9Å; L156-R1192 HydrophobicContact CD1-CG 4.09Å
157	L	30.2	Very low	27.1	Very low	72 Å²	72	137.2 Å²	137.2	38%	0.377	71%	0.705	S	S	.	*			cis	-168.4	155.6	-5.5	-140.8	76.9	0	0	0	107.4	R1191	L157-R1191 HydrophobicContact CB-CG 3.89Å; L157-R1191 HydrophobicContact CD2-CG 4.44Å; L157-R1191 PolarHBondContact O-NE 3.42Å; L157-R1191 PolarHBondContact O-NH2 3.26Å
158	L	29.9	Very low	27.1	Very low	138 Å²	138	138.5 Å²	138.5	72%	0.723	71%	0.712	S	S	*	*			cis	-125.7	-109.6	-14.6	-162.2	41.3	0	0	0	108.3
159	Q	29.9	Very low	27	Very low	150 Å²	150	142.8 Å²	142.8	70%	0.701	72%	0.724	S	S	*	*			cis	-164.8	158.5	-16.5	-136	173.1	1.3	0	0	106.1
160	V	30.8	Very low	27	Very low	110 Å²	110	140.6 Å²	140.6	67%	0.667	73%	0.731	S	S	*	*	S	Bend	cis	-136.7	128	11.2	-175.2	0	0	0	0	110.9
161	L	22.4	Very low	27.1	Very low	173 Å²	173	142.5 Å²	142.5	91%	0.906	74%	0.74	S	S	*	*			trans	-175.8	110.3	137.2	-104.7	174	0	0	0	108.4
162	P	29.1	Very low	27.1	Very low	112 Å²	112	143.1 Å²	143.1	73%	0.727	75%	0.748	S	S	*	*			trans	-105.5	148.2	-174.9	37.2	-31.6	0	0	0	114.3
163	Q	22.6	Very low	26.9	Very low	187 Å²	187	142.5 Å²	142.5	87%	0.874	75%	0.75	S	S	*	*			trans	-76.9	155.8	154.7	-64.9	155.1	-79.5	0	0	109.8
164	E	27.1	Very low	27	Very low	177 Å²	177	138.2 Å²	138.2	83%	0.827	75%	0.745	S	S	*	*			trans	-167.7	105.5	140	-116	171.2	-135.6	0	0	110.7
165	Y	24.8	Very low	26.7	Very low	212 Å²	212	142.3 Å²	142.3	83%	0.831	75%	0.753	S	S	*	*			trans	-147.7	44.8	165.8	-135.5	-86.7	0	0	0	111.7
166	L	25.2	Very low	26.7	Very low	117 Å²	117	147 Å²	147	61%	0.613	77%	0.767	S	S	*	*			trans	-143	40.1	-179.1	-121.5	166.7	0	0	0	113.2	L1228	L166-L1228 HydrophobicContact CD1-CD2 3.48Å; L166-L1228 VanDerWaalsContact CD1-CD2 3.48Å; L166-L1228 HydrophobicContact CD1-CG 3.95Å
167	A	24.9	Very low	26.4	Very low	84 Å²	84	147.8 Å²	147.8	69%	0.694	77%	0.773	S	S	*	*	S	Bend	trans	-132.1	45.8	178.7	0	0	0	0	0	112.1
168	N	26.4	Very low	26.4	Very low	163 Å²	163	149.2 Å²	149.2	87%	0.872	78%	0.784	S	S	*	*	S	Bend	trans	-153.7	25.9	177.4	-116.9	-38	0	0	0	116.8
169	Y	23.2	Very low	26.3	Very low	235 Å²	235	148.6 Å²	148.6	92%	0.922	78%	0.781	S	S	*	*	S	Bend	trans	-143.6	19.1	169.2	-145.5	-101.6	0	0	0	116.1
170	A	25.8	Very low	26.4	Very low	101 Å²	101	149.2 Å²	149.2	84%	0.835	78%	0.782	S	S	*	*	S	Bend	trans	-137.7	26.7	179.9	0	0	0	0	0	114.3
171	Q	27	Very low	26.3	Very low	191 Å²	191	150.4 Å²	150.4	89%	0.893	78%	0.784	S	S	*	*	S	Bend	trans	-141	57	169.8	-138.5	174.3	55.3	0	0	112.5
172	N	25.9	Very low	26.7	Very low	169 Å²	169	148.2 Å²	148.2	90%	0.904	78%	0.784	S	S	*	*	S	Bend	trans	-149.3	47.3	163.6	-106.7	-35.9	0	0	0	111.4
173	L	23.7	Very low	26.7	Very low	168 Å²	168	146.4 Å²	146.4	88%	0.88	79%	0.785	S	S	*	*	S	Bend	trans	-143	131.9	166.6	-101.7	172.5	0	0	0	108.8
174	A	25.5	Very low	26.8	Very low	92 Å²	92	144.9 Å²	144.9	76%	0.76	78%	0.783	S	S	*	*			trans	56.7	126.9	-164.3	0	0	0	0	0	113
175	K	27.9	Very low	26.8	Very low	184 Å²	184	144.2 Å²	144.2	80%	0.8	78%	0.784	S	S	*	*			cis	-155.7	157.7	47.5	-78.5	-173.1	172.5	-179.5	0	108.7
176	L	27.5	Very low	26.7	Very low	139 Å²	139	140.7 Å²	140.7	73%	0.728	78%	0.777	S	S	*	*			cis	-168.9	161.4	-6.8	-94.1	165.1	0	0	0	104.1
177	N	25.4	Very low	26.7	Very low	130 Å²	130	141.8 Å²	141.8	70%	0.695	78%	0.779	S	S	*	*			cis	179	-175.3	-10.8	-176.6	23.1	0	0	0	108.6
178	V	28.9	Very low	26.6	Very low	101 Å²	101	144.3 Å²	144.3	61%	0.612	78%	0.78	S	S	*	*			trans	89.1	131.2	153.5	-178.3	0	0	0	0	118
179	N	28.7	Very low	26.7	Very low	125 Å²	125	142 Å²	142	67%	0.668	77%	0.774	S	S	*	*			trans	77.6	131.9	165.2	-69.7	-16.6	0	0	0	119.3
180	K	31.6	Very low	26.9	Very low	163 Å²	163	134.3 Å²	134.3	71%	0.709	75%	0.754	S	S	*	*			cis	-166.7	139.9	-18.5	-129.8	175.1	-166.9	173.4	0	112.6
181	N	27.8	Very low	26.8	Very low	135 Å²	135	135.8 Å²	135.8	72%	0.722	75%	0.748	S	S	*	*			trans	58.9	157.1	143.4	-70.5	11.5	0	0	0	122.9
182	S	30.9	Very low	26.8	Very low	128 Å²	128	133 Å²	133	90%	0.895	74%	0.739	S	S	*	*			trans	70.2	130.6	164.3	60.2	0	0	0	0	117.5
183	G	29.9	Very low	26.9	Very low	73 Å²	73	130.8 Å²	130.8	75%	0.753	74%	0.736	S	S	*	*			cis	-167.3	142	-6.3	0	0	0	0	0	113.4
184	D	25.2	Very low	26.8	Very low	155 Å²	155	127.3 Å²	127.3	83%	0.829	73%	0.725	S	S	*	*			trans	-79.3	180	-178.7	-55.1	-84.4	0	0	0	113.3
185	L	26.4	Very low	26.7	Very low	163 Å²	163	129.5 Å²	129.5	85%	0.853	73%	0.73	S	S	*	*			trans	84.7	140	163.5	-56.9	153.2	0	0	0	117.1
186	M	23.3	Very low	26.5	Very low	139 Å²	139	123.6 Å²	123.6	69%	0.685	72%	0.721	S	S	*	*			cis	175.1	166.9	-37.4	-106.2	-85.5	-101.6	0	0	108.2
187	H	23.9	Very low	26.3	Very low	140 Å²	140	122.5 Å²	122.5	65%	0.648	73%	0.725	S	S	*	*			trans	61.3	115.2	158.2	-70.9	-57	0	0	0	121
188	L	23.9	Very low	26.3	Very low	136 Å²	136	124.7 Å²	124.7	71%	0.712	73%	0.728	S	S	*	*			trans	65.8	171.7	136.9	-87.1	77.7	0	0	0	117.6
189	P	28.6	Very low	26	Very low	115 Å²	115	125.8 Å²	125.8	75%	0.747	73%	0.73	S	S	*	*			cis	-97.5	157.6	-9.4	42.3	-34.8	0	0	0	110.6
190	S	26.4	Very low	25.6	Very low	74 Å²	74	123 Å²	123	52%	0.517	71%	0.714	S	S	.	*			cis	66.8	131.5	40	80.5	0	0	0	0	115.8
191	N	24.9	Very low	25.2	Very low	132 Å²	132	121.3 Å²	121.3	71%	0.706	71%	0.707	S	S	*	*			trans	65.3	103	152.8	-62.2	-3.7	0	0	0	120.7
192	N	26.5	Very low	25	Very low	132 Å²	132	121.7 Å²	121.7	71%	0.706	71%	0.706	S	S	*	*				62.7	103.8	111.3	-50.8	-16	0	0	0	119.2
193	C	28.2	Very low	24.8	Very low	123 Å²	123	118.6 Å²	118.6	83%	0.831	68%	0.68	S	S	*	*				-124.6	131.1	117.9	-86.8	0	0	0	0	107.4
194	S	20.6	Very low	24.8	Very low	94 Å²	94	119.4 Å²	119.4	66%	0.657	67%	0.67	S	S	*	*				71.3	130.4	59.3	-57.9	0	0	0	0	110.9
195	T	24.2	Very low	24.9	Very low	138 Å²	138	118.9 Å²	118.9	85%	0.847	67%	0.667	S	S	*	*			cis	-150.5	178.4	14.5	-16.2	0	0	0	0	111.7
196	G	23.7	Very low	25.3	Very low	61 Å²	61	116.4 Å²	116.4	63%	0.629	66%	0.663	S	S	*	*			trans	-67.8	-166.4	171.5	0	0	0	0	0	114.4
197	S	23.8	Very low	25.7	Very low	115 Å²	115	113.4 Å²	113.4	80%	0.804	66%	0.656	S	S	*	*			trans	83.2	104.7	-151.9	-45.7	0	0	0	0	110.3
198	K	24.3	Very low	25.9	Very low	176 Å²	176	112.8 Å²	112.8	77%	0.765	66%	0.662	S	S	*	*				47.9	122.9	65.4	-169.1	-148.3	-168.9	-174.6	0	109.4
199	I	22.5	Very low	26.2	Very low	125 Å²	125	113.4 Å²	113.4	64%	0.641	66%	0.661	S	S	*	*			trans	64.7	110.6	160.2	-85.5	169	0	0	0	112.7
200	N	21.2	Very low	26	Very low	65 Å²	65	114.8 Å²	114.8	35%	0.348	66%	0.662	S	S	.	*			cis	-155.6	147.4	20.3	-98	-36.2	0	0	0	108.1	M202	N200-M202 HydrophobicContact CB-CB 3.83Å; N200-M202 HydrophobicContact CB-CG 3.74Å; N200-M202 HydrophobicContact CB-SD 3.96Å; N200-M202 WeakPolarHBondContact ND2-CE 3.32Å; N200-M202 PolarHBondContact ND2-SD 2.81Å
201	K	22.4	Very low	25.8	Very low	129 Å²	129	114.9 Å²	114.9	56%	0.561	66%	0.659	S	S	*	*				50	-129	73.7	-49.5	-160	-65.6	66.5	0	109.8	D203 T204	K201-D203 WeakPolarHBondContact CB-OD1 3.39Å; K201-D203 IonicContact NZ-OD1 3.21Å; K201-D203 PolarHBondContact NZ-OD1 3.49Å; K201-D203 IonicContact NZ-OD2 2.77Å; K201-T204 WeakPolarHBondContact CA-OG1 3.39Å; K201-T204 WeakPolarHBondContact CB-OG1 3.39Å; K201-T204 HydrophobicContact CD-CG2 4.32Å
202	M	23.3	Very low	25.8	Very low	142 Å²	142	111.9 Å²	111.9	70%	0.7	66%	0.66	S	S	*	*	S	Bend	trans	49.7	63.4	171.2	-75.3	174.4	175.3	0	0	115.7	N200	N200-M202 HydrophobicContact CB-CB 3.83Å; N200-M202 HydrophobicContact CB-CG 3.74Å; N200-M202 HydrophobicContact CB-SD 3.96Å; N200-M202 WeakPolarHBondContact ND2-CE 3.32Å; N200-M202 PolarHBondContact ND2-SD 2.81Å
203	D	27.1	Very low	25.9	Very low	64 Å²	64	115.4 Å²	115.4	34%	0.342	67%	0.665	S	S	.	*			cis	-160.5	146.8	-7.2	-109.2	-15.5	0	0	0	107.1	K201 L205	K201-D203 WeakPolarHBondContact CB-OD1 3.39Å; K201-D203 IonicContact NZ-OD1 3.21Å; K201-D203 PolarHBondContact NZ-OD1 3.49Å; K201-D203 IonicContact NZ-OD2 2.77Å; D203-L205 HydrophobicContact CB-CB 4Å; D203-L205 HydrophobicContact CB-CD1 4.02Å; D203-L205 HydrophobicContact CB-CG 3.76Å; D203-L205 PolarHBondContact O-N 2.98Å
204	T	30.4	Very low	25.6	Very low	89 Å²	89	113 Å²	113	55%	0.546	65%	0.649	S	S	.	*			cis	56.1	11.6	42.1	-20.4	0	0	0	0	114	K201	K201-T204 WeakPolarHBondContact CA-OG1 3.39Å; K201-T204 WeakPolarHBondContact CB-OG1 3.39Å; K201-T204 HydrophobicContact CD-CG2 4.32Å
205	L	28.2	Very low	25.8	Very low	144 Å²	144	112 Å²	112	75%	0.754	63%	0.634	S	S	*	*			trans	-120.8	86.8	163.4	-76.3	169.8	0	0	0	103.3	D203	D203-L205 HydrophobicContact CB-CB 4Å; D203-L205 HydrophobicContact CB-CD1 4.02Å; D203-L205 HydrophobicContact CB-CG 3.76Å; D203-L205 PolarHBondContact O-N 2.98Å
206	S	33.2	Very low	26.1	Very low	112 Å²	112	107.2 Å²	107.2	78%	0.783	61%	0.613	S	S	*	*	S	Bend	cis	-156.6	163.8	34.1	35.8	0	0	0	0	110.7
207	S	32.8	Very low	26.6	Very low	75 Å²	75	109.4 Å²	109.4	52%	0.524	61%	0.609	S	S	.	*			cis	-170.4	147.9	-12.5	173.1	0	0	0	0	103.4	Q209	S207-Q209 PolarHBondContact O-N 3.01Å; S207-Q209 VanDerWaalsContact O-N 3.14Å; S207-Q209 VanDerWaalsContact O-O 3.05Å; S207-Q209 PolarHBondContact OG-N 2.84Å; S207-Q209 VanDerWaalsContact OG-N 3.14Å
208	V	28.5	Very low	26.9	Very low	128 Å²	128	106.6 Å²	106.6	78%	0.776	59%	0.585	S	S	*	*				54.7	5.8	59.9	-165.2	0	0	0	0	113.6
209	Q	29.9	Very low	27.2	Very low	148 Å²	148	101.5 Å²	101.5	69%	0.692	56%	0.563	S	S	*	*				-96.8	124.1	128.5	-79.9	-173.2	-34.4	0	0	106.1	S207 T211	S207-Q209 PolarHBondContact O-N 3.01Å; S207-Q209 VanDerWaalsContact O-N 3.14Å; S207-Q209 VanDerWaalsContact O-O 3.05Å; S207-Q209 PolarHBondContact OG-N 2.84Å; S207-Q209 VanDerWaalsContact OG-N 3.14Å; Q209-T211 CarbonylContact C-O 3.59Å; Q209-T211 VanDerWaalsContact C-O 3.29Å
210	N	23.4	Very low	27.8	Very low	144 Å²	144	96.9 Å²	96.9	77%	0.77	54%	0.539	S	S	*	.			cis	53.5	101.4	19.2	-169	24.1	0	0	0	112.2
211	T	23.3	Very low	28.6	Very low	76 Å²	76	97.5 Å²	97.5	47%	0.466	55%	0.547	S	S	.	.			trans	66.3	123.7	-134.1	83.7	0	0	0	0	111	Q209 Y213	Q209-T211 CarbonylContact C-O 3.59Å; Q209-T211 VanDerWaalsContact C-O 3.29Å; T211-Y213 HydrophobicContact CG2-CD2 3.9Å; T211-Y213 HydrophobicContact CG2-CE2 4.38Å
212	G	24.5	Very low	28.9	Very low	69 Å²	69	96 Å²	96	71%	0.711	55%	0.545	S	S	*	.			cis	73.6	-176.9	-4.1	0	0	0	0	0	114.6
213	Y	28.9	Very low	29.1	Very low	206 Å²	206	90 Å²	90	81%	0.808	52%	0.516	S	S	*	.			trans	63.8	156.3	180	-61.6	-83.5	0	0	0	116.6	T211	T211-Y213 HydrophobicContact CG2-CD2 3.9Å; T211-Y213 HydrophobicContact CG2-CE2 4.38Å
214	S	22.5	Very low	29	Very low	73 Å²	73	90.8 Å²	90.8	51%	0.51	52%	0.518	S	S	.	.			trans	65.1	114.2	173.9	83.8	0	0	0	0	115
215	Q	23.6	Very low	29.2	Very low	73 Å²	73	87.1 Å²	87.1	34%	0.341	50%	0.498	S	S	.	.			cis	-152.2	162.7	-9.2	-34.5	163.8	34.6	0	0	105	G225 R226 H229	Q215-G225 WeakPolarHBondContact CB-O 3.35Å; Q215-R226 VanDerWaalsContact C-N 3.33Å; Q215-R226 VanDerWaalsContact CB-O 3.31Å; Q215-R226 WeakPolarHBondContact CB-O 3.36Å; Q215-R226 WeakPolarHBondContact CG-O 3.45Å; Q215-R226 PolarHBondContact NE2-O 3.05Å; Q215-R226 CarbonylContact O-C 3.51Å; Q215-R226 WeakPolarHBondContact O-CA 3.39Å; Q215-R226 PolarHBondContact O-N 2.99Å; Q215-R226 PolarHBondContact OE1-O 3.03Å; Q215-H229 PolarHBondContact NE2-CE1 2.88Å; Q215-H229 VanDerWaalsContact NE2-CE1 3.27Å; Q215-H229 PolarHBondContact NE2-ND1 3.2Å; Q215-H229 PolarHBondContact OE1-CE1 3.36Å; Q215-H229 PolarHBondContact OE1-ND1 2.78Å
216	G	31.1	Very low	29.4	Very low	38 Å²	38	86.1 Å²	86.1	39%	0.392	48%	0.484	S	S	.	.	B	Isolated β-bridge	cis	-164.2	157.9	5.8	0	0	0	0	0	109.6	G225	G216-G225 VanDerWaalsContact N-C 3.34Å; G216-G225 PolarHBondContact O-N 3.45Å; G216-G225 VanDerWaalsContact O-N 3.12Å
217	L	34.7	Very low	29	Very low	107 Å²	107	87.5 Å²	87.5	56%	0.56	48%	0.479	S	S	*	.				75.5	142.7	93.5	-58.7	170.8	0	0	0	110.9	T223 Q224	L217-T223 CarbonylContact O-C 3.52Å; L217-Q224 CarbonylContact O-C 3.58Å; L217-Q224 VanDerWaalsContact O-CA 3.28Å; L217-Q224 WeakPolarHBondContact O-CA 3.45Å; L217-Q224 PolarHBondContact O-N 3.4Å
218	L	30.3	Very low	29.1	Very low	55 Å²	55	88.3 Å²	88.3	29%	0.288	48%	0.48	S	S	.	.			cis	-160.6	-143	-2.1	-125.8	171.4	0	0	0	107.8	T223 M2332 N2333	L218-T223 WeakPolarHBondContact CB-OG1 2.96Å; L218-M2332 VanDerWaalsContact C-SD 3.54Å; L218-M2332 HydrophobicContact CD2-CB 3.5Å; L218-M2332 VanDerWaalsContact CD2-CB 3.5Å; L218-M2332 HydrophobicContact CD2-CG 4.34Å; L218-M2332 HydrophobicContact CD2-SD 4.05Å; L218-N2333 HydrophobicContact CD2-CB 4.39Å
219	H	30.3	Very low	29.3	Very low	69 Å²	69	87.6 Å²	87.6	32%	0.319	47%	0.468	S	S	.	.	S	Bend	trans	-52.4	-173.7	157.8	-101.8	-8.2	0	0	0	113.1	P221 T223 S2331 M2332 N2333	H219-P221 CarbonylContact O-C 3.17Å; H219-P221 VanDerWaalsContact O-C 3.28Å; H219-P221 WeakPolarHBondContact O-CA 3.09Å; H219-T223 WeakPolarHBondContact O-CB 3.15Å; H219-T223 WeakPolarHBondContact O-CG2 3.19Å; H219-T223 PolarHBondContact O-N 3.3Å; H219-T223 PolarHBondContact O-OG1 2.82Å; H219-S2331 VanDerWaalsContact CB-C 3.45Å; H219-S2331 WeakPolarHBondContact CB-O 3.28Å; H219-S2331 PolarHBondContact CD2-O 3.21Å; H219-M2332 VanDerWaalsContact CB-CA 3.44Å; H219-M2332 HydrophobicContact CB-CB 3.4Å; H219-M2332 VanDerWaalsContact CB-CB 3.4Å; H219-M2332 HydrophobicContact CB-CG 4.13Å; H219-M2332 WeakPolarHBondContact CD2-CA 3.32Å; H219-M2332 VanDerWaalsContact CD2-CB 3.48Å; H219-M2332 WeakPolarHBondContact CD2-CB 3.26Å; H219-M2332 PolarHBondContact CD2-N 3.35Å; H219-M2332 PolarHBondContact CD2-O 3.07Å; H219-M2332 WeakPolarHBondContact CE1-CA 3.25Å; H219-M2332 VanDerWaalsContact CE1-CB 3.4Å; H219-M2332 WeakPolarHBondContact CE1-CB 3.42Å; H219-M2332 PolarHBondContact CE1-N 3.41Å; H219-M2332 VanDerWaalsContact N-CB 3.31Å; H219-M2332 WeakPolarHBondContact ND1-CA 3.21Å; H219-M2332 WeakPolarHBondContact ND1-CB 3.04Å; H219-M2332 WeakPolarHBondContact ND1-CG 3.05Å; H219-M2332 PolarHBondContact ND1-N 3.27Å; H219-M2332 WeakPolarHBondContact NE2-CA 3.47Å; H219-M2332 PolarHBondContact NE2-N 3.34Å; H219-N2333 PolarHBondContact NE2-N 3.25Å
220	Q	34.6	Very low	29.7	Very low	29 Å²	29	85.6 Å²	85.6	14%	0.136	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	-136.3	-143.9	-167.1	173.6	-39	0	0	107.1	D222 T223 H233 K2330 S2331	Q220-D222 HydrophobicContact CG-CB 4.32Å; Q220-D222 VanDerWaalsContact CG-OD2 3.3Å; Q220-D222 WeakPolarHBondContact CG-OD2 3.47Å; Q220-D222 PolarHBondContact NE2-OD2 2.75Å; Q220-T223 HydrophobicContact CB-CG2 3.42Å; Q220-T223 VanDerWaalsContact CB-CG2 3.42Å; Q220-T223 HydrophobicContact CG-CG2 4.48Å; Q220-H233 PolarHBondContact OE1-CD2 3.36Å; Q220-H233 VanDerWaalsContact OE1-N 3.14Å; Q220-K2330 HydrophobicContact CB-CD 4.23Å; Q220-K2330 VanDerWaalsContact CD-CE 3.43Å; Q220-K2330 HydrophobicContact CG-CD 3.71Å; Q220-K2330 HydrophobicContact CG-CG 4.27Å; Q220-K2330 VanDerWaalsContact NE2-NZ 3.15Å; Q220-S2331 VanDerWaalsContact CA-OG 3.27Å; Q220-S2331 WeakPolarHBondContact CA-OG 3.4Å; Q220-S2331 PolarHBondContact N-OG 3.17Å; Q220-S2331 PolarHBondContact O-OG 2.76Å
221	P	36.8	Very low	30.3	Very low	78 Å²	78	81.3 Å²	81.3	51%	0.506	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn		-106.7	-29.4	115.8	-19.8	34.6	0	0	0	112.9	H219 T223	H219-P221 CarbonylContact O-C 3.17Å; H219-P221 VanDerWaalsContact O-C 3.28Å; H219-P221 WeakPolarHBondContact O-CA 3.09Å; P221-T223 PolarHBondContact O-N 3.29Å
222	D	29.6	Very low	30.5	Very low	96 Å²	96	81 Å²	81	51%	0.513	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	43.1	-176.2	-19.7	-109.5	0	0	0	112.7	Q220 Q224 T232	Q220-D222 HydrophobicContact CG-CB 4.32Å; Q220-D222 VanDerWaalsContact CG-OD2 3.3Å; Q220-D222 WeakPolarHBondContact CG-OD2 3.47Å; Q220-D222 PolarHBondContact NE2-OD2 2.75Å; D222-Q224 PolarHBondContact O-NE2 3.36Å; D222-T232 WeakPolarHBondContact O-CA 3.41Å; D222-T232 PolarHBondContact O-N 3.27Å
223	T	27.3	Very low	30.5	Very low	17 Å²	17	81.1 Å²	81.1	10%	0.104	42%	0.422	C	S	.	.			trans	-110.2	28.1	163	84.4	0	0	0	0	115.3	L217 L218 H219 Q220 P221 T232	L217-T223 CarbonylContact O-C 3.52Å; L218-T223 WeakPolarHBondContact CB-OG1 2.96Å; H219-T223 WeakPolarHBondContact O-CB 3.15Å; H219-T223 WeakPolarHBondContact O-CG2 3.19Å; H219-T223 PolarHBondContact O-N 3.3Å; H219-T223 PolarHBondContact O-OG1 2.82Å; Q220-T223 HydrophobicContact CB-CG2 3.42Å; Q220-T223 VanDerWaalsContact CB-CG2 3.42Å; Q220-T223 HydrophobicContact CG-CG2 4.48Å; P221-T223 PolarHBondContact O-N 3.29Å; T223-T232 HydrophobicContact CG2-CG2 3.77Å
224	Q	26.4	Very low	30.6	Very low	80 Å²	80	76.3 Å²	76.3	37%	0.374	41%	0.411	S	S	.	.			trans	51.4	128.7	132	-58.2	161.4	50	0	0	119.1	L217 D222 I230 S231 T232	L217-Q224 CarbonylContact O-C 3.58Å; L217-Q224 VanDerWaalsContact O-CA 3.28Å; L217-Q224 WeakPolarHBondContact O-CA 3.45Å; L217-Q224 PolarHBondContact O-N 3.4Å; D222-Q224 PolarHBondContact O-NE2 3.36Å; Q224-I230 VanDerWaalsContact CB-O 3.3Å; Q224-I230 WeakPolarHBondContact CB-O 3.44Å; Q224-I230 PolarHBondContact OE1-O 3.44Å; Q224-S231 VanDerWaalsContact NE2-C 3.28Å; Q224-T232 VanDerWaalsContact NE2-N 3.13Å; Q224-T232 PolarHBondContact NE2-O 3.47Å
225	G	33.3	Very low	30.9	Very low	13 Å²	13	78.8 Å²	78.8	13%	0.134	42%	0.418	C	S	.	.	B	Isolated β-bridge		118.3	128.4	98.3	0	0	0	0	0	119	Q215 G216	Q215-G225 WeakPolarHBondContact CB-O 3.35Å; G216-G225 VanDerWaalsContact N-C 3.34Å; G216-G225 PolarHBondContact O-N 3.45Å; G216-G225 VanDerWaalsContact O-N 3.12Å
226	R	32.8	Very low	31.2	Very low	123 Å²	123	83 Å²	83	46%	0.464	44%	0.442	S	S	.	.			trans	59.7	127.8	137.7	-70.9	168.4	60.4	-157.4	11.7	119.3	Q215 T228 H229	Q215-R226 VanDerWaalsContact C-N 3.33Å; Q215-R226 VanDerWaalsContact CB-O 3.31Å; Q215-R226 WeakPolarHBondContact CB-O 3.36Å; Q215-R226 WeakPolarHBondContact CG-O 3.45Å; Q215-R226 PolarHBondContact NE2-O 3.05Å; Q215-R226 CarbonylContact O-C 3.51Å; Q215-R226 WeakPolarHBondContact O-CA 3.39Å; Q215-R226 PolarHBondContact O-N 2.99Å; Q215-R226 PolarHBondContact OE1-O 3.03Å; R226-T228 VanDerWaalsContact CZ-OG1 3.28Å; R226-T228 PolarHBondContact NE-OG1 3.25Å; R226-T228 PolarHBondContact NH1-O 2.73Å; R226-T228 PolarHBondContact NH2-O 2.68Å; R226-T228 PolarHBondContact NH2-OG1 2.73Å; R226-T228 PolarHBondContact O-N 2.9Å; R226-H229 WeakPolarHBondContact CB-O 2.97Å; R226-H229 WeakPolarHBondContact CD-O 3.44Å; R226-H229 VanDerWaalsContact CZ-O 3.22Å; R226-H229 PolarHBondContact NE-O 2.97Å; R226-H229 PolarHBondContact NH1-O 2.92Å; R226-H229 PolarHBondContact O-N 3.14Å
227	Q	24.5	Very low	31.2	Very low	141 Å²	141	86 Å²	86	66%	0.659	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	122.1	132.5	-97.4	-159.1	7.2	0	0	107.3
228	T	35.1	Very low	30.8	Very low	92 Å²	92	88 Å²	88	56%	0.564	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.8	12.5	-160.7	72	0	0	0	0	118.4	R226	R226-T228 VanDerWaalsContact CZ-OG1 3.28Å; R226-T228 PolarHBondContact NE-OG1 3.25Å; R226-T228 PolarHBondContact NH1-O 2.73Å; R226-T228 PolarHBondContact NH2-O 2.68Å; R226-T228 PolarHBondContact NH2-OG1 2.73Å; R226-T228 PolarHBondContact O-N 2.9Å
229	H	33.1	Very low	30.9	Very low	112 Å²	112	92.8 Å²	92.8	52%	0.519	49%	0.491	S	S	.	.			trans	61.7	-167.8	159.3	-40.7	-72.7	0	0	0	117.4	Q215 R226	Q215-H229 PolarHBondContact NE2-CE1 2.88Å; Q215-H229 VanDerWaalsContact NE2-CE1 3.27Å; Q215-H229 PolarHBondContact NE2-ND1 3.2Å; Q215-H229 PolarHBondContact OE1-CE1 3.36Å; Q215-H229 PolarHBondContact OE1-ND1 2.78Å; R226-H229 WeakPolarHBondContact CB-O 2.97Å; R226-H229 WeakPolarHBondContact CD-O 3.44Å; R226-H229 VanDerWaalsContact CZ-O 3.22Å; R226-H229 PolarHBondContact NE-O 2.97Å; R226-H229 PolarHBondContact NH1-O 2.92Å; R226-H229 PolarHBondContact O-N 3.14Å
230	I	37.7	Very low	30.9	Very low	106 Å²	106	94.7 Å²	94.7	54%	0.544	51%	0.51	S	S	.	.			trans	71.1	149.8	174.9	-51	175.8	0	0	0	114.1	Q224	Q224-I230 VanDerWaalsContact CB-O 3.3Å; Q224-I230 WeakPolarHBondContact CB-O 3.44Å; Q224-I230 PolarHBondContact OE1-O 3.44Å
231	S	35.3	Very low	30.5	Very low	55 Å²	55	100.1 Å²	100.1	39%	0.385	54%	0.539	S	S	.	.				175.4	130	-69.3	57.4	0	0	0	0	110.4	Q224	Q224-S231 VanDerWaalsContact NE2-C 3.28Å
232	T	28.2	Very low	29.9	Very low	68 Å²	68	107.1 Å²	107.1	42%	0.417	56%	0.555	S	S	.	*			trans	62.9	155.8	151.7	69.5	0	0	0	0	121.3	D222 T223 Q224	D222-T232 WeakPolarHBondContact O-CA 3.41Å; D222-T232 PolarHBondContact O-N 3.27Å; T223-T232 HydrophobicContact CG2-CG2 3.77Å; Q224-T232 VanDerWaalsContact NE2-N 3.13Å; Q224-T232 PolarHBondContact NE2-O 3.47Å
233	H	25.6	Very low	29.7	Very low	72 Å²	72	110.6 Å²	110.6	33%	0.333	57%	0.572	S	S	.	*				26.4	147.4	128.1	-68.3	-123.5	0	0	0	120.4	Q220 K2330	Q220-H233 PolarHBondContact OE1-CD2 3.36Å; Q220-H233 VanDerWaalsContact OE1-N 3.14Å; H233-K2330 WeakPolarHBondContact CE1-CD 3.31Å; H233-K2330 VanDerWaalsContact NE2-CD 3.29Å; H233-K2330 WeakPolarHBondContact NE2-CD 3.36Å
234	N	29.6	Very low	29.6	Very low	105 Å²	105	115.4 Å²	115.4	56%	0.561	59%	0.592	S	S	*	*			cis	-161.4	154.5	27.7	-126.2	-7	0	0	0	113
235	N	28.2	Very low	29.5	Very low	125 Å²	125	115.3 Å²	115.3	67%	0.668	60%	0.599	S	S	*	*			trans	47.8	133	148.1	-58.7	-16.3	0	0	0	123.6
236	L	31.9	Very low	29.8	Very low	161 Å²	161	119.9 Å²	119.9	84%	0.843	63%	0.627	S	S	*	*			trans	-11.7	151.4	133.4	-100.4	71.6	0	0	0	116.7
237	P	31	Very low	29.5	Very low	102 Å²	102	120.6 Å²	120.6	66%	0.662	64%	0.64	S	S	*	*				-154.4	173.5	57.8	44.5	-25.1	0	0	0	120.3
238	N	24.8	Very low	29.6	Very low	148 Å²	148	120.9 Å²	120.9	79%	0.791	65%	0.646	S	S	*	*			trans	80.1	135.1	145.7	-67.6	-16.4	0	0	0	123.8
239	L	32.2	Very low	29.3	Very low	157 Å²	157	120.7 Å²	120.7	82%	0.822	65%	0.648	S	S	*	*			trans	-72.2	-177.5	152.6	-76.8	85.6	0	0	0	109.7
240	P	31.6	Very low	29.1	Very low	108 Å²	108	124.5 Å²	124.5	70%	0.701	66%	0.663	S	S	*	*			cis	-152	167	19.5	44.7	-22.5	0	0	0	121.1
241	L	25.2	Very low	28.6	Very low	143 Å²	143	126.6 Å²	126.6	75%	0.749	67%	0.674	S	S	*	*			trans	41.4	116.1	133.6	-59.6	172.1	0	0	0	125.2
242	R	25.6	Very low	28.1	Very low	226 Å²	226	131.2 Å²	131.2	85%	0.853	69%	0.69	S	S	*	*				79.5	124.7	105.9	-169.9	-168.8	-165.9	169.3	5.6	123.7
243	I	25.5	Very low	27.9	Very low	168 Å²	168	137.6 Å²	137.6	86%	0.862	71%	0.706	S	S	*	*			trans	-170.3	156.8	156.9	-108.9	165.3	0	0	0	110
244	K	24.7	Very low	27.9	Very low	119 Å²	119	140.4 Å²	140.4	52%	0.517	73%	0.728	S	S	.	*			cis	-144.5	-94.8	-28	-161.6	-174.7	173.1	-89.6	0	115.7	Y1076	K244-Y1076 HydrophobicContact CD-CE1 3.9Å; K244-Y1076 PolarHBondContact NZ-OH 2.69Å
245	S	23.7	Very low	27.8	Very low	77 Å²	77	141.1 Å²	141.1	54%	0.538	74%	0.742	S	S	.	*			trans	-178.7	178.6	-159.6	68.5	0	0	0	0	112.5
246	P	39	Very low	27.7	Very low	110 Å²	110	144.2 Å²	144.2	71%	0.714	75%	0.752	S	S	*	*			cis	-136.8	-142.3	0.5	49.3	-29.9	0	0	0	111.3
247	D	26.8	Very low	27.5	Very low	138 Å²	138	141.4 Å²	141.4	74%	0.738	75%	0.746	S	S	*	*			cis	-158.6	179.3	-32.2	-134.1	-59.5	0	0	0	111.6
248	N	27.5	Very low	27.1	Very low	146 Å²	146	143.3 Å²	143.3	78%	0.781	75%	0.75	S	S	*	*			trans	60.7	139.7	158.5	-79.5	-40.1	0	0	0	121.3
249	S	28.2	Very low	27.1	Very low	88 Å²	88	146.7 Å²	146.7	62%	0.615	75%	0.751	S	S	*	*			cis	-160	151.1	-13.9	80.6	0	0	0	0	113.4
250	K	29	Very low	26.6	Very low	192 Å²	192	144.5 Å²	144.5	84%	0.835	75%	0.749	S	S	*	*			trans	57.7	144.6	156.2	-65.9	171.8	-178.2	170.3	0	121.5
251	I	27.6	Very low	26.3	Very low	151 Å²	151	144.7 Å²	144.7	77%	0.774	75%	0.753	S	S	*	*			cis	-169.2	134.6	-27.8	-175.6	167.2	0	0	0	109.1
252	Q	24.5	Very low	26.8	Very low	152 Å²	152	143.1 Å²	143.1	71%	0.71	75%	0.752	S	S	*	*			trans	-170.5	159.6	149.4	-117.1	-171.2	107.7	0	0	115
253	R	24.2	Very low	26.6	Very low	202 Å²	202	137.3 Å²	137.3	76%	0.762	74%	0.735	S	S	*	*			trans	42.9	129.3	156.9	-63.6	-174.7	-170.3	-158	-1.9	121.7
254	T	24.7	Very low	26.5	Very low	130 Å²	130	135 Å²	135	80%	0.798	72%	0.724	S	S	*	*			trans	75.6	145.8	150.9	43.7	0	0	0	0	120.4
255	S	29.1	Very low	26.5	Very low	120 Å²	120	136.2 Å²	136.2	84%	0.839	74%	0.736	S	S	*	*			trans	62	97.5	176.1	28.8	0	0	0	0	118.1
256	Q	25.9	Very low	26.6	Very low	190 Å²	190	138.1 Å²	138.1	89%	0.888	75%	0.75	S	S	*	*			trans	-77.7	145.6	158.2	-64.4	161.9	-42.4	0	0	108.8
257	S	26	Very low	26.1	Very low	102 Å²	102	138.6 Å²	138.6	71%	0.713	75%	0.753	S	S	*	*			cis	76.5	133.8	33	-162.5	0	0	0	0	113
258	L	24.4	Very low	25.9	Very low	143 Å²	143	137.3 Å²	137.3	75%	0.749	75%	0.75	S	S	*	*			cis	-165.9	176.3	-15	-116	177.5	0	0	0	108.8
259	R	23.7	Very low	25.9	Very low	218 Å²	218	140.1 Å²	140.1	82%	0.823	76%	0.756	S	S	*	*			trans	69	132.4	149.7	-82	-178	-178	-160	1.3	122.6
260	S	22.8	Very low	25.6	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	76%	0.756	S	S	*	*			trans	49.1	138.6	139.2	60.6	0	0	0	0	124.4
261	S	25.3	Very low	25.5	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	76%	0.76	S	S	*	*			trans	-59.2	174	155	-37.7	0	0	0	0	112.9
262	P	34.2	Very low	25.5	Very low	111 Å²	111	141.2 Å²	141.2	72%	0.721	75%	0.75	S	S	*	*			cis	-136.4	-163.1	4.3	41.9	-22.6	0	0	0	114.9
263	M	22.4	Very low	25.7	Very low	103 Å²	103	138.5 Å²	138.5	51%	0.507	75%	0.754	S	S	.	*			trans	72.2	126.3	155.5	-65.1	-90.3	81	0	0	122.1	R553	M263-R553 PolarHBondContact SD-NH1 3.14Å
264	L	23.7	Very low	25.9	Very low	119 Å²	119	133.9 Å²	133.9	62%	0.623	75%	0.75	S	S	*	*			trans	60.7	173.9	140.4	-67.2	168.3	0	0	0	120.5
265	N	23.9	Very low	26.1	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	75%	0.746	S	S	*	*			trans	-107.2	132.3	-165.6	-63.4	-60.4	0	0	0	112.8
266	S	25.3	Very low	26.1	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	74%	0.743	S	S	*	*			trans	64.2	165.9	142.8	-70.2	0	0	0	0	118.6
267	P	28.1	Very low	26.1	Very low	121 Å²	121	131.4 Å²	131.4	79%	0.786	74%	0.737	S	S	*	*			cis	-121.1	179.7	4	41.6	-28.4	0	0	0	115.7
268	V	23.4	Very low	26	Very low	111 Å²	111	134.3 Å²	134.3	67%	0.673	74%	0.739	S	S	*	*			trans	-62.5	138.6	169.5	172.1	0	0	0	0	111.6	Q270	V268-Q270 HydrophobicContact CG1-CB 4.49Å
269	F	26.7	Very low	26.1	Very low	205 Å²	205	136.3 Å²	136.3	90%	0.899	74%	0.737	S	S	*	*			trans	-134.6	163.6	132.9	-109.3	-77.3	0	0	0	111.9
270	Q	23.3	Very low	26.2	Very low	134 Å²	134	134.2 Å²	134.2	63%	0.626	73%	0.734	S	S	*	*			trans	-149.5	124.7	-161.8	174	-169.1	-37.1	0	0	108.5	V268	V268-Q270 HydrophobicContact CG1-CB 4.49Å
271	Y	26.7	Very low	26.3	Very low	232 Å²	232	134.2 Å²	134.2	91%	0.91	73%	0.734	S	S	*	*			trans	-109.2	147.5	164.6	-102.7	-94.3	0	0	0	111.6
272	P	28.1	Very low	26.5	Very low	87 Å²	87	134.4 Å²	134.4	57%	0.565	73%	0.733	S	S	*	*			trans	-132.4	153	-154.4	38.5	-20	0	0	0	117
273	A	26.8	Very low	26.9	Very low	96 Å²	96	134.9 Å²	134.9	79%	0.793	74%	0.736	S	S	*	*			trans	66.8	177	152.1	0	0	0	0	0	115.8
274	P	30.4	Very low	27	Very low	104 Å²	104	135.6 Å²	135.6	68%	0.675	75%	0.748	S	S	*	*			cis	-126.4	151	-7.6	39.3	-25.1	0	0	0	115.1
275	N	28.4	Very low	27	Very low	136 Å²	136	137.4 Å²	137.4	73%	0.727	75%	0.753	S	S	*	*				-178.1	132.8	101.1	-99.3	-37.5	0	0	0	115.9
276	N	27.7	Very low	27.5	Very low	144 Å²	144	135.6 Å²	135.6	77%	0.77	75%	0.749	S	S	*	*			trans	62.1	167.4	146.4	-63.8	-18.2	0	0	0	120.9
277	S	25.9	Very low	27.8	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	74%	0.744	S	S	*	*			trans	-173.5	168.7	-141.7	-70	0	0	0	0	113.4
278	Q	25.9	Very low	28	Very low	163 Å²	163	134.6 Å²	134.6	76%	0.762	74%	0.74	S	S	*	*			trans	87.8	133	158.8	-53.8	-161.2	16.7	0	0	120.9
279	R	25.6	Very low	28.4	Very low	184 Å²	184	139.9 Å²	139.9	69%	0.694	75%	0.748	S	S	*	*			trans	73.8	136.9	133.9	-85.3	179.8	169	-155.4	-3.4	122.7
280	F	26.6	Very low	28.6	Very low	174 Å²	174	139.5 Å²	139.5	76%	0.763	74%	0.741	S	S	*	*			trans	63.9	147.4	152.7	-69	-62.1	0	0	0	121
281	S	23.5	Very low	28.9	Very low	112 Å²	112	138.4 Å²	138.4	78%	0.783	74%	0.738	S	S	*	*			trans	-73	173.1	171.1	-33.6	0	0	0	0	111.5
282	P	29.4	Very low	29	Very low	116 Å²	116	132.4 Å²	132.4	75%	0.753	73%	0.73	S	S	*	*			cis	-131.5	178.3	5.2	39.9	-21.4	0	0	0	115.2
283	P	42.5	Very low	29.1	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	74%	0.744	S	S	*	*			trans	-86.2	160.3	176.1	36	-37.4	0	0	0	113.7
284	P	25.3	Very low	29	Very low	119 Å²	119	133.9 Å²	133.9	77%	0.773	75%	0.75	S	S	*	*				-154.8	156.4	104	39.7	-21.7	0	0	0	119.2
285	H	24.4	Very low	29	Very low	156 Å²	156	132.8 Å²	132.8	72%	0.722	76%	0.757	S	S	*	*				-8.7	176.5	127.5	-74	-57.8	0	0	0	121.3
286	P	32.5	Very low	28.8	Very low	108 Å²	108	134 Å²	134	70%	0.701	76%	0.759	S	S	*	*			cis	-135.8	-121.3	-20.8	35.1	-11.6	0	0	0	110.4
287	P	32.7	Very low	28.6	Very low	108 Å²	108	132.2 Å²	132.2	70%	0.701	75%	0.746	S	S	*	*				-114.1	-152.8	-55	40.5	-23.3	0	0	0	110.5
288	P	31.2	Very low	28.5	Very low	109 Å²	109	132 Å²	132	71%	0.708	74%	0.739	S	S	*	*			cis	-114.3	-165	-21.4	44.4	-30.7	0	0	0	110.9
289	R	32.4	Very low	28.3	Very low	221 Å²	221	134.4 Å²	134.4	83%	0.834	74%	0.742	S	S	*	*			cis	-147.3	169.9	14	-103.5	179	-74.8	-150	-1	106
290	R	31.1	Very low	28.1	Very low	198 Å²	198	132.2 Å²	132.2	75%	0.747	74%	0.739	S	S	*	*			cis	-168.3	152.4	-14.8	-177	-153.3	176.7	-154.4	1.3	105.2
291	L	29.7	Very low	28	Very low	111 Å²	111	129.5 Å²	129.5	58%	0.581	73%	0.733	S	S	*	*			trans	72.3	124.7	175.1	-50	-179.7	0	0	0	114
292	S	29.3	Very low	28.5	Very low	106 Å²	106	132.9 Å²	132.9	74%	0.741	73%	0.733	S	S	*	*			cis	85.6	130	43.5	75.3	0	0	0	0	113.6
293	G	30.3	Very low	28.6	Very low	82 Å²	82	132.7 Å²	132.7	85%	0.845	73%	0.732	S	S	*	*			cis	-166.5	-168.1	5.8	0	0	0	0	0	113.8
294	S	23.9	Very low	27.8	Very low	132 Å²	132	133.2 Å²	133.2	92%	0.923	73%	0.727	S	S	*	*			trans	-96.6	154.6	-170.3	53.2	0	0	0	0	114.9
295	G	30.2	Very low	28	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	72%	0.722	S	S	*	*			trans	-152.4	153.9	171.2	0	0	0	0	0	113.4
296	E	24.3	Very low	28.2	Very low	163 Å²	163	133 Å²	133	76%	0.762	72%	0.724	S	S	*	*			trans	-96.9	163	-179.2	-74.9	-168.7	76.5	0	0	113.9
297	Q	23.5	Very low	27.9	Very low	106 Å²	106	131.9 Å²	131.9	50%	0.495	72%	0.719	S	S	.	*	S	Bend	trans	65.3	-163.9	144.1	-85.5	178.9	69.9	0	0	117.6
298	T	23.4	Very low	27.8	Very low	103 Å²	103	133.8 Å²	133.8	63%	0.632	72%	0.718	S	S	*	*			trans	-72.8	148.8	-159.4	48.8	0	0	0	0	114.8
299	R	22.3	Very low	27.7	Very low	215 Å²	215	136.3 Å²	136.3	81%	0.811	72%	0.72	S	S	*	*			trans	73.1	156.2	146.3	-82.7	178.2	154.4	177	-2.6	117.4
300	H	22.7	Very low	27.3	Very low	137 Å²	137	133.1 Å²	133.1	63%	0.634	72%	0.719	S	S	*	*			trans	22.2	135.7	138.5	-53.7	-44.5	0	0	0	119.6
301	N	23.4	Very low	27.2	Very low	118 Å²	118	128.5 Å²	128.5	63%	0.631	72%	0.715	S	S	*	*			cis	-168.4	-173.8	2.1	-114.7	-6.9	0	0	0	110.3
302	K	33.9	Very low	27.1	Very low	183 Å²	183	129 Å²	129	80%	0.796	73%	0.727	S	S	*	*				-13.3	140.9	129.6	-38	179.1	179.4	-175.4	0	112.7
303	P	32.1	Very low	27	Very low	112 Å²	112	127.1 Å²	127.1	73%	0.727	73%	0.725	S	S	*	*				-150.2	-164.2	71.5	44.6	-26.4	0	0	0	112.4
304	L	25.3	Very low	26.6	Very low	130 Å²	130	132.4 Å²	132.4	68%	0.681	73%	0.725	S	S	*	*			cis	-148.1	144.2	-6.7	-126.4	141.8	0	0	0	103.1	Q306	L304-Q306 HydrophobicContact CD2-CG 4.05Å
305	T	30.2	Very low	26.8	Very low	109 Å²	109	132 Å²	132	67%	0.669	71%	0.713	S	S	*	*				-167.9	127.2	79.6	34.4	0	0	0	0	109.1
306	Q	28.3	Very low	26.6	Very low	162 Å²	162	135.5 Å²	135.5	76%	0.757	71%	0.711	S	S	*	*				83.9	141.6	100.1	-70.2	167.9	-15.2	0	0	113.9	L304	L304-Q306 HydrophobicContact CD2-CG 4.05Å
307	S	26.1	Very low	27.5	Very low	85 Å²	85	132.7 Å²	132.7	59%	0.594	71%	0.707	S	S	*	*			cis	-160.3	176.6	-4	37.5	0	0	0	0	111.7
308	H	29.5	Very low	27.5	Very low	148 Å²	148	133.7 Å²	133.7	69%	0.685	72%	0.721	S	S	*	*			trans	74	143.1	172.8	-48	-86.1	0	0	0	116.1
309	Q	29.5	Very low	27.9	Very low	162 Å²	162	136.5 Å²	136.5	76%	0.757	73%	0.73	S	S	*	*			cis	-154.3	168	-15.9	-124.3	159.9	-1.8	0	0	113.2
310	L	25.1	Very low	28.1	Very low	154 Å²	154	130 Å²	130	81%	0.806	72%	0.718	S	S	*	*			trans	-34	174	162.8	-66.8	165.7	0	0	0	118.1
311	P	28.3	Very low	28.5	Very low	101 Å²	101	128.2 Å²	128.2	66%	0.656	73%	0.727	S	S	*	*			cis	-140	-177.7	-25.8	33.6	-13.5	0	0	0	115.1
312	S	26.6	Very low	28.6	Very low	121 Å²	121	128.3 Å²	128.3	85%	0.846	73%	0.731	S	S	*	*			trans	62.7	149.6	151.7	51.5	0	0	0	0	119.9
313	G	27.6	Very low	28.4	Very low	67 Å²	67	124 Å²	124	69%	0.691	73%	0.729	S	S	*	*			cis	-177.7	-168.3	-2.4	0	0	0	0	0	113.5
314	F	22.4	Very low	28.2	Very low	193 Å²	193	130 Å²	130	85%	0.846	74%	0.738	S	S	*	*			trans	-33.4	153.4	163.8	-66	-98.3	0	0	0	114.4
315	D	28.6	Very low	28.3	Very low	124 Å²	124	126.5 Å²	126.5	66%	0.663	73%	0.727	S	S	*	*			cis	-160.9	164.7	35.1	-133.8	-17.1	0	0	0	117.6
316	L	25.8	Very low	28.3	Very low	153 Å²	153	126 Å²	126	80%	0.801	73%	0.734	S	S	*	*			trans	37.1	165.2	147.8	-101.5	70.2	0	0	0	122.8
317	P	41.8	Very low	28.3	Very low	103 Å²	103	122.4 Å²	122.4	67%	0.669	73%	0.727	S	S	*	*				-143.5	-146.2	-129.8	34.8	-5.9	0	0	0	113.5
318	T	25.3	Very low	28.3	Very low	127 Å²	127	126 Å²	126	78%	0.779	74%	0.736	S	S	*	*			trans	61.6	62.5	153.5	-44.2	0	0	0	0	116.4
319	I	30.4	Very low	28.3	Very low	163 Å²	163	125.3 Å²	125.3	84%	0.836	74%	0.737	S	S	*	*	S	Bend	trans	-115.8	127.5	130.5	-65.2	-176.2	0	0	0	108.2
320	S	27.8	Very low	28.2	Very low	78 Å²	78	119.2 Å²	119.2	55%	0.545	71%	0.712	S	S	.	*			trans	-3.9	119.4	170.9	-155.7	0	0	0	0	116.8	V322	S320-V322 WeakPolarHBondContact OG-CB 3.44Å; S320-V322 VanDerWaalsContact OG-CG2 3.26Å; S320-V322 WeakPolarHBondContact OG-CG2 3.3Å; S320-V322 PolarHBondContact OG-N 3.44Å
321	A	30.9	Very low	28.6	Very low	100 Å²	100	114.7 Å²	114.7	83%	0.826	69%	0.692	S	S	*	*			cis	64.8	3	36.3	0	0	0	0	0	116.2
322	V	25.7	Very low	28.6	Very low	120 Å²	120	112.6 Å²	112.6	73%	0.727	68%	0.68	S	S	*	*			trans	-124.9	110	165.5	169.2	0	0	0	0	108.6	S320	S320-V322 WeakPolarHBondContact OG-CB 3.44Å; S320-V322 VanDerWaalsContact OG-CG2 3.26Å; S320-V322 WeakPolarHBondContact OG-CG2 3.3Å; S320-V322 PolarHBondContact OG-N 3.44Å
323	A	30	Very low	28.8	Very low	91 Å²	91	112 Å²	112	75%	0.752	66%	0.663	S	S	*	*	S	Bend	trans	167.6	-26.7	170.4	0	0	0	0	0	110.5
324	R	27.4	Very low	29.2	Very low	239 Å²	239	115.4 Å²	115.4	90%	0.902	67%	0.665	S	S	*	*	S	Bend	trans	-126.3	24.6	180	-135.9	176	-68.8	167.3	0.6	113.7
325	A	27.2	Very low	29.6	Very low	56 Å²	56	108.8 Å²	108.8	46%	0.463	64%	0.637	S	S	.	*	S	Bend	trans	-117.7	-1	165.6	0	0	0	0	0	112.4	S327 M328	A325-S327 PolarHBondContact O-N 2.84Å; A325-M328 PolarHBondContact O-N 2.77Å
326	A	30	Very low	29.6	Very low	98 Å²	98	106 Å²	106	81%	0.81	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	37.8	170.4	0	0	0	0	0	112.3
327	S	28.3	Very low	29.7	Very low	87 Å²	87	102.1 Å²	102.1	61%	0.608	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.2	29.2	177.4	67.8	0	0	0	0	110.3	A325	A325-S327 PolarHBondContact O-N 2.84Å
328	M	27.1	Very low	29.1	Very low	160 Å²	160	100.6 Å²	100.6	79%	0.788	62%	0.617	S	S	*	*	S	Bend	trans	-146.1	25.1	-178	-74	-80.9	88	0	0	111.6	A325	A325-M328 PolarHBondContact O-N 2.77Å
329	L	27.9	Very low	29.3	Very low	135 Å²	135	99.6 Å²	99.6	71%	0.707	61%	0.611	S	S	*	*	S	Bend	trans	-136.2	152.9	166	-65.9	175.3	0	0	0	107.8	Q333	L329-Q333 HydrophobicContact CB-CB 4.49Å
330	S	28.8	Very low	29.1	Very low	34 Å²	34	98.4 Å²	98.4	24%	0.238	61%	0.606	C	S	.	*			trans	-82.1	162.4	-175.9	57.6	0	0	0	0	112.8	S332 Q333	S330-S332 WeakPolarHBondContact CB-OG 3.49Å; S330-S332 PolarHBondContact O-N 3.22Å; S330-S332 PolarHBondContact OG-OG 3.37Å; S330-Q333 PolarHBondContact O-N 2.97Å; S330-Q333 WeakPolarHBondContact OG-CG 3.49Å
331	P	32.8	Very low	29.1	Very low	58 Å²	58	102.9 Å²	102.9	38%	0.377	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-53.5	-42.3	169.8	-26.1	36	0	0	0	112.1	Q333 L334 E335 A1240	P331-Q333 PolarHBondContact O-N 3.24Å; P331-L334 PolarHBondContact O-N 3.46Å; P331-E335 PolarHBondContact O-N 2.85Å; P331-A1240 HydrophobicContact CB-CB 3.77Å
332	S	28.8	Very low	28.9	Very low	57 Å²	57	103.5 Å²	103.5	40%	0.399	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-63	1.9	174.1	53.3	0	0	0	0	115.9	S330	S330-S332 WeakPolarHBondContact CB-OG 3.49Å; S330-S332 PolarHBondContact O-N 3.22Å; S330-S332 PolarHBondContact OG-OG 3.37Å
333	Q	30.9	Very low	28.9	Very low	108 Å²	108	105.4 Å²	105.4	51%	0.505	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-119	5.7	173.9	-72.9	-180	-28.2	0	0	113.3	L329 S330 P331	L329-Q333 HydrophobicContact CB-CB 4.49Å; S330-Q333 PolarHBondContact O-N 2.97Å; S330-Q333 WeakPolarHBondContact OG-CG 3.49Å; P331-Q333 PolarHBondContact O-N 3.24Å
334	L	35.4	Very low	28.6	Very low	140 Å²	140	109.9 Å²	109.9	73%	0.733	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-35.8	172.7	-139.4	143.9	0	0	0	111.3	P331 A337 A338	P331-L334 PolarHBondContact O-N 3.46Å; L334-A337 PolarHBondContact O-N 2.99Å; L334-A338 PolarHBondContact O-N 3.46Å
335	E	30.1	Very low	28.6	Very low	53 Å²	53	105.6 Å²	105.6	25%	0.248	61%	0.614	C	S	.	*	G	3₁₀ helix	trans	-62.3	-46	165.5	-69.7	161.5	155.1	0	0	110.5	P331 A337 A338 A1240 E1244	P331-E335 PolarHBondContact O-N 2.85Å; E335-A337 PolarHBondContact O-N 3Å; E335-A338 PolarHBondContact O-N 3.44Å; E335-A1240 WeakPolarHBondContact OE2-CA 3.48Å; E335-A1240 VanDerWaalsContact OE2-CB 3.25Å; E335-A1240 WeakPolarHBondContact OE2-CB 3.36Å; E335-E1244 WeakPolarHBondContact CA-OE1 3.11Å; E335-E1244 HydrophobicContact CB-CG 4.49Å; E335-E1244 VanDerWaalsContact CB-OE1 3.27Å; E335-E1244 WeakPolarHBondContact CB-OE1 3.47Å
336	A	29.3	Very low	28.6	Very low	65 Å²	65	108.1 Å²	108.1	54%	0.537	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-63.4	-6.1	174.3	0	0	0	0	0	115.2
337	A	28.4	Very low	28.5	Very low	72 Å²	72	108.3 Å²	108.3	60%	0.595	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-107.6	-6.2	176.5	0	0	0	0	0	113.7	L334 E335	L334-A337 PolarHBondContact O-N 2.99Å; E335-A337 PolarHBondContact O-N 3Å
338	A	29.5	Very low	28.5	Very low	71 Å²	71	107.1 Å²	107.1	59%	0.587	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-25.8	174.9	0	0	0	0	0	112.9	L334 E335	L334-A338 PolarHBondContact O-N 3.46Å; E335-A338 PolarHBondContact O-N 3.44Å
339	V	29.2	Very low	28.6	Very low	106 Å²	106	104.4 Å²	104.4	64%	0.642	58%	0.583	S	S	*	*	S	Bend	trans	-87.7	-14.1	-175.1	179.6	0	0	0	0	113.3
340	L	25.3	Very low	28.6	Very low	139 Å²	139	104.1 Å²	104.1	73%	0.728	58%	0.581	S	S	*	*	S	Bend	trans	-128.8	71.4	-177.7	-72.4	174.7	0	0	0	113.2
341	L	28.5	Very low	28.3	Very low	171 Å²	171	105.2 Å²	105.2	90%	0.895	59%	0.593	S	S	*	*	S	Bend	trans	170.5	66.7	137.7	-92.6	165.2	0	0	0	112.7
342	S	26.9	Very low	28.1	Very low	113 Å²	113	110.6 Å²	110.6	79%	0.79	62%	0.618	S	S	*	*	S	Bend	trans	-145.2	16.8	158.9	67.8	0	0	0	0	116
343	Q	24.9	Very low	27.8	Very low	161 Å²	161	115.5 Å²	115.5	75%	0.752	64%	0.638	S	S	*	*	S	Bend	trans	-150.5	131.1	159.7	-75.7	-158.7	26.6	0	0	106.8
344	W	25	Very low	27.4	Very low	184 Å²	184	114.2 Å²	114.2	70%	0.697	65%	0.646	S	S	*	*			cis	-133.8	171.6	-0.5	-75.2	-22.2	0	0	0	111.1
345	D	26.1	Very low	27	Very low	149 Å²	149	114 Å²	114	80%	0.797	65%	0.646	S	S	*	*			trans	-146.7	131.7	138.3	-114.5	-3	0	0	0	108.4
346	N	27.8	Very low	26.8	Very low	110 Å²	110	118.3 Å²	118.3	59%	0.588	67%	0.671	S	S	*	*			cis	-167.5	-177.3	-18.4	-146.6	-32.6	0	0	0	111.9
347	V	27.3	Very low	26.7	Very low	102 Å²	102	119.7 Å²	119.7	62%	0.618	68%	0.676	S	S	*	*			trans	79.8	137.4	144.1	149.3	0	0	0	0	116.7
348	N	28.8	Very low	26.4	Very low	61 Å²	61	122 Å²	122	33%	0.326	69%	0.688	S	S	.	*			cis	-145.8	176.9	8	-128.3	16.7	0	0	0	108	Q2506 L2507	N348-Q2506 VanDerWaalsContact C-CD 3.49Å; N348-Q2506 WeakPolarHBondContact O-CB 3.26Å; N348-Q2506 WeakPolarHBondContact O-CG 3.39Å; N348-Q2506 PolarHBondContact O-NE2 2.8Å; N348-Q2506 PolarHBondContact O-OE1 2.86Å; N348-L2507 VanDerWaalsContact C-CD1 3.44Å; N348-L2507 VanDerWaalsContact O-CG 3.23Å; N348-L2507 WeakPolarHBondContact O-CG 3.48Å; N348-L2507 PolarHBondContact O-N 3.02Å
349	Q	28.5	Very low	26.3	Very low	104 Å²	104	127.5 Å²	127.5	49%	0.486	70%	0.695	S	S	.	*				-156.3	165.7	-53.2	-145.6	-176.8	108.2	0	0	108.7
350	L	27.8	Very low	26.1	Very low	128 Å²	128	132 Å²	132	67%	0.67	70%	0.7	S	S	*	*			trans	69.9	112	160.3	-56	161.1	0	0	0	117	L2507	L350-L2507 CarbonylContact C-O 2.92Å; L350-L2507 VanDerWaalsContact C-O 3.26Å; L350-L2507 VanDerWaalsContact O-O 3.06Å
351	A	23.9	Very low	26.1	Very low	58 Å²	58	132.7 Å²	132.7	48%	0.479	71%	0.705	S	S	.	*			cis	69.2	107.2	33	0	0	0	0	0	116.3
352	L	27.1	Very low	25.9	Very low	171 Å²	171	131.9 Å²	131.9	90%	0.895	70%	0.701	S	S	*	*			trans	-165.2	162.5	152.3	-115.2	173	0	0	0	112.4
353	L	22.2	Very low	25.9	Very low	159 Å²	159	132.5 Å²	132.5	83%	0.832	70%	0.695	S	S	*	*			trans	-88.7	158.4	-178.7	-56.3	123.4	0	0	0	112.4
354	A	23.7	Very low	26	Very low	81 Å²	81	130.7 Å²	130.7	67%	0.669	69%	0.69	S	S	*	*				169.2	164.3	124	0	0	0	0	0	113.7
355	N	27.7	Very low	26.1	Very low	136 Å²	136	128.9 Å²	128.9	73%	0.727	69%	0.693	S	S	*	*			trans	72.4	114.6	155.1	-64	-31.8	0	0	0	117.4
356	N	25.9	Very low	26.3	Very low	144 Å²	144	127.4 Å²	127.4	77%	0.77	69%	0.689	S	S	*	*				81.8	140.8	70.9	-78.6	-42.1	0	0	0	112.9
357	S	25.6	Very low	26.4	Very low	94 Å²	94	128.8 Å²	128.8	66%	0.657	70%	0.696	S	S	*	*			cis	-167.7	172.1	-11.2	52.7	0	0	0	0	110.5
358	S	22.2	Very low	26.4	Very low	121 Å²	121	128.6 Å²	128.6	85%	0.846	70%	0.7	S	S	*	*			trans	-130.1	106.1	157.7	-83.4	0	0	0	0	109.5
359	Y	28	Very low	26.3	Very low	186 Å²	186	131 Å²	131	73%	0.729	72%	0.721	S	S	*	*			trans	-155.9	119.8	176.4	-130.2	-98.4	0	0	0	111.2
360	R	25.8	Very low	26.1	Very low	200 Å²	200	129.2 Å²	129.2	76%	0.755	73%	0.731	S	S	*	*			trans	42.3	106.9	158.8	-58.6	178.6	-178.8	167.7	1	118
361	N	23.7	Very low	25.9	Very low	154 Å²	154	130.3 Å²	130.3	82%	0.824	74%	0.737	S	S	*	*				49.8	118.1	72.3	-73.4	-2.3	0	0	0	116.6
362	L	26.2	Very low	25.8	Very low	154 Å²	154	135.8 Å²	135.8	81%	0.806	75%	0.751	S	S	*	*				-164.7	145.8	119.6	-68.4	-165.1	0	0	0	105.9
363	N	25.5	Very low	25.6	Very low	125 Å²	125	135.7 Å²	135.7	67%	0.668	75%	0.745	S	S	*	*			cis	-159.5	167.7	-5.9	-105.1	-8.2	0	0	0	107
364	N	26.8	Very low	26	Very low	123 Å²	123	133 Å²	133	66%	0.658	74%	0.738	S	S	*	*			cis	-166.3	156.9	34.1	-140.5	2.6	0	0	0	113
365	I	27.1	Very low	26.1	Very low	146 Å²	146	134.2 Å²	134.2	75%	0.749	74%	0.737	S	S	*	*			trans	79.5	141.9	156.4	-54.4	155.8	0	0	0	118.7
366	V	31.7	Very low	25.9	Very low	118 Å²	118	134.6 Å²	134.6	72%	0.715	74%	0.739	S	S	*	*	S	Bend	trans	70.7	102.3	-178.3	-156.9	0	0	0	0	118.5
367	D	28.5	Very low	25.9	Very low	139 Å²	139	132.7 Å²	132.7	74%	0.743	74%	0.737	S	S	*	*			trans	43.5	115.5	147.7	-52.4	-27.3	0	0	0	122.1
368	S	27.6	Very low	25.8	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	74%	0.737	S	S	*	*			cis	90.7	142.1	37.8	-63.4	0	0	0	0	114.3
369	S	27.6	Very low	26.1	Very low	110 Å²	110	134.5 Å²	134.5	77%	0.769	73%	0.731	S	S	*	*			trans	44.2	115	151.5	52.6	0	0	0	0	118.9
370	G	24.4	Very low	26	Very low	67 Å²	67	131 Å²	131	69%	0.691	73%	0.725	S	S	*	*			cis	65.5	136.5	13	0	0	0	0	0	113.1
371	N	23.3	Very low	26	Very low	151 Å²	151	130 Å²	130	81%	0.807	73%	0.727	S	S	*	*			trans	49.4	119	168.7	-80.6	-39.1	0	0	0	116.2
372	K	22.5	Very low	26	Very low	174 Å²	174	127.4 Å²	127.4	76%	0.757	72%	0.721	S	S	*	*				177.5	176.9	52.3	-129.7	164.8	-169.7	176	0	111.2
373	Q	22.5	Very low	26.5	Very low	168 Å²	168	125.6 Å²	125.6	79%	0.785	72%	0.718	S	S	*	*			trans	75.8	154.6	154.5	-71.4	-78.8	-61.1	0	0	116
374	P	29.4	Very low	26.6	Very low	103 Å²	103	125.1 Å²	125.1	67%	0.669	72%	0.722	S	S	*	*			trans	-123.3	-111.1	-132	40.9	-27.1	0	0	0	113.5
375	V	25.9	Very low	26.3	Very low	107 Å²	107	125.2 Å²	125.2	65%	0.648	73%	0.727	S	S	*	*			trans	87.4	91.6	168.8	-164	0	0	0	0	116.8
376	N	24.6	Very low	26	Very low	144 Å²	144	122.6 Å²	122.6	77%	0.77	72%	0.721	S	S	*	*			trans	75.3	165.6	135.3	-60.9	-2	0	0	0	122.6
377	S	26.2	Very low	25.6	Very low	104 Å²	104	122.3 Å²	122.3	73%	0.727	72%	0.724	S	S	*	*			trans	71.2	91.8	157	23.8	0	0	0	0	118.1
378	S	22.3	Very low	25.9	Very low	95 Å²	95	123.7 Å²	123.7	66%	0.664	73%	0.726	S	S	*	*				-7.8	132.7	120	53.8	0	0	0	0	116.7
379	H	29.5	Very low	25.8	Very low	158 Å²	158	124.7 Å²	124.7	73%	0.731	73%	0.73	S	S	*	*				-165.5	131.5	113.5	-97.4	-57.6	0	0	0	112.8
380	N	24.4	Very low	26.1	Very low	113 Å²	113	125.9 Å²	125.9	60%	0.604	73%	0.728	S	S	*	*			trans	32.9	158.9	130.5	-49.7	8	0	0	0	123.2
381	F	26.6	Very low	26.4	Very low	178 Å²	178	127.9 Å²	127.9	78%	0.781	73%	0.729	S	S	*	*			trans	76.8	102.1	152.2	-63.3	-56.5	0	0	0	119.4
382	S	22.7	Very low	26.5	Very low	100 Å²	100	125.6 Å²	125.6	70%	0.699	72%	0.72	S	S	*	*				61	142.5	112.7	-55.7	0	0	0	0	121.8
383	P	38.7	Very low	26.6	Very low	115 Å²	115	122.3 Å²	122.3	75%	0.747	72%	0.715	S	S	*	*			trans	-71.3	165.8	159.2	40.7	-39.9	0	0	0	109.1
384	P	26.5	Very low	26.8	Very low	115 Å²	115	118 Å²	118	75%	0.747	70%	0.704	S	S	*	*				-157.9	177.3	73.4	46	-25.6	0	0	0	118
385	V	21.1	Very low	26.7	Very low	126 Å²	126	117.1 Å²	117.1	76%	0.764	71%	0.713	S	S	*	*			trans	35.7	113.2	132.9	176.7	0	0	0	0	119.5
386	S	21.1	Very low	26.8	Very low	90 Å²	90	115.3 Å²	115.3	63%	0.629	72%	0.716	S	S	*	*			trans	39.9	118.3	146.2	72.3	0	0	0	0	121.1
387	S	22.3	Very low	27	Very low	112 Å²	112	119.4 Å²	119.4	78%	0.783	72%	0.722	S	S	*	*			trans	175.3	113.6	131.9	38.4	0	0	0	0	105.2
388	E	34.2	Very low	27.1	Very low	169 Å²	169	120.9 Å²	120.9	79%	0.79	72%	0.72	S	S	*	*				30	118.3	71.2	-85.6	-156.2	139.3	0	0	112.4
389	P	25.8	Very low	27.3	Very low	119 Å²	119	123.6 Å²	123.6	77%	0.773	72%	0.723	S	S	*	*				-148	158.3	69.8	43.6	-27.8	0	0	0	116.4
390	N	34.3	Very low	27.1	Very low	136 Å²	136	120.3 Å²	120.3	73%	0.727	71%	0.71	S	S	*	*			trans	-50.4	146.5	145.4	-79.3	-60.1	0	0	0	109.3
391	P	31.4	Very low	27.2	Very low	108 Å²	108	121.5 Å²	121.5	70%	0.701	71%	0.712	S	S	*	*				-157.3	168	70.7	43.4	-23.3	0	0	0	118.4
392	V	24.4	Very low	27.3	Very low	104 Å²	104	118.1 Å²	118.1	63%	0.63	71%	0.705	S	S	*	*				30.3	121.4	127.2	-172	0	0	0	0	116.1
393	T	23.8	Very low	27.5	Very low	104 Å²	104	118.4 Å²	118.4	64%	0.638	70%	0.696	S	S	*	*				-143.8	147.2	76	8	0	0	0	0	118.4
394	S	27.5	Very low	27	Very low	79 Å²	79	117.9 Å²	117.9	55%	0.552	69%	0.69	S	S	*	*			trans	0.5	142.6	145.6	62.9	0	0	0	0	121.2
395	G	26.8	Very low	27.1	Very low	84 Å²	84	117.5 Å²	117.5	87%	0.866	68%	0.68	S	S	*	*			trans	174.4	64.7	163.3	0	0	0	0	0	115.2
396	G	27.5	Very low	27.5	Very low	68 Å²	68	115.1 Å²	115.1	70%	0.701	66%	0.663	S	S	*	*			trans	-95	170.3	-179	0	0	0	0	0	115.1
397	Y	29.2	Very low	28	Very low	230 Å²	230	118.2 Å²	118.2	90%	0.902	66%	0.66	S	S	*	*			trans	-160.7	134.5	162.3	-107.9	-52.6	0	0	0	113.6
398	I	29	Very low	29.1	Very low	136 Å²	136	118.7 Å²	118.7	70%	0.697	66%	0.664	S	S	*	*			trans	66.6	84.5	154.8	-44	-173.8	0	0	0	120
399	E	25.7	Very low	29	Very low	152 Å²	152	113.9 Å²	113.9	71%	0.71	66%	0.66	S	S	*	*				56.9	128.8	106.1	-78.6	-166	114.8	0	0	125.3
400	N	26.7	Very low	29.2	Very low	89 Å²	89	114.9 Å²	114.9	48%	0.476	66%	0.664	S	S	.	*				102.8	105.7	122.1	-67.4	-6.5	0	0	0	125.1	R428	N400-R428 PolarHBondContact O-NH1 3.31Å; N400-R428 PolarHBondContact O-NH2 2.74Å
401	H	26.6	Very low	28.8	Very low	138 Å²	138	110.4 Å²	110.4	64%	0.639	65%	0.65	S	S	*	*				86.3	93.8	124.3	-87.5	-90.7	0	0	0	124.2	R428	H401-R428 PolarHBondContact O-NH1 3.12Å
402	V	28.5	Very low	28.5	Very low	106 Å²	106	109.4 Å²	109.4	64%	0.642	64%	0.642	S	S	*	*				53.2	121.2	120.6	-178.2	0	0	0	0	121.3
403	H	25.4	Very low	28.4	Very low	106 Å²	106	110.7 Å²	110.7	49%	0.491	65%	0.645	S	S	.	*				-166.6	156.5	117.8	-140.2	-90.9	0	0	0	113.9
404	V	28.4	Very low	28.3	Very low	105 Å²	105	111 Å²	111	64%	0.636	65%	0.65	S	S	*	*			trans	-172.5	146.3	175.8	57.7	0	0	0	0	111.6
405	M	28.4	Very low	28.1	Very low	106 Å²	106	116.9 Å²	116.9	52%	0.522	67%	0.666	S	S	.	*			trans	175.4	143.4	151.3	-103.3	-163.4	171.1	0	0	116.8	L441	M405-L441 HydrophobicContact CE-CB 4.12Å
406	N	30.3	Very low	27.9	Very low	76 Å²	76	118.3 Å²	118.3	41%	0.406	66%	0.662	S	S	.	*			trans	75.8	153	135.1	-64.6	12.6	0	0	0	122.8	D440 L441	N406-D440 WeakPolarHBondContact ND2-CB 3.3Å; N406-D440 PolarHBondContact ND2-OD2 3.29Å; N406-L441 WeakPolarHBondContact OD1-CD1 3.34Å
407	R	32.2	Very low	27.7	Very low	155 Å²	155	125.3 Å²	125.3	59%	0.585	67%	0.668	S	S	*	*			cis	-154.2	177.3	-20.6	-145.2	173.5	171.9	179.7	-2.9	108.9	D440 L441	R407-D440 IonicContact CZ-OD1 3.09Å; R407-D440 IonicContact NE-OD1 3.17Å; R407-D440 IonicContact NH1-OD1 3.63Å; R407-D440 PolarHBondContact NH1-OD1 3.18Å; R407-L441 HydrophobicContact CG-CD1 3.82Å; R407-L441 VanDerWaalsContact CZ-CG 3.49Å
408	S	45.6	Very low	27.5	Very low	123 Å²	123	123 Å²	123	86%	0.86	66%	0.657	S	S	*	*			trans	-119.8	162.3	-166.1	54.7	0	0	0	0	117.2
409	G	31.4	Very low	27.5	Very low	68 Å²	68	122 Å²	122	70%	0.701	66%	0.657	S	S	*	*			trans	135	149.6	167.9	0	0	0	0	0	113.4
410	T	29.4	Very low	27.5	Very low	139 Å²	139	120.4 Å²	120.4	85%	0.853	65%	0.654	S	S	*	*			cis	-165.8	143.4	-10.8	39	0	0	0	0	109.3
411	G	27.2	Very low	27.5	Very low	42 Å²	42	122.1 Å²	122.1	43%	0.433	66%	0.663	S	S	.	*			trans	105	133.7	150.1	0	0	0	0	0	120.4
412	T	24.3	Very low	27.7	Very low	87 Å²	87	122.7 Å²	122.7	53%	0.534	67%	0.67	S	S	.	*			trans	76.4	99.8	153.2	40.6	0	0	0	0	121.5	N2571 D2572	T412-N2571 HydrophobicContact CG2-CB 4.1Å; T412-N2571 WeakPolarHBondContact CG2-ND2 3.32Å; T412-D2572 WeakPolarHBondContact CA-OD2 3.28Å; T412-D2572 PolarHBondContact N-OD2 2.77Å
413	D	22.3	Very low	27.5	Very low	132 Å²	132	122.9 Å²	122.9	71%	0.706	68%	0.676	S	S	*	*				86.9	159.7	121.9	-138.2	-28.6	0	0	0	119.9	D2572	D413-D2572 PolarHBondContact N-OD2 2.92Å
414	C	22.9	Very low	27.5	Very low	109 Å²	109	125.5 Å²	125.5	74%	0.736	69%	0.69	S	S	*	*			trans	70	108.5	169.9	-75.1	0	0	0	0	120.2	S416	C414-S416 PolarHBondContact O-N 3.09Å
415	K	22.1	Very low	27.4	Very low	204 Å²	204	126.7 Å²	126.7	89%	0.887	70%	0.698	S	S	*	*			trans	-21.3	116.6	150.8	-57.5	162.8	-177.1	167.3	0	115.1
416	S	23.1	Very low	27.2	Very low	113 Å²	113	128 Å²	128	79%	0.79	71%	0.707	S	S	*	*				-178.4	127.9	115.1	-84	0	0	0	0	115.6	C414	C414-S416 PolarHBondContact O-N 3.09Å
417	R	23.8	Very low	27	Very low	216 Å²	216	130.3 Å²	130.3	82%	0.815	72%	0.724	S	S	*	*			trans	29.9	131	141.4	-80.7	-176	168.9	-173.6	-3	121.5
418	R	25.1	Very low	26.7	Very low	181 Å²	181	130.6 Å²	130.6	68%	0.683	73%	0.725	S	S	*	*			trans	86.5	115.1	150.6	-69.3	176.1	172.7	170.7	-5.4	115.5	L2490	R418-L2490 HydrophobicContact CB-CD1 4.46Å
419	V	27.4	Very low	25.9	Very low	114 Å²	114	129.7 Å²	129.7	69%	0.691	72%	0.715	S	S	*	*				86.2	86.3	56.7	172.6	0	0	0	0	111.2
420	N	27.2	Very low	25.7	Very low	120 Å²	120	132 Å²	132	64%	0.642	71%	0.709	S	S	*	*				68.2	127.8	117.2	-74.7	56.1	0	0	0	122.3
421	D	26.7	Very low	25.9	Very low	124 Å²	124	130 Å²	130	66%	0.663	70%	0.699	S	S	*	*				78.7	146.5	125.3	-58.7	-5.8	0	0	0	121.2
422	L	29.6	Very low	25.9	Very low	150 Å²	150	133.5 Å²	133.5	79%	0.785	72%	0.717	S	S	*	*			cis	-168.3	135.7	-18.3	-111.3	168.9	0	0	0	108.7
423	S	24.2	Very low	26	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	73%	0.729	S	S	*	*			trans	174.8	137.7	146	44.7	0	0	0	0	116.2
424	M	26.2	Very low	26.1	Very low	162 Å²	162	134.2 Å²	134.2	80%	0.798	73%	0.73	S	S	*	*			trans	28.3	129.3	142.4	-48.8	-88.9	74	0	0	120.2
425	T	25.3	Very low	26.1	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	74%	0.735	S	S	*	*				-174.3	140.4	72.8	31.8	0	0	0	0	115.1
426	N	25.2	Very low	26.2	Very low	135 Å²	135	128.9 Å²	128.9	72%	0.722	73%	0.725	S	S	*	*			trans	28.9	120.7	147.6	-65.5	-4.9	0	0	0	126.3
427	T	25.7	Very low	26.3	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	73%	0.728	S	S	*	*			trans	71	163	130.6	64.8	0	0	0	0	120.4
428	R	25.9	Very low	26.3	Very low	161 Å²	161	127.9 Å²	127.9	61%	0.608	73%	0.728	S	S	*	*			cis	-159	178.9	-8.7	-125.6	-174.5	-158.7	-93.9	13.1	110.6	N400 H401	N400-R428 PolarHBondContact O-NH1 3.31Å; N400-R428 PolarHBondContact O-NH2 2.74Å; H401-R428 PolarHBondContact O-NH1 3.12Å
429	T	28.3	Very low	26.2	Very low	105 Å²	105	124.3 Å²	124.3	64%	0.644	73%	0.731	S	S	*	*			trans	66.7	108.1	159	-40.7	0	0	0	0	119.3
430	I	28.2	Very low	26.2	Very low	115 Å²	115	121.8 Å²	121.8	59%	0.59	71%	0.714	S	S	*	*			trans	-141.3	131.1	158.2	-58.5	-175.5	0	0	0	109.5
431	P	34.4	Very low	26.3	Very low	97 Å²	97	117.5 Å²	117.5	63%	0.63	69%	0.69	S	S	*	*			trans	-129.8	137.7	176.3	37.4	-22.4	0	0	0	116.1
432	S	26.7	Very low	26.2	Very low	117 Å²	117	119.9 Å²	119.9	82%	0.818	69%	0.69	S	S	*	*			trans	66.9	168.8	153.4	80.7	0	0	0	0	118.7
433	V	26.1	Very low	26	Very low	128 Å²	128	123 Å²	123	78%	0.776	69%	0.693	S	S	*	*			cis	-168.4	170.7	-42.7	68.1	0	0	0	0	109.6
434	S	23.8	Very low	26.5	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	68%	0.679	S	S	*	*			trans	89.1	-134.1	160.7	79.7	0	0	0	0	119.5
435	T	23.4	Very low	26.3	Very low	137 Å²	137	117 Å²	117	84%	0.84	67%	0.666	S	S	*	*	S	Bend	trans	-91.9	133.2	-154.5	53.4	0	0	0	0	115
436	G	24	Very low	26.2	Very low	65 Å²	65	115.1 Å²	115.1	67%	0.67	65%	0.649	S	S	*	*	S	Bend	trans	109.4	112.8	156.8	0	0	0	0	0	116.2
437	T	24.2	Very low	26	Very low	140 Å²	140	116.1 Å²	116.1	86%	0.859	65%	0.647	S	S	*	*	S	Bend	trans	58.1	128.3	159.2	54.5	0	0	0	0	120
438	M	25.5	Very low	26	Very low	168 Å²	168	117.9 Å²	117.9	83%	0.828	65%	0.652	S	S	*	*			trans	68.4	143.4	171.7	-56	-102.1	58.9	0	0	116.9
439	S	22.6	Very low	25.9	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	65%	0.65	S	S	*	*			trans	-179.1	163.7	158.8	-86.1	0	0	0	0	112.8
440	D	27	Very low	25.6	Very low	60 Å²	60	116.4 Å²	116.4	32%	0.321	66%	0.657	S	S	.	*			trans	-126.3	152.2	-156.6	-94.4	-30.1	0	0	0	117.2	N406 R407 S2561	N406-D440 WeakPolarHBondContact ND2-CB 3.3Å; N406-D440 PolarHBondContact ND2-OD2 3.29Å; R407-D440 IonicContact CZ-OD1 3.09Å; R407-D440 IonicContact NE-OD1 3.17Å; R407-D440 IonicContact NH1-OD1 3.63Å; R407-D440 PolarHBondContact NH1-OD1 3.18Å; D440-S2561 VanDerWaalsContact C-CB 3.43Å; D440-S2561 VanDerWaalsContact O-CB 3.22Å; D440-S2561 WeakPolarHBondContact O-CB 3.46Å; D440-S2561 PolarHBondContact O-OG 2.8Å
441	L	29.2	Very low	25.4	Very low	30 Å²	30	115.2 Å²	115.2	16%	0.157	66%	0.659	C	S	.	*			trans	69.8	122.6	144.6	-90.4	169.6	0	0	0	124.1	M405 N406 R407 S2561	M405-L441 HydrophobicContact CE-CB 4.12Å; N406-L441 WeakPolarHBondContact OD1-CD1 3.34Å; R407-L441 HydrophobicContact CG-CD1 3.82Å; R407-L441 VanDerWaalsContact CZ-CG 3.49Å; L441-S2561 VanDerWaalsContact C-N 3.31Å; L441-S2561 CarbonylContact C-O 3.6Å; L441-S2561 VanDerWaalsContact CA-O 3.28Å; L441-S2561 WeakPolarHBondContact CA-O 3.23Å; L441-S2561 PolarHBondContact N-O 3.41Å; L441-S2561 PolarHBondContact O-N 2.76Å
442	R	24.6	Very low	24.9	Very low	175 Å²	175	118.1 Å²	118.1	66%	0.66	67%	0.669	S	S	*	*				-169.4	166.1	85.5	-86.9	-168.9	-173.8	-162.7	1.9	113.1	S2561	R442-S2561 PolarHBondContact N-O 3.17Å
443	Y	24.6	Very low	24.9	Very low	215 Å²	215	117.3 Å²	117.3	84%	0.843	66%	0.661	S	S	*	*			trans	-53.8	174.8	170.1	-80.4	-70.9	0	0	0	114.9
444	P	35	Very low	25	Very low	74 Å²	74	117.2 Å²	117.2	48%	0.481	65%	0.646	S	S	.	*			cis	-133.1	-176.1	-24.5	24.5	-2.2	0	0	0	115.1	F1813	P444-F1813 HydrophobicContact CB-CZ 4.15Å; P444-F1813 HydrophobicContact CG-CE1 3.85Å; P444-F1813 HydrophobicContact CG-CE2 4.25Å; P444-F1813 HydrophobicContact CG-CZ 3.41Å; P444-F1813 VanDerWaalsContact CG-CZ 3.41Å; P444-F1813 WeakPolarHBondContact O-CZ 3.43Å
445	S	22.9	Very low	25	Very low	73 Å²	73	114.8 Å²	114.8	51%	0.51	63%	0.629	S	S	.	*			trans	84.3	160.5	154.1	-157.9	0	0	0	0	120.6	F1813	S445-F1813 VanDerWaalsContact CB-CZ 3.45Å
446	M	22.5	Very low	25.1	Very low	88 Å²	88	113.3 Å²	113.3	43%	0.433	61%	0.614	S	S	.	*			trans	72	117.1	171.1	-62	-92.6	169.6	0	0	118.1
447	K	22.1	Very low	25.2	Very low	156 Å²	156	114.8 Å²	114.8	68%	0.678	61%	0.607	S	S	*	*				43	132.8	126	-54.9	170.1	-175.1	161.3	0	118.3
448	N	25.6	Very low	25.4	Very low	161 Å²	161	113.5 Å²	113.5	86%	0.861	59%	0.591	S	S	*	*				-138.1	112.6	103.7	-100	-23.2	0	0	0	111.6
449	S	22.3	Very low	25.3	Very low	81 Å²	81	110.9 Å²	110.9	57%	0.566	58%	0.58	S	S	*	*			trans	-65.3	159.8	149.2	49.2	0	0	0	0	109.8
450	L	23	Very low	25.4	Very low	154 Å²	154	111.3 Å²	111.3	81%	0.806	58%	0.578	S	S	*	*			trans	73.7	136.5	172.4	-58.2	148.6	0	0	0	113.7
451	S	23.1	Very low	25.6	Very low	90 Å²	90	115.1 Å²	115.1	63%	0.629	60%	0.598	S	S	*	*			cis	-166	150.4	-1.5	41.3	0	0	0	0	114.3
452	L	24.3	Very low	25.3	Very low	158 Å²	158	123.9 Å²	123.9	83%	0.827	63%	0.629	S	S	*	*			trans	70.8	155.3	148.1	-93.1	83.2	0	0	0	118.1
453	P	28.3	Very low	25.5	Very low	100 Å²	100	123 Å²	123	65%	0.649	64%	0.637	S	S	*	*				-147.8	-142.6	-126.7	40.2	-14.8	0	0	0	113
454	R	26.2	Very low	25.6	Very low	125 Å²	125	119.8 Å²	119.8	47%	0.472	63%	0.634	S	S	.	*			trans	83.8	150.3	166.1	-49.5	-161.6	167.4	166.8	-6.4	115.4	S2435 S2437	R454-S2435 VanDerWaalsContact NH1-C 3.34Å; R454-S2435 PolarHBondContact NH1-O 3.48Å; R454-S2435 PolarHBondContact NH2-O 3.36Å; R454-S2437 WeakPolarHBondContact CD-OG 3.18Å; R454-S2437 VanDerWaalsContact CG-O 3.28Å; R454-S2437 WeakPolarHBondContact CG-O 3.28Å
455	S	24.7	Very low	25.3	Very low	55 Å²	55	118 Å²	118	39%	0.385	62%	0.623	S	S	.	*			trans	178.5	155.8	-157.1	46.8	0	0	0	0	109	S2438 L2439	S455-S2438 CarbonylContact O-C 3.58Å; S455-S2438 WeakPolarHBondContact O-CA 3.48Å; S455-S2438 PolarHBondContact O-N 3.29Å; S455-L2439 VanDerWaalsContact CB-O 3.29Å; S455-L2439 WeakPolarHBondContact CB-O 3.37Å; S455-L2439 PolarHBondContact O-N 2.89Å; S455-L2439 WeakPolarHBondContact OG-CA 3.37Å; S455-L2439 PolarHBondContact OG-O 2.85Å
456	M	25.1	Very low	25.6	Very low	105 Å²	105	123.4 Å²	123.4	52%	0.517	63%	0.633	S	S	.	*			trans	155.9	138.5	151.6	-177.6	144.8	74.9	0	0	109.1	S2438	M456-S2438 WeakPolarHBondContact CE-O 2.97Å
457	D	27.2	Very low	25.6	Very low	97 Å²	97	125.4 Å²	125.4	52%	0.519	66%	0.655	S	S	.	*				-174.7	94.7	120.8	-100.8	-27.2	0	0	0	114	Y2441	D457-Y2441 WeakPolarHBondContact O-CD2 3.17Å; D457-Y2441 WeakPolarHBondContact O-CE2 2.85Å
458	Q	27	Very low	25.9	Very low	113 Å²	113	123.5 Å²	123.5	53%	0.528	66%	0.661	S	S	.	*				62.1	122.3	128.4	-66.3	-175.2	74.9	0	0	122.8	Y2441	Q458-Y2441 VanDerWaalsContact O-CE2 3.28Å; Q458-Y2441 WeakPolarHBondContact O-CE2 3.07Å; Q458-Y2441 PolarHBondContact O-OH 2.86Å
459	L	24.2	Very low	26.1	Very low	113 Å²	113	120.5 Å²	120.5	59%	0.592	65%	0.649	S	S	*	*			trans	113.8	98.4	137.4	-69.6	152.1	0	0	0	122.3	Y2441	L459-Y2441 PolarHBondContact O-OH 3.36Å; L459-Y2441 VanDerWaalsContact O-OH 3.04Å
460	T	25.4	Very low	26.4	Very low	114 Å²	114	122.4 Å²	122.4	70%	0.699	66%	0.659	S	S	*	*			trans	40.5	123.6	131.1	58.1	0	0	0	0	122.5
461	N	29.7	Very low	26.9	Very low	140 Å²	140	117.6 Å²	117.6	75%	0.749	65%	0.647	S	S	*	*				-159.3	-180	127.2	-122.9	-61.6	0	0	0	115.3
462	R	24.5	Very low	27	Very low	214 Å²	214	119.8 Å²	119.8	81%	0.808	65%	0.652	S	S	*	*	S	Bend	trans	-78.9	161.4	-172.6	-52.2	166.5	-176	171.1	0.8	113.8
463	L	28.3	Very low	27.1	Very low	157 Å²	157	118.3 Å²	118.3	82%	0.822	64%	0.641	S	S	*	*	S	Bend	trans	70.4	129.7	172.9	-59.5	162	0	0	0	113.3
464	N	26.9	Very low	27.3	Very low	147 Å²	147	117.3 Å²	117.3	79%	0.786	63%	0.634	S	S	*	*	S	Bend	trans	51.5	-152.2	-162.4	-64.6	-26.9	0	0	0	111.5
465	S	29.2	Very low	27.3	Very low	36 Å²	36	116.9 Å²	116.9	25%	0.252	64%	0.639	S	S	.	*			trans	57	77.2	147.2	-54.9	0	0	0	0	119.7	D2444	S465-D2444 WeakPolarHBondContact CB-OD2 3.4Å; S465-D2444 VanDerWaalsContact OG-CG 3.26Å; S465-D2444 PolarHBondContact OG-OD1 3.24Å; S465-D2444 PolarHBondContact OG-OD2 3.12Å
466	R	27.4	Very low	27.4	Very low	188 Å²	188	120 Å²	120	71%	0.709	65%	0.651	S	S	*	*			trans	58.4	131.4	134.7	-68.4	-177.9	169.4	-171.9	-3.5	121.2	S2442	R466-S2442 PolarHBondContact NH1-OG 3.07Å
467	S	23.3	Very low	27.4	Very low	129 Å²	129	123.5 Å²	123.5	90%	0.902	66%	0.664	S	S	*	*			trans	76.5	159.8	146.7	70.2	0	0	0	0	118.5
468	S	29.1	Very low	27.3	Very low	116 Å²	116	127.6 Å²	127.6	81%	0.811	67%	0.673	S	S	*	*			trans	-106	155.7	-151	47.8	0	0	0	0	115.2
469	T	30.1	Very low	27.1	Very low	98 Å²	98	128.1 Å²	128.1	60%	0.601	68%	0.679	S	S	*	*			trans	-62.2	144.8	-179.7	46.3	0	0	0	0	114.6
470	P	27.4	Very low	27.1	Very low	121 Å²	121	130.3 Å²	130.3	79%	0.786	69%	0.687	S	S	*	*			trans	-75.1	142.6	153.8	33.7	-31.8	0	0	0	110.1
471	G	32.8	Very low	27	Very low	53 Å²	53	132.6 Å²	132.6	55%	0.546	69%	0.691	S	S	.	*			trans	-89.1	-178.4	174.7	0	0	0	0	0	113.2
472	N	26.9	Very low	26.7	Very low	137 Å²	137	130.9 Å²	130.9	73%	0.733	69%	0.689	S	S	*	*			trans	-134.6	168.3	166.9	-142.2	-1.1	0	0	0	110.3
473	E	25.9	Very low	26.8	Very low	127 Å²	127	126.6 Å²	126.6	59%	0.593	69%	0.69	S	S	*	*			trans	-81.3	160.9	-152.2	-101.4	-144	96.5	0	0	119.6	K2420	E473-K2420 VanDerWaalsContact CD-CE 3.46Å; E473-K2420 IonicContact OE1-NZ 3.74Å; E473-K2420 PolarHBondContact OE1-NZ 2.63Å; E473-K2420 WeakPolarHBondContact OE2-CE 3.13Å; E473-K2420 IonicContact OE2-NZ 3.14Å; E473-K2420 PolarHBondContact OE2-NZ 2.79Å; E473-K2420 VanDerWaalsContact OE2-NZ 3.12Å
474	P	32.3	Very low	27.1	Very low	78 Å²	78	124.9 Å²	124.9	51%	0.506	69%	0.688	S	S	.	*			trans	-108.7	172.3	-173.6	40	-34.4	0	0	0	116.8	K2420	P474-K2420 PolarHBondContact O-NZ 2.9Å
475	M	25.3	Very low	27.4	Very low	117 Å²	117	121.8 Å²	121.8	58%	0.576	68%	0.677	S	S	*	*				160.2	133.8	118.7	-85.6	-103.9	83.8	0	0	117.4
476	N	27.1	Very low	27.3	Very low	120 Å²	120	131.6 Å²	131.6	64%	0.642	71%	0.708	S	S	*	*			trans	61.8	132.5	148.2	-66.4	-26	0	0	0	121.3
477	K	24.8	Very low	27.4	Very low	178 Å²	178	126.4 Å²	126.4	77%	0.774	70%	0.701	S	S	*	*				-162.1	143.2	58.2	-90	-169.8	165.2	-170.4	0	116.2
478	Y	24.9	Very low	27.7	Very low	183 Å²	183	126.3 Å²	126.3	72%	0.718	70%	0.695	S	S	*	*			trans	47.5	118	143.7	-63	-68.6	0	0	0	125.3
479	D	23.7	Very low	27.9	Very low	124 Å²	124	126.8 Å²	126.8	66%	0.663	69%	0.693	S	S	*	*				90.3	133	119.4	-64.9	-7.9	0	0	0	127.9
480	H	25	Very low	27.9	Very low	160 Å²	160	126.5 Å²	126.5	74%	0.741	69%	0.688	S	S	*	*			trans	73.1	87.4	148	-65	-48	0	0	0	125.3
481	M	22.7	Very low	28	Very low	162 Å²	162	124 Å²	124	80%	0.798	67%	0.666	S	S	*	*				74.3	140.2	119	-59.1	-145.5	75.2	0	0	125.4
482	C	22.4	Very low	27.8	Very low	104 Å²	104	128 Å²	128	70%	0.703	66%	0.664	S	S	*	*			trans	81.7	85.7	150.8	-70.6	0	0	0	0	122.3
483	C	26.8	Very low	27.9	Very low	123 Å²	123	124.5 Å²	124.5	83%	0.831	66%	0.655	S	S	*	*				38	158.3	110.2	-66.9	0	0	0	0	122.6
484	P	35	Very low	28	Very low	121 Å²	121	127.8 Å²	127.8	79%	0.786	66%	0.663	S	S	*	*			cis	-123.4	-100.8	12.2	21.9	5.3	0	0	0	117.3
485	P	34.2	Very low	27.6	Very low	83 Å²	83	127.7 Å²	127.7	54%	0.539	66%	0.664	S	S	.	*			trans	-143.4	176.1	-131.3	47.2	-27.5	0	0	0	119.8
486	W	26	Very low	27.6	Very low	241 Å²	241	128.8 Å²	128.8	91%	0.913	68%	0.678	S	S	*	*			trans	68.1	167.9	144.3	-68.2	-23.2	0	0	0	120.9
487	S	30	Very low	27.4	Very low	79 Å²	79	127.6 Å²	127.6	55%	0.552	67%	0.671	S	S	*	*			cis	-176.3	169.3	-38.2	67	0	0	0	0	111.5
488	T	29.4	Very low	27.5	Very low	127 Å²	127	124.1 Å²	124.1	78%	0.779	67%	0.669	S	S	*	*			trans	66.3	163	160.1	62	0	0	0	0	118.4
489	T	33.7	Very low	27.5	Very low	126 Å²	126	118.7 Å²	118.7	77%	0.773	66%	0.658	S	S	*	*			cis	-167	152.6	-30.6	-86.1	0	0	0	0	108.1
490	D	29.1	Very low	27.6	Very low	93 Å²	93	120.6 Å²	120.6	50%	0.497	66%	0.663	S	S	.	*			trans	-142.3	-120.9	163.8	-174.2	33.3	0	0	0	113.1	R2339	D490-R2339 IonicContact OD1-NE 2.9Å; D490-R2339 IonicContact OD2-CZ 3.6Å; D490-R2339 IonicContact OD2-NE 2.8Å; D490-R2339 PolarHBondContact OD2-NE 2.96Å; D490-R2339 IonicContact OD2-NH2 3.14Å; D490-R2339 PolarHBondContact OD2-NH2 2.77Å
491	Q	31	Very low	27.6	Very low	69 Å²	69	117.5 Å²	117.5	32%	0.322	66%	0.659	S	S	.	*			trans	-152.6	163.1	-153.5	-85.7	173	88.1	0	0	112.5	G2338 R2339	Q491-G2338 VanDerWaalsContact NE2-C 3.34Å; Q491-G2338 PolarHBondContact OE1-O 2.97Å; Q491-R2339 PolarHBondContact O-NH2 3.34Å
492	R	28.2	Very low	27.7	Very low	136 Å²	136	119.6 Å²	119.6	51%	0.513	66%	0.66	S	S	.	*			cis	-148	174.9	20	-134.9	156.4	-167.4	-114.5	10.6	108.3	Y494 G2338	R492-Y494 PolarHBondContact NH1-OH 2.78Å; R492-G2338 PolarHBondContact NH2-O 2.71Å
493	A	29.3	Very low	27.8	Very low	64 Å²	64	122.5 Å²	122.5	53%	0.529	66%	0.66	S	S	.	*			cis	-157	165.6	17.5	0	0	0	0	0	115.5	S495	A493-S495 PolarHBondContact O-N 3.15Å
494	Y	26.4	Very low	27.6	Very low	196 Å²	196	123.9 Å²	123.9	77%	0.769	66%	0.658	S	S	*	*			trans	51.1	-107	159.2	-57.6	-69.3	0	0	0	117.3	R492	R492-Y494 PolarHBondContact NH1-OH 2.78Å
495	S	25.3	Very low	27.2	Very low	75 Å²	75	126 Å²	126	52%	0.524	66%	0.658	S	S	.	*			trans	-158.2	175.2	-135.5	-71.4	0	0	0	0	109.4	A493 D497	A493-S495 PolarHBondContact O-N 3.15Å; S495-D497 WeakPolarHBondContact CA-OD2 3.23Å; S495-D497 WeakPolarHBondContact CB-OD2 3.34Å; S495-D497 PolarHBondContact OG-OD2 3.44Å
496	T	24.9	Very low	26.9	Very low	141 Å²	141	126.2 Å²	126.2	87%	0.865	66%	0.66	S	S	*	*	S	Bend	cis	-152.6	149.4	23.2	-42.7	0	0	0	0	111.2
497	D	23.5	Very low	27	Very low	94 Å²	94	119.8 Å²	119.8	50%	0.503	65%	0.651	S	S	.	*	S	Bend	cis	-174.2	166.6	-48.9	-114.2	-46.7	0	0	0	106.7	S495	S495-D497 WeakPolarHBondContact CA-OD2 3.23Å; S495-D497 WeakPolarHBondContact CB-OD2 3.34Å; S495-D497 PolarHBondContact OG-OD2 3.44Å
498	S	26.8	Very low	27.3	Very low	105 Å²	105	120.9 Å²	120.9	73%	0.734	66%	0.657	S	S	*	*			cis	-156.5	153.4	0.5	38.4	0	0	0	0	110.3
499	S	24.8	Very low	27	Very low	69 Å²	69	122.3 Å²	122.3	48%	0.483	65%	0.654	S	S	.	*			cis	-162.5	157.4	-28.2	57.4	0	0	0	0	109.9	R2336	S499-R2336 PolarHBondContact OG-NH1 2.81Å; S499-R2336 PolarHBondContact OG-NH2 3.41Å
500	H	25.9	Very low	26.6	Very low	165 Å²	165	121.5 Å²	121.5	76%	0.764	65%	0.645	S	S	*	*			trans	-66.2	153.8	176.4	-58.9	-91.9	0	0	0	113.8	R2336	H500-R2336 PolarHBondContact O-NH2 2.74Å
501	S	24.6	Very low	26.3	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	66%	0.657	S	S	*	*				167.4	122.7	98.8	62.1	0	0	0	0	118.1
502	Y	24.8	Very low	26.1	Very low	206 Å²	206	127.4 Å²	127.4	81%	0.808	68%	0.678	S	S	*	*			trans	50.1	133.9	133.4	-71.8	-71.2	0	0	0	127
503	K	24.3	Very low	25.9	Very low	164 Å²	164	126.1 Å²	126.1	71%	0.713	69%	0.685	S	S	*	*			trans	93.6	120.5	132	-86.7	-178	175.6	-178.7	0	124.3
504	L	23.1	Very low	25.6	Very low	152 Å²	152	127.7 Å²	127.7	80%	0.796	68%	0.681	S	S	*	*			trans	83.7	153.7	139.8	-70.9	164.5	0	0	0	122.4
505	Q	25.8	Very low	25.6	Very low	165 Å²	165	125.6 Å²	125.6	77%	0.771	68%	0.683	S	S	*	*			trans	-70.7	172	-169.2	-82.1	-174.5	-14.4	0	0	115.9
506	P	27.9	Very low	25.6	Very low	89 Å²	89	125.6 Å²	125.6	58%	0.578	69%	0.687	S	S	*	*			cis	-138.1	-171.9	19.8	42.9	-23.1	0	0	0	118.6
507	S	29.3	Very low	25.7	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	68%	0.681	S	S	*	*			trans	-60.1	168.2	171.9	-122.2	0	0	0	0	114.6
508	P	34.7	Very low	25.7	Very low	102 Å²	102	125.5 Å²	125.5	66%	0.662	69%	0.689	S	S	*	*			cis	-151.8	178.8	41.5	45.1	-24.6	0	0	0	121
509	H	24.1	Very low	25.7	Very low	157 Å²	157	130.7 Å²	130.7	73%	0.727	69%	0.693	S	S	*	*			trans	87	121.5	150.9	-83.7	-68.1	0	0	0	124
510	D	24.3	Very low	25.9	Very low	109 Å²	109	133.7 Å²	133.7	58%	0.583	70%	0.703	S	S	*	*			trans	78.8	109.3	138	-63.4	-0.8	0	0	0	124.6
511	H	23.4	Very low	25.8	Very low	161 Å²	161	127.2 Å²	127.2	75%	0.745	68%	0.678	S	S	*	*			trans	53	112.9	134.9	-48.8	-37.8	0	0	0	118.1
512	T	27.1	Very low	25.9	Very low	124 Å²	124	126.4 Å²	126.4	76%	0.761	67%	0.665	S	S	*	*			cis	-147.5	147.5	41.5	39.2	0	0	0	0	111.1
513	V	22.8	Very low	25.9	Very low	110 Å²	110	120.6 Å²	120.6	67%	0.667	65%	0.647	S	S	*	*				56	117.6	71.8	173.1	0	0	0	0	111.2
514	E	23.8	Very low	26	Very low	97 Å²	97	120.6 Å²	120.6	45%	0.453	65%	0.65	S	S	.	*			cis	-161.2	150.9	2.8	-124.8	177.4	159.4	0	0	112.1	R1264	E514-R1264 VanDerWaalsContact CD-CZ 3.44Å; E514-R1264 IonicContact OE1-CZ 3.66Å; E514-R1264 IonicContact OE1-NE 3.44Å; E514-R1264 IonicContact OE1-NH1 3.65Å; E514-R1264 PolarHBondContact OE1-NH1 3.18Å; E514-R1264 IonicContact OE1-NH2 3.38Å; E514-R1264 PolarHBondContact OE1-NH2 2.81Å; E514-R1264 VanDerWaalsContact OE1-NH2 3.14Å; E514-R1264 IonicContact OE2-CZ 2.74Å; E514-R1264 IonicContact OE2-NH1 2.84Å; E514-R1264 PolarHBondContact OE2-NH1 2.79Å; E514-R1264 IonicContact OE2-NH2 3.25Å; E514-R1264 PolarHBondContact OE2-NH2 2.75Å
515	L	25.5	Very low	26.2	Very low	151 Å²	151	119.7 Å²	119.7	79%	0.791	65%	0.646	S	S	*	*			trans	62.2	160.2	154.1	-68.1	158.5	0	0	0	117.3
516	A	26.6	Very low	26.2	Very low	76 Å²	76	115 Å²	115	63%	0.628	64%	0.636	S	S	*	*			cis	-143.2	175.2	17.2	0	0	0	0	0	115.9
517	D	26.4	Very low	26.2	Very low	136 Å²	136	120 Å²	120	73%	0.727	65%	0.648	S	S	*	*			trans	77	98.2	148.3	-71.9	-55.1	0	0	0	125.3
518	S	23.5	Very low	26.2	Very low	97 Å²	97	122.3 Å²	122.3	68%	0.678	65%	0.651	S	S	*	*				58.3	90.8	102.4	-53.4	0	0	0	0	119.8
519	R	27.7	Very low	25.7	Very low	214 Å²	214	121.2 Å²	121.2	81%	0.808	65%	0.651	S	S	*	*			trans	-152.7	126.6	140.7	-117.3	167.9	-178	-178.8	0.3	114.3	T2285	R519-T2285 PolarHBondContact O-OG1 3.22Å
520	L	28.6	Very low	25.7	Very low	132 Å²	132	118.8 Å²	118.8	69%	0.691	65%	0.652	S	S	*	*			trans	23.5	135.1	143.2	-74	159.2	0	0	0	121
521	A	24.4	Very low	25.7	Very low	29 Å²	29	120.9 Å²	120.9	24%	0.24	66%	0.662	C	S	.	*				36.5	145.5	123.6	0	0	0	0	0	120.6	S2287 T2288	A521-S2287 PolarHBondContact N-OG 2.68Å; A521-T2288 HydrophobicContact CB-CG2 3.9Å
522	I	26.4	Very low	25.7	Very low	78 Å²	78	117.9 Å²	117.9	40%	0.4	66%	0.659	S	S	.	*			cis	-149.9	169	20.1	-140.9	140.6	0	0	0	110.7	S2287 T2288 S2289 E2290	I522-S2287 CarbonylContact C-O 3.55Å; I522-S2287 VanDerWaalsContact CA-O 3.25Å; I522-S2287 WeakPolarHBondContact CA-O 3.21Å; I522-T2288 VanDerWaalsContact CG1-O 3.26Å; I522-T2288 WeakPolarHBondContact CG1-O 3.42Å; I522-S2289 WeakPolarHBondContact CD1-O 3.16Å; I522-S2289 WeakPolarHBondContact CG1-O 3.43Å; I522-E2290 HydrophobicContact CB-CB 4.43Å; I522-E2290 HydrophobicContact CD1-CB 3.94Å; I522-E2290 HydrophobicContact CD1-CG 3.99Å; I522-E2290 HydrophobicContact CG1-CB 3.8Å; I522-E2290 HydrophobicContact CG1-CG 4.34Å; I522-E2290 HydrophobicContact CG2-CB 3.79Å; I522-E2290 HydrophobicContact CG2-CG 4.16Å
523	L	25	Very low	25.6	Very low	83 Å²	83	116.9 Å²	116.9	44%	0.435	65%	0.652	S	S	.	*			trans	-92.7	162.4	-172.2	-70.6	171	0	0	0	116.4	T2288	L523-T2288 WeakPolarHBondContact CB-O 3.28Å; L523-T2288 WeakPolarHBondContact CG-O 3.29Å; L523-T2288 PolarHBondContact N-O 2.99Å
524	H	25.1	Very low	25.6	Very low	164 Å²	164	117.4 Å²	117.4	76%	0.759	65%	0.652	S	S	*	*			trans	71.1	153.8	145	-90.3	-128.1	0	0	0	118.9
525	D	27.1	Very low	25.6	Very low	133 Å²	133	122 Å²	122	71%	0.711	67%	0.665	S	S	*	*			cis	-163.5	173.8	-31.3	-162.7	21	0	0	0	110.8
526	A	26.4	Very low	26	Very low	68 Å²	68	118.5 Å²	118.5	56%	0.562	65%	0.652	S	S	*	*				139.4	145	118.8	0	0	0	0	0	115.3
527	K	27.6	Very low	25.8	Very low	192 Å²	192	120.1 Å²	120.1	84%	0.835	66%	0.658	S	S	*	*			trans	69.7	119.4	167	-63.3	174.8	-179.2	173.1	0	114.8
528	L	28.9	Very low	25.8	Very low	155 Å²	155	119.8 Å²	119.8	81%	0.812	67%	0.665	S	S	*	*			cis	-135.5	142.9	4.2	-64.1	169.7	0	0	0	108.2
529	A	24.8	Very low	25.8	Very low	79 Å²	79	121.7 Å²	121.7	65%	0.653	67%	0.673	S	S	*	*			cis	81.3	128.4	43.3	0	0	0	0	0	114.9
530	S	23.8	Very low	25.6	Very low	107 Å²	107	120.1 Å²	120.1	75%	0.748	68%	0.677	S	S	*	*			trans	61.9	112.7	174.1	36	0	0	0	0	117.8
531	L	23.7	Very low	25.6	Very low	153 Å²	153	118.2 Å²	118.2	80%	0.801	67%	0.672	S	S	*	*				68.5	143.9	78.4	-64.9	165.7	0	0	0	113.4	V533	L531-V533 HydrophobicContact CD2-CG2 3.77Å
532	S	24.6	Very low	25.5	Very low	98 Å²	98	124.1 Å²	124.1	69%	0.685	70%	0.695	S	S	*	*			cis	-122.1	165.7	10	-78.9	0	0	0	0	112
533	V	24.7	Very low	25.3	Very low	102 Å²	102	126.1 Å²	126.1	62%	0.618	71%	0.706	S	S	*	*			cis	85.5	154.8	27.6	-173.9	0	0	0	0	114.1	L531	L531-V533 HydrophobicContact CD2-CG2 3.77Å
534	D	23.8	Very low	25.2	Very low	122 Å²	122	126 Å²	126	65%	0.652	71%	0.705	S	S	*	*			trans	98.8	115.7	173.4	-58.2	-58.6	0	0	0	117.3
535	W	23.2	Very low	25.1	Very low	192 Å²	192	124.7 Å²	124.7	73%	0.727	71%	0.711	S	S	*	*			cis	94.9	164.9	44.8	-84.4	53.6	0	0	0	112.1
536	P	32.8	Very low	24.9	Very low	79 Å²	79	123.2 Å²	123.2	51%	0.513	70%	0.702	S	S	.	*			cis	-138	-179.8	-37.1	36.1	-19.6	0	0	0	114.5
537	S	23.7	Very low	24.7	Very low	110 Å²	110	124.9 Å²	124.9	77%	0.769	71%	0.709	S	S	*	*			trans	-166	155.5	141	-93.4	0	0	0	0	114.9
538	C	26.2	Very low	24.6	Very low	128 Å²	128	124.6 Å²	124.6	87%	0.865	71%	0.708	S	S	*	*			trans	62	76.4	164.8	-61.5	0	0	0	0	119.1
539	T	24.4	Very low	24.4	Very low	138 Å²	138	120.9 Å²	120.9	85%	0.847	70%	0.699	S	S	*	*			trans	-124.9	136.8	147.9	49.2	0	0	0	0	111.1
540	M	23.6	Very low	24.6	Very low	181 Å²	181	124.6 Å²	124.6	89%	0.892	71%	0.708	S	S	*	*			trans	-160.7	154.8	-178.7	-105.1	-86.7	147.4	0	0	107.4
541	P	26.9	Very low	24.6	Very low	92 Å²	92	129 Å²	129	60%	0.597	71%	0.708	S	S	*	*				-132.8	-165.9	-99.5	39.9	-23.6	0	0	0	113.5
542	Q	23.2	Very low	24.8	Very low	153 Å²	153	129 Å²	129	72%	0.715	71%	0.708	S	S	*	*			trans	75.7	143.3	157.8	-76.7	-164.6	25.9	0	0	118.1
543	N	23	Very low	24.8	Very low	119 Å²	119	132 Å²	132	64%	0.636	70%	0.704	S	S	*	*			cis	-174.3	179.3	-17.4	-150.1	-14.4	0	0	0	109.8
544	I	22.5	Very low	24.7	Very low	80 Å²	80	131.3 Å²	131.3	41%	0.41	70%	0.704	S	S	.	*			trans	77.9	131.8	135.4	-90.8	156.8	0	0	0	122.6	M546	I544-M546 HydrophobicContact CB-CB 4.45Å; I544-M546 HydrophobicContact CD1-CB 4.14Å; I544-M546 HydrophobicContact CD1-CG 3.58Å; I544-M546 HydrophobicContact CD1-SD 3.31Å; I544-M546 WeakPolarHBondContact CD1-SD 3.32Å; I544-M546 HydrophobicContact CG1-CB 3.98Å; I544-M546 HydrophobicContact CG1-CG 3.7Å; I544-M546 HydrophobicContact CG1-SD 4.14Å; I544-M546 HydrophobicContact CG2-CB 3.83Å; I544-M546 HydrophobicContact CG2-CG 4.48Å
545	P	21.5	Very low	24.8	Very low	137 Å²	137	131 Å²	131	89%	0.89	71%	0.712	S	S	*	*				-119.3	55.3	128.6	38.5	-34.1	0	0	0	113.5	S547	P545-S547 PolarHBondContact O-N 3.14Å
546	M	23.5	Very low	25.1	Very low	103 Å²	103	125.1 Å²	125.1	51%	0.507	71%	0.71	S	S	.	*			trans	-42.9	134.6	159.7	-98	178.8	94.1	0	0	112.9	I544 K548	I544-M546 HydrophobicContact CB-CB 4.45Å; I544-M546 HydrophobicContact CD1-CB 4.14Å; I544-M546 HydrophobicContact CD1-CG 3.58Å; I544-M546 HydrophobicContact CD1-SD 3.31Å; I544-M546 WeakPolarHBondContact CD1-SD 3.32Å; I544-M546 HydrophobicContact CG1-CB 3.98Å; I544-M546 HydrophobicContact CG1-CG 3.7Å; I544-M546 HydrophobicContact CG1-SD 4.14Å; I544-M546 HydrophobicContact CG2-CB 3.83Å; I544-M546 HydrophobicContact CG2-CG 4.48Å; M546-K548 PolarHBondContact O-N 3.06Å
547	S	23.5	Very low	24.8	Very low	102 Å²	102	126 Å²	126	71%	0.713	72%	0.718	S	S	*	*				0.1	61.1	105.6	48.5	0	0	0	0	117.9	P545	P545-S547 PolarHBondContact O-N 3.14Å
548	K	23.6	Very low	24.9	Very low	186 Å²	186	128.8 Å²	128.8	81%	0.809	72%	0.723	S	S	*	*			trans	-66	139.4	165.1	-70	178.1	-179.8	176.7	0	109	M546	M546-K548 PolarHBondContact O-N 3.06Å
549	A	26.1	Very low	24.9	Very low	77 Å²	77	127.5 Å²	127.5	64%	0.636	72%	0.716	S	S	*	*			cis	-139.8	168.7	13.7	0	0	0	0	0	109.9
550	N	28.1	Very low	24.9	Very low	158 Å²	158	125.8 Å²	125.8	85%	0.845	71%	0.71	S	S	*	*				-149.2	164.2	54.4	-87.5	-39.2	0	0	0	114.4
551	R	23.3	Very low	25.2	Very low	198 Å²	198	122.4 Å²	122.4	75%	0.747	70%	0.701	S	S	*	*			trans	-131.8	110.8	168.9	176.9	-163.8	-92.8	-163.8	-5.9	110.4
552	I	28.8	Very low	25	Very low	155 Å²	155	123.9 Å²	123.9	80%	0.795	71%	0.708	S	S	*	*			trans	-148	103.7	167.2	-72.1	-174	0	0	0	101.2
553	R	23.7	Very low	25	Very low	160 Å²	160	121.6 Å²	121.6	60%	0.604	71%	0.708	S	S	*	*				46.1	114.6	60.4	-109.2	-153.1	-178.3	-158.2	2.6	111.1	M263	M263-R553 PolarHBondContact SD-NH1 3.14Å
554	S	24.5	Very low	25	Very low	88 Å²	88	122.3 Å²	122.3	62%	0.615	71%	0.711	S	S	*	*			cis	-177.3	171.3	4.5	28.1	0	0	0	0	108
555	S	24.4	Very low	25.1	Very low	116 Å²	116	123.9 Å²	123.9	81%	0.811	72%	0.724	S	S	*	*			trans	61	158.6	162.3	41.5	0	0	0	0	117.4
556	G	30.7	Very low	25.6	Very low	67 Å²	67	122.1 Å²	122.1	69%	0.691	71%	0.713	S	S	*	*			cis	-95.3	158.1	-15.9	0	0	0	0	0	112.1
557	S	25.2	Very low	25.6	Very low	99 Å²	99	123.1 Å²	123.1	69%	0.692	73%	0.725	S	S	*	*			cis	81.2	141	27	79.5	0	0	0	0	115.5
558	L	25.4	Very low	25.6	Very low	167 Å²	167	122.5 Å²	122.5	87%	0.874	72%	0.721	S	S	*	*			trans	70.7	137	173.2	-52.1	169.7	0	0	0	113.5
559	S	27.3	Very low	25.7	Very low	101 Å²	101	122.6 Å²	122.6	71%	0.706	72%	0.722	S	S	*	*			cis	-147.5	162.3	-6	56.4	0	0	0	0	107.4
560	S	23.7	Very low	25.5	Very low	102 Å²	102	123.1 Å²	123.1	71%	0.713	72%	0.721	S	S	*	*			cis	58.1	153.6	43.1	-53.7	0	0	0	0	113.1
561	P	30.4	Very low	25.4	Very low	111 Å²	111	122.7 Å²	122.7	72%	0.721	72%	0.718	S	S	*	*			cis	-105.3	177.6	-9.9	14.8	10	0	0	0	110.6
562	V	22.8	Very low	25.5	Very low	123 Å²	123	119.9 Å²	119.9	75%	0.745	72%	0.723	S	S	*	*			cis	82.5	133.7	24	119.5	0	0	0	0	115.1
563	C	22.9	Very low	25.2	Very low	104 Å²	104	117.6 Å²	117.6	70%	0.703	72%	0.717	S	S	*	*			trans	65.4	162.2	163.5	-66.5	0	0	0	0	118.4
564	L	22.8	Very low	25.2	Very low	135 Å²	135	114.7 Å²	114.7	71%	0.707	72%	0.721	S	S	*	*			cis	-158.7	136.2	-24.7	-97.3	162.7	0	0	0	104.1
565	T	24.6	Very low	25.2	Very low	112 Å²	112	119 Å²	119	69%	0.687	73%	0.731	S	S	*	*				45.3	165	94.8	82.3	0	0	0	0	116.3
566	P	32.6	Very low	25.4	Very low	100 Å²	100	118.7 Å²	118.7	65%	0.649	73%	0.729	S	S	*	*			cis	-139.2	-161.8	0.6	36.8	-13.9	0	0	0	114.7
567	T	23.9	Very low	24.9	Very low	125 Å²	125	120.8 Å²	120.8	77%	0.767	73%	0.733	S	S	*	*			trans	68.4	143	150.5	43.7	0	0	0	0	120.4
568	S	23.6	Very low	25	Very low	89 Å²	89	125.5 Å²	125.5	62%	0.622	74%	0.742	S	S	*	*			cis	-171.4	166.1	-4.7	47.4	0	0	0	0	115.3
569	F	24.4	Very low	24.8	Very low	187 Å²	187	121.9 Å²	121.9	82%	0.82	73%	0.731	S	S	*	*			trans	74.2	79.9	153.1	-64.1	-58.1	0	0	0	123
570	S	22.9	Very low	24.8	Very low	89 Å²	89	121.3 Å²	121.3	62%	0.622	72%	0.723	S	S	*	*				52.7	127.5	112.7	65.2	0	0	0	0	124.6
571	N	25.1	Very low	25	Very low	148 Å²	148	123.6 Å²	123.6	79%	0.791	73%	0.727	S	S	*	*			trans	81.4	113.3	139.1	-62.5	-0.2	0	0	0	121.9
572	T	25.6	Very low	24.7	Very low	139 Å²	139	125.2 Å²	125.2	85%	0.853	73%	0.725	S	S	*	*				-165.1	161.5	105.7	13.4	0	0	0	0	114.7
573	T	23.7	Very low	24.9	Very low	107 Å²	107	126 Å²	126	66%	0.656	72%	0.724	S	S	*	*			trans	-39.8	161.7	166.9	41.9	0	0	0	0	117.7
574	S	23.9	Very low	25.1	Very low	99 Å²	99	129.3 Å²	129.3	69%	0.692	73%	0.729	S	S	*	*			cis	-175.2	-174.2	-4.1	46.3	0	0	0	0	111.6
575	E	23.5	Very low	25.4	Very low	178 Å²	178	128.3 Å²	128.3	83%	0.832	73%	0.729	S	S	*	*			trans	86	163.4	159.9	-56.7	-150.3	144	0	0	121
576	S	27.9	Very low	25.5	Very low	110 Å²	110	132 Å²	132	77%	0.769	74%	0.735	S	S	*	*			trans	66.5	93.9	173.3	66.9	0	0	0	0	118
577	S	21.9	Very low	25.3	Very low	111 Å²	111	131.5 Å²	131.5	78%	0.776	74%	0.74	S	S	*	*			trans	-48	136.2	145.1	51.5	0	0	0	0	112.6
578	F	26.2	Very low	25.4	Very low	198 Å²	198	129.8 Å²	129.8	87%	0.868	74%	0.738	S	S	*	*			trans	-147.4	125.4	141.9	-108.1	-73.4	0	0	0	111.8
579	S	22.2	Very low	25.6	Very low	92 Å²	92	131.6 Å²	131.6	64%	0.643	75%	0.746	S	S	*	*			trans	-90.1	154.3	160.4	179.2	0	0	0	0	109
580	T	27.2	Very low	25.8	Very low	89 Å²	89	128.4 Å²	128.4	55%	0.546	74%	0.742	S	S	.	*			trans	19.5	119.4	158.6	53.8	0	0	0	0	119.4	Q582	T580-Q582 VanDerWaalsContact O-CB 3.26Å; T580-Q582 WeakPolarHBondContact O-CB 3.37Å; T580-Q582 PolarHBondContact O-NE2 2.74Å; T580-Q582 PolarHBondContact OG1-NE2 3.12Å
581	N	26.3	Very low	26	Very low	150 Å²	150	128.9 Å²	128.9	80%	0.802	75%	0.745	S	S	*	*			trans	-103.1	108.2	137.3	-75.2	-41.9	0	0	0	106.1
582	Q	24.9	Very low	26.1	Very low	144 Å²	144	126.4 Å²	126.4	67%	0.673	74%	0.739	S	S	*	*			cis	75.3	163.8	19.8	-133.6	-165.1	115.1	0	0	114.2	T580	T580-Q582 VanDerWaalsContact O-CB 3.26Å; T580-Q582 WeakPolarHBondContact O-CB 3.37Å; T580-Q582 PolarHBondContact O-NE2 2.74Å; T580-Q582 PolarHBondContact OG1-NE2 3.12Å
583	L	26.8	Very low	26	Very low	140 Å²	140	124 Å²	124	73%	0.733	73%	0.728	S	S	*	*			trans	74.9	125	-159.3	-49.3	169.1	0	0	0	111.8
584	H	27.1	Very low	26.1	Very low	174 Å²	174	128.3 Å²	128.3	81%	0.806	74%	0.741	S	S	*	*	S	Bend	cis	-112.4	157.1	3.9	-73.6	-125.6	0	0	0	110.2
585	T	28.4	Very low	26.2	Very low	113 Å²	113	128.7 Å²	128.7	69%	0.693	74%	0.743	S	S	*	*			cis	-153.9	146.2	-3.3	4.2	0	0	0	0	110.7
586	K	26.5	Very low	26.2	Very low	190 Å²	190	127.9 Å²	127.9	83%	0.826	74%	0.744	S	S	*	*			trans	4.8	144.4	130.1	-65.6	178.2	179	-179.8	0	118
587	A	28.6	Very low	26.2	Very low	90 Å²	90	128 Å²	128	74%	0.744	75%	0.745	S	S	*	*			cis	-167.8	-177.8	-4	0	0	0	0	0	111.3
588	A	26.7	Very low	26.3	Very low	89 Å²	89	128.1 Å²	128.1	74%	0.736	75%	0.746	S	S	*	*			trans	21.3	139.7	144.4	0	0	0	0	0	119.8
589	T	27.7	Very low	26.1	Very low	126 Å²	126	124.9 Å²	124.9	77%	0.773	74%	0.742	S	S	*	*			cis	-163.9	174.1	15.9	2.3	0	0	0	0	106.9
590	T	28.1	Very low	26	Very low	120 Å²	120	124.9 Å²	124.9	74%	0.736	74%	0.742	S	S	*	*			cis	-165.3	175	31.1	-16.6	0	0	0	0	110.7
591	S	27.7	Very low	26	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	75%	0.75	S	S	*	*			trans	-12.7	159.2	153.6	53.8	0	0	0	0	121.5
592	S	26.3	Very low	26.2	Very low	96 Å²	96	128.5 Å²	128.5	67%	0.671	76%	0.756	S	S	*	*			cis	-178.1	168.2	-15.8	56.2	0	0	0	0	111.3
593	S	25	Very low	26.2	Very low	89 Å²	89	127 Å²	127	62%	0.622	76%	0.756	S	S	*	*			trans	51.6	118.5	142.4	61.8	0	0	0	0	122.8
594	Q	25.7	Very low	26.3	Very low	197 Å²	197	125.3 Å²	125.3	92%	0.921	76%	0.756	S	S	*	*			trans	76.5	166.4	134.8	-68.1	178.8	-13.5	0	0	120
595	S	25.4	Very low	26.3	Very low	106 Å²	106	126 Å²	126	74%	0.741	76%	0.76	S	S	*	*			trans	-115.4	147.5	-161.6	52.8	0	0	0	0	112.5
596	L	24.2	Very low	26.2	Very low	161 Å²	161	124.9 Å²	124.9	84%	0.843	76%	0.757	S	S	*	*			trans	-179.7	167.5	133.2	-104	166.8	0	0	0	112.3
597	S	27.5	Very low	26.3	Very low	114 Å²	114	123.5 Å²	123.5	80%	0.797	76%	0.758	S	S	*	*			trans	67.2	141.4	158.8	62.4	0	0	0	0	120
598	S	22.7	Very low	26.2	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	76%	0.757	S	S	*	*			trans	-93.1	146.8	178.3	-35.9	0	0	0	0	111.6
599	V	22.4	Very low	26.2	Very low	130 Å²	130	132.2 Å²	132.2	79%	0.788	77%	0.765	S	S	*	*			trans	68.6	130.3	157.9	-176.4	0	0	0	0	117.5
600	S	21.3	Very low	26.1	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	76%	0.763	S	S	*	*			trans	69.1	146.7	169.5	77	0	0	0	0	115.9
601	F	25.6	Very low	26.4	Very low	164 Å²	164	130.4 Å²	130.4	72%	0.719	76%	0.76	S	S	*	*			cis	-127.5	150.6	9.7	-91	-95.5	0	0	0	113.6	T603	F601-T603 HydrophobicContact CB-CG2 3.74Å; F601-T603 HydrophobicContact CD1-CG2 3.66Å; F601-T603 HydrophobicContact CE1-CG2 4.42Å; F601-T603 HydrophobicContact CG-CG2 3.79Å
602	V	31.8	Very low	26.3	Very low	152 Å²	152	131.5 Å²	131.5	92%	0.921	76%	0.763	S	S	*	*			trans	-95.7	85.7	146	-179.1	0	0	0	0	106.6	S604	V602-S604 PolarHBondContact O-N 2.93Å
603	T	25.2	Very low	26.3	Very low	112 Å²	112	131.7 Å²	131.7	69%	0.687	76%	0.764	S	S	*	*			trans	-84.7	99.3	-178.5	28	0	0	0	0	111.9	F601	F601-T603 HydrophobicContact CB-CG2 3.74Å; F601-T603 HydrophobicContact CD1-CG2 3.66Å; F601-T603 HydrophobicContact CE1-CG2 4.42Å; F601-T603 HydrophobicContact CG-CG2 3.79Å
604	S	28.2	Very low	26.4	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	77%	0.771	S	S	*	*	S	Bend	trans	170.4	117.5	130.6	54.5	0	0	0	0	108.7	V602	V602-S604 PolarHBondContact O-N 2.93Å
605	E	26.6	Very low	26.4	Very low	187 Å²	187	132.8 Å²	132.8	87%	0.874	76%	0.763	S	S	*	*			cis	-157.6	165.2	-0.1	-83.3	170.2	172.4	0	0	106.1
606	S	27.6	Very low	26.4	Very low	91 Å²	91	133.3 Å²	133.3	64%	0.636	77%	0.766	S	S	*	*			cis	-168.7	158.7	-27.3	66	0	0	0	0	107.9
607	L	27.2	Very low	26.7	Very low	160 Å²	160	131.1 Å²	131.1	84%	0.838	76%	0.764	S	S	*	*			trans	63.6	144.6	160.6	-91.3	70.8	0	0	0	117.7
608	V	27.4	Very low	27.2	Very low	120 Å²	120	131.1 Å²	131.1	73%	0.727	76%	0.761	S	S	*	*			cis	-149.5	156.2	-0.4	-158.3	0	0	0	0	110.1
609	R	27.5	Very low	27.3	Very low	243 Å²	243	131.5 Å²	131.5	92%	0.917	76%	0.759	S	S	*	*			trans	84.3	149.3	147.8	-105.4	169.5	-174.6	170.3	1	121.8
610	S	23.7	Very low	27.6	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	76%	0.759	S	S	*	*			trans	-121.5	-173.7	-174.6	57.8	0	0	0	0	110.1
611	P	35.8	Very low	28.2	Very low	105 Å²	105	133.5 Å²	133.5	68%	0.682	76%	0.762	S	S	*	*			cis	-137	-161.7	-10.4	25.7	1.6	0	0	0	115
612	T	25.8	Very low	28.2	Very low	124 Å²	124	131.4 Å²	131.4	76%	0.761	76%	0.763	S	S	*	*			trans	92.1	119.3	151.4	63	0	0	0	0	125
613	S	25.4	Very low	28	Very low	99 Å²	99	130 Å²	130	69%	0.692	75%	0.75	S	S	*	*			trans	69.5	124.4	135.7	60.5	0	0	0	0	126.1
614	D	26.3	Very low	28.1	Very low	144 Å²	144	133.2 Å²	133.2	77%	0.77	76%	0.755	S	S	*	*			trans	87.5	129.4	130.2	-65.1	4	0	0	0	126.7
615	H	27.1	Very low	28.6	Very low	165 Å²	165	135.2 Å²	135.2	76%	0.764	76%	0.758	S	S	*	*			trans	65.1	115.3	146	-76.3	-62.8	0	0	0	126
616	C	25.2	Very low	29	Very low	118 Å²	118	131.9 Å²	131.9	80%	0.797	75%	0.752	S	S	*	*			trans	77.6	151.2	135.8	-63.7	0	0	0	0	123.1
617	S	29.4	Very low	29.4	Very low	115 Å²	115	137.6 Å²	137.6	80%	0.804	77%	0.765	S	S	*	*			trans	-91.6	-178.2	-171	-25.4	0	0	0	0	114.1
618	P	39	Very low	29.4	Very low	113 Å²	113	133.4 Å²	133.4	73%	0.734	76%	0.761	S	S	*	*			cis	-138	-169.8	-4	35.2	-12.8	0	0	0	116.3
619	T	24	Very low	29.8	Very low	120 Å²	120	133.2 Å²	133.2	74%	0.736	76%	0.762	S	S	*	*			trans	100.8	107.9	151.7	-28.9	0	0	0	0	121.5
620	I	28.4	Very low	29.8	Very low	154 Å²	154	127.4 Å²	127.4	79%	0.79	75%	0.754	S	S	*	*				19.8	146.7	126	-55.8	170.4	0	0	0	119.1
621	P	34.9	Very low	29.9	Very low	110 Å²	110	129.5 Å²	129.5	71%	0.714	76%	0.756	S	S	*	*			cis	-141.3	166	4.9	31.3	-6.9	0	0	0	121.5
622	V	26.3	Very low	29.4	Very low	120 Å²	120	131.9 Å²	131.9	73%	0.727	76%	0.758	S	S	*	*			trans	61.6	121.7	134.1	176.5	0	0	0	0	126.8
623	N	27.1	Very low	29.5	Very low	123 Å²	123	131.4 Å²	131.4	66%	0.658	76%	0.755	S	S	*	*			trans	49.1	171.7	143.7	-58	1.9	0	0	0	123.3
624	F	27.3	Very low	29.7	Very low	180 Å²	180	135.3 Å²	135.3	79%	0.789	76%	0.763	S	S	*	*			cis	-152.6	-175.7	16.3	-114.1	-54.6	0	0	0	115.4
625	N	37.6	Very low	29.5	Very low	147 Å²	147	133.8 Å²	133.8	79%	0.786	76%	0.763	S	S	*	*			trans	-61.5	164.2	-177.3	-66.4	-23.8	0	0	0	118.1
626	P	37	Very low	29.7	Very low	117 Å²	117	131.1 Å²	131.1	76%	0.76	76%	0.761	S	S	*	*			trans	-147	159.4	149.5	40.2	-24.6	0	0	0	119.7
627	K	34.3	Very low	29.9	Very low	210 Å²	210	132.8 Å²	132.8	91%	0.913	76%	0.76	S	S	*	*			trans	121.5	119.5	153.3	-70.8	-179.8	179.8	179.5	0	114.2
628	G	27.8	Very low	29.8	Very low	72 Å²	72	131.8 Å²	131.8	74%	0.742	75%	0.753	S	S	*	*			cis	178.7	177.1	-4.4	0	0	0	0	0	109.5
629	P	36.9	Very low	29.2	Very low	116 Å²	116	131.5 Å²	131.5	75%	0.753	75%	0.754	S	S	*	*			cis	-127.7	178.8	17.3	41.2	-26.1	0	0	0	115.7
630	T	26.8	Very low	29.4	Very low	121 Å²	121	131.2 Å²	131.2	74%	0.742	76%	0.755	S	S	*	*			trans	50.5	119.8	156.9	44.7	0	0	0	0	119
631	L	25.8	Very low	29.5	Very low	146 Å²	146	129.7 Å²	129.7	76%	0.764	76%	0.757	S	S	*	*			cis	-146.7	157.8	1.4	-72.5	152.7	0	0	0	105.7
632	Q	25.6	Very low	29.2	Very low	156 Å²	156	133.2 Å²	133.2	73%	0.729	76%	0.764	S	S	*	*			cis	-159.8	151.1	4.2	-132.1	165.1	-13.5	0	0	107.9
633	T	28.3	Very low	29.2	Very low	113 Å²	113	133.1 Å²	133.1	69%	0.693	76%	0.764	S	S	*	*			trans	38.9	143.9	151.7	51.8	0	0	0	0	122.5
634	E	28	Very low	29.2	Very low	182 Å²	182	134.1 Å²	134.1	85%	0.85	77%	0.767	S	S	*	*			cis	-177.2	160.5	-18.3	-123.6	166.2	-134.5	0	0	108.6
635	S	22.5	Very low	29.2	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	77%	0.768	S	S	*	*			trans	-174.5	179.9	173.6	72.3	0	0	0	0	111.3
636	P	32.2	Very low	28.7	Very low	110 Å²	110	132.5 Å²	132.5	71%	0.714	77%	0.767	S	S	*	*			cis	-125.5	-145.2	-13.9	42	-25.9	0	0	0	111.4
637	I	27.9	Very low	28.1	Very low	152 Å²	152	134.4 Å²	134.4	78%	0.779	77%	0.77	S	S	*	*			trans	140.4	132.6	147.4	-71.8	161.4	0	0	0	116.3
638	S	27.9	Very low	27.7	Very low	95 Å²	95	128.5 Å²	128.5	66%	0.664	76%	0.755	S	S	*	*			trans	43.2	126.2	153.6	79.8	0	0	0	0	126.8
639	S	26.7	Very low	27.7	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	76%	0.756	S	S	*	*				67.8	143.4	121.8	72.3	0	0	0	0	124.8
640	C	27.2	Very low	27.3	Very low	115 Å²	115	131.6 Å²	131.6	78%	0.777	76%	0.755	S	S	*	*			trans	72.8	116	153.4	-162.3	0	0	0	0	118.7
641	C	32.2	Very low	27.6	Very low	121 Å²	121	131.3 Å²	131.3	82%	0.818	75%	0.753	S	S	*	*			trans	-90.6	121	177.7	-55	0	0	0	0	112.2
642	Q	27.2	Very low	27.9	Very low	185 Å²	185	127.6 Å²	127.6	86%	0.864	75%	0.75	S	S	*	*			trans	-149.2	65.2	167.4	-122.8	171.8	52.5	0	0	115.2
643	T	26.4	Very low	28.1	Very low	118 Å²	118	127.3 Å²	127.3	72%	0.724	75%	0.752	S	S	*	*			trans	30.3	97.8	138.6	-44	0	0	0	0	121.4
644	I	28.6	Very low	28.3	Very low	143 Å²	143	126.6 Å²	126.6	73%	0.733	75%	0.747	S	S	*	*			trans	45	129.2	134.6	-26.1	167.4	0	0	0	120.7
645	K	26.7	Very low	28.1	Very low	185 Å²	185	129.3 Å²	129.3	80%	0.804	75%	0.75	S	S	*	*				159.3	128.6	117.5	-86.8	165.2	-173.3	177.7	0	117.2
646	S	26.7	Very low	28.5	Very low	109 Å²	109	128.7 Å²	128.7	76%	0.762	74%	0.741	S	S	*	*			trans	-166.9	134.1	144.8	56.6	0	0	0	0	108.8
647	L	25.3	Very low	28.6	Very low	156 Å²	156	130 Å²	130	82%	0.817	74%	0.741	S	S	*	*	S	Bend	cis	-87.7	145.5	-4.6	-73.3	73.2	0	0	0	109
648	S	25.2	Very low	28.6	Very low	86 Å²	86	129.6 Å²	129.6	60%	0.601	74%	0.741	S	S	*	*			cis	66.4	129.2	42.8	79.7	0	0	0	0	113.5
649	P	28.4	Very low	28.5	Very low	119 Å²	119	129.6 Å²	129.6	77%	0.773	74%	0.741	S	S	*	*			cis	-113.9	-164.9	19.6	46.6	-36.3	0	0	0	111
650	N	28.1	Very low	28.4	Very low	134 Å²	134	128.7 Å²	128.7	72%	0.717	74%	0.735	S	S	*	*			cis	-150.8	167.7	-0.5	-144.9	-5.9	0	0	0	112
651	T	32.4	Very low	28.4	Very low	116 Å²	116	131.4 Å²	131.4	71%	0.712	74%	0.736	S	S	*	*			trans	34.2	125.7	152.2	51.4	0	0	0	0	122
652	G	32.4	Very low	27.9	Very low	67 Å²	67	130 Å²	130	69%	0.691	73%	0.727	S	S	*	*			trans	148.3	92.7	164.6	0	0	0	0	0	111.3
653	I	30.3	Very low	27.7	Very low	151 Å²	151	128.9 Å²	128.9	77%	0.774	72%	0.722	S	S	*	*				54.3	104.5	50.7	-48.3	175.2	0	0	0	109.6
654	T	31.7	Very low	27.5	Very low	98 Å²	98	131.5 Å²	131.5	60%	0.601	72%	0.724	S	S	*	*			cis	-148.6	168.3	-3.2	16.3	0	0	0	0	107.3	V656	T654-V656 HydrophobicContact CG2-CG2 3.9Å
655	R	23.1	Very low	27.1	Very low	238 Å²	238	129.6 Å²	129.6	90%	0.898	72%	0.723	S	S	*	*				55.5	-174.5	51	-127.1	-174.2	-162.6	-179.4	7.1	111.9
656	V	32.1	Very low	26.9	Very low	99 Å²	99	125.4 Å²	125.4	60%	0.6	72%	0.723	S	S	*	*			trans	78.7	98	169.7	-179	0	0	0	0	114.8	T654	T654-V656 HydrophobicContact CG2-CG2 3.9Å
657	L	34.4	Very low	26.8	Very low	136 Å²	136	127.8 Å²	127.8	71%	0.712	73%	0.726	S	S	*	*			trans	78.2	128.3	153.6	-55.7	172.8	0	0	0	115.6
658	N	26.9	Very low	27	Very low	144 Å²	144	125.4 Å²	125.4	77%	0.77	72%	0.722	S	S	*	*				60.2	133.6	58.3	-48	4.8	0	0	0	109.4
659	S	26.7	Very low	27.2	Very low	96 Å²	96	124.7 Å²	124.7	67%	0.671	73%	0.728	S	S	*	*			cis	-157.2	152.3	25.2	78.1	0	0	0	0	108.5
660	S	24.8	Very low	27.2	Very low	87 Å²	87	121.6 Å²	121.6	61%	0.608	72%	0.718	S	S	*	*				68	156.2	94.9	95.4	0	0	0	0	116
661	Q	26.4	Very low	27	Very low	171 Å²	171	120.5 Å²	120.5	80%	0.799	71%	0.707	S	S	*	*			trans	68.3	128.2	175.7	-60.1	172.3	-0.3	0	0	114
662	S	23	Very low	26.7	Very low	92 Å²	92	116.8 Å²	116.8	64%	0.643	69%	0.686	S	S	*	*			cis	81.5	117	30.2	87.8	0	0	0	0	115.1
663	Q	21.4	Very low	26.8	Very low	162 Å²	162	117.4 Å²	117.4	76%	0.757	68%	0.678	S	S	*	*			trans	65.6	167.4	162.7	-52.9	-179.4	-17.2	0	0	116.6
664	F	22.2	Very low	26.5	Very low	172 Å²	172	115 Å²	115	75%	0.754	67%	0.67	S	S	*	*			trans	56	114	171.7	-63.1	-79.1	0	0	0	116.7
665	S	20.3	Very low	26.3	Very low	103 Å²	103	112.8 Å²	112.8	72%	0.72	67%	0.667	S	S	*	*				70	115.5	66.7	-61.4	0	0	0	0	113.7
666	A	22.7	Very low	26.5	Very low	97 Å²	97	111.6 Å²	111.6	80%	0.802	66%	0.664	S	S	*	*			trans	59.8	143.4	175.6	0	0	0	0	0	113.4
667	I	25.5	Very low	26.3	Very low	159 Å²	159	111.8 Å²	111.8	82%	0.815	67%	0.67	S	S	*	*			cis	-152.7	129.7	39.4	-69.1	151.5	0	0	0	103.7
668	S	29.8	Very low	25.8	Very low	106 Å²	106	111.8 Å²	111.8	74%	0.741	67%	0.67	S	S	*	*				-170.5	163.4	69.5	-151	0	0	0	0	106.8
669	G	28.1	Very low	25.7	Very low	71 Å²	71	108.8 Å²	108.8	73%	0.732	66%	0.659	S	S	*	*			cis	78.3	75.7	36.8	0	0	0	0	0	110.8
670	G	29.5	Very low	25.7	Very low	55 Å²	55	108 Å²	108	57%	0.567	67%	0.667	S	S	*	*			cis	-168.4	-124.5	-1.9	0	0	0	0	0	115.3
671	K	24.3	Very low	25.8	Very low	110 Å²	110	109.5 Å²	109.5	48%	0.478	66%	0.664	S	S	.	*				62.6	102.3	86.8	-128.8	148.2	-81.9	-158.4	0	110	D1807 N1808 H1809	K671-D1807 VanDerWaalsContact C-OD1 3.27Å; K671-D1807 WeakPolarHBondContact CA-OD2 3.31Å; K671-D1807 WeakPolarHBondContact CB-OD2 3.49Å; K671-D1807 WeakPolarHBondContact CG-OD2 3.3Å; K671-D1807 VanDerWaalsContact O-CG 3.24Å; K671-D1807 VanDerWaalsContact O-OD2 3.09Å; K671-N1808 WeakPolarHBondContact CD-O 3.23Å; K671-N1808 WeakPolarHBondContact CG-O 3.27Å; K671-H1809 WeakPolarHBondContact CA-CD2 3.48Å; K671-H1809 HydrophobicContact CD-CB 4.29Å; K671-H1809 WeakPolarHBondContact CE-CD2 3.49Å; K671-H1809 HydrophobicContact CG-CB 3.98Å; K671-H1809 PolarHBondContact N-CD2 2.89Å; K671-H1809 PolarHBondContact N-NE2 2.99Å
672	S	25.3	Very low	25.7	Very low	39 Å²	39	108.7 Å²	108.7	27%	0.273	66%	0.658	S	S	.	*			trans	174.9	144.1	171.3	-91.5	0	0	0	0	114.9	N1806 D1807 N1808	S672-N1806 VanDerWaalsContact OG-CA 3.31Å; S672-N1806 WeakPolarHBondContact OG-CA 3.46Å; S672-N1806 WeakPolarHBondContact OG-CB 3.49Å; S672-N1806 PolarHBondContact OG-ND2 2.97Å; S672-D1807 CarbonylContact C-O 2.77Å; S672-D1807 VanDerWaalsContact CA-N 3.3Å; S672-D1807 PolarHBondContact N-OD2 2.85Å; S672-D1807 PolarHBondContact OG-N 2.93Å; S672-D1807 PolarHBondContact OG-OD1 3.25Å; S672-N1808 WeakPolarHBondContact O-CB 3.25Å; S672-N1808 PolarHBondContact O-ND2 3.12Å
673	P	33.4	Very low	26	Very low	80 Å²	80	111.7 Å²	111.7	52%	0.519	67%	0.666	S	S	.	*	S	Bend	cis	-128.9	120	17.4	40.2	-18.5	0	0	0	124.1	N1806 D1807	P673-N1806 VanDerWaalsContact CA-CA 3.4Å; P673-D1807 CarbonylContact C-O 3.56Å; P673-D1807 WeakPolarHBondContact CA-O 3.46Å; P673-D1807 VanDerWaalsContact N-O 3.13Å
674	T	24.9	Very low	26.4	Very low	99 Å²	99	108.8 Å²	108.8	61%	0.607	66%	0.661	S	S	*	*			trans	-163.8	112	172.5	62.8	0	0	0	0	115.3	N1806 D1807	T674-N1806 CarbonylContact C-O 3.26Å; T674-N1806 VanDerWaalsContact CA-O 3.23Å; T674-N1806 WeakPolarHBondContact CA-O 3.45Å; T674-N1806 PolarHBondContact N-O 2.84Å; T674-N1806 VanDerWaalsContact O-O 3.1Å; T674-D1807 WeakPolarHBondContact CB-O 3.36Å; T674-D1807 VanDerWaalsContact N-C 3.32Å; T674-D1807 PolarHBondContact N-O 3.17Å; T674-D1807 WeakPolarHBondContact O-CA 3.38Å; T674-D1807 PolarHBondContact OG1-O 3.44Å
675	G	27.8	Very low	26.5	Very low	52 Å²	52	105.5 Å²	105.5	54%	0.536	66%	0.655	S	S	.	*			trans	92	153.9	139.4	0	0	0	0	0	120.1	N1806	G675-N1806 PolarHBondContact N-O 2.77Å; G675-N1806 VanDerWaalsContact N-O 3.17Å
676	Y	26.6	Very low	26.7	Very low	213 Å²	213	106.9 Å²	106.9	84%	0.835	66%	0.655	S	S	*	*			trans	59.5	104.1	178.6	-58.2	-75	0	0	0	114.5	L678	Y676-L678 HydrophobicContact CD1-CD1 4.06Å
677	S	28.3	Very low	26.8	Very low	104 Å²	104	107 Å²	107	73%	0.727	65%	0.646	S	S	*	*			cis	46.5	115.2	33.8	-174.4	0	0	0	0	113.1
678	L	24.1	Very low	26.8	Very low	135 Å²	135	107 Å²	107	71%	0.707	65%	0.647	S	S	*	*				-149.9	152.4	126.9	-133.3	72.6	0	0	0	110.2	Y676	Y676-L678 HydrophobicContact CD1-CD1 4.06Å
679	C	23.7	Very low	26.8	Very low	82 Å²	82	107 Å²	107	55%	0.554	65%	0.647	S	S	*	*			trans	27.3	139.5	134.9	-72.6	0	0	0	0	120.5	Q681	C679-Q681 HydrophobicContact CB-CG 3.6Å; C679-Q681 WeakPolarHBondContact SG-CG 3.24Å
680	G	27.5	Very low	27.2	Very low	80 Å²	80	111.7 Å²	111.7	83%	0.825	65%	0.654	S	S	*	*			cis	87.4	-173.1	35.5	0	0	0	0	0	110.2
681	Q	26.2	Very low	26.9	Very low	118 Å²	118	115.3 Å²	115.3	55%	0.551	66%	0.66	S	S	*	*			cis	-132.8	-158.5	14.3	-61.4	138.6	-74.5	0	0	109.7	C679	C679-Q681 HydrophobicContact CB-CG 3.6Å; C679-Q681 WeakPolarHBondContact SG-CG 3.24Å
682	F	25.5	Very low	27.1	Very low	153 Å²	153	116.3 Å²	116.3	67%	0.671	67%	0.671	S	S	*	*			trans	78.5	144.1	152	-48.2	-52.4	0	0	0	115.7
683	L	28.5	Very low	27.1	Very low	156 Å²	156	120 Å²	120	82%	0.817	69%	0.687	S	S	*	*	S	Bend	cis	-128.2	168.9	-1.5	-80.2	90.5	0	0	0	109.8
684	P	29.9	Very low	26.8	Very low	100 Å²	100	122 Å²	122	65%	0.649	69%	0.694	S	S	*	*			cis	-118.1	160.4	-22.4	24.8	-2.7	0	0	0	109.8
685	T	24.4	Very low	26.9	Very low	103 Å²	103	121.7 Å²	121.7	63%	0.632	69%	0.692	S	S	*	*				42.3	140.3	72.8	71.6	0	0	0	0	113.8
686	N	24.9	Very low	26.8	Very low	133 Å²	133	124.7 Å²	124.7	71%	0.711	69%	0.694	S	S	*	*			cis	-159.3	166.1	13.2	-137.6	1.8	0	0	0	112.8
687	T	25.3	Very low	27	Very low	100 Å²	100	122.3 Å²	122.3	61%	0.613	69%	0.691	S	S	*	*			trans	28.6	123.5	150	55.8	0	0	0	0	122.4
688	N	25.3	Very low	26.8	Very low	157 Å²	157	123 Å²	123	84%	0.84	69%	0.686	S	S	*	*			trans	65.4	165	141.1	-63.1	-11.5	0	0	0	119.7
689	S	28.4	Very low	26.9	Very low	107 Å²	107	120 Å²	120	75%	0.748	68%	0.677	S	S	*	*			trans	-73.1	135.7	167.4	55.5	0	0	0	0	111.4
690	I	36.8	Very low	27.3	Very low	169 Å²	169	122.8 Å²	122.8	87%	0.867	69%	0.686	S	S	*	*				-166	154.4	128.9	-105	157.7	0	0	0	111
691	N	24.9	Very low	27.3	Very low	132 Å²	132	126 Å²	126	71%	0.706	68%	0.679	S	S	*	*			trans	-43.1	134.9	175.7	-78.8	5.2	0	0	0	116.3
692	N	26.9	Very low	27.5	Very low	130 Å²	130	127.1 Å²	127.1	70%	0.695	69%	0.687	S	S	*	*				94.1	151.2	118.1	-78.9	25.3	0	0	0	122.5
693	N	26.1	Very low	27.7	Very low	116 Å²	116	127.8 Å²	127.8	62%	0.62	69%	0.693	S	S	*	*			trans	70	102.2	158.2	-77.4	60.8	0	0	0	117.2
694	D	27.7	Very low	27.8	Very low	122 Å²	122	125 Å²	125	65%	0.652	69%	0.686	S	S	*	*				105.8	123.8	111.5	-71.9	3.7	0	0	0	117.8
695	T	26.2	Very low	27.6	Very low	93 Å²	93	127.4 Å²	127.4	57%	0.571	69%	0.693	S	S	*	*			cis	-166.6	-179.9	-8.4	-3.1	0	0	0	0	112.3
696	I	26.4	Very low	27.9	Very low	115 Å²	115	132.6 Å²	132.6	59%	0.59	70%	0.702	S	S	*	*			trans	72.4	125.2	140.4	-77	158.1	0	0	0	117.5	L698	I696-L698 VanDerWaalsContact N-CD1 3.34Å
697	E	29.9	Very low	28	Very low	164 Å²	164	132.7 Å²	132.7	77%	0.766	70%	0.701	S	S	*	*			cis	-138	120.8	-13.9	-120.3	149.3	-169.9	0	0	108
698	L	24.9	Very low	28.2	Very low	118 Å²	118	132.7 Å²	132.7	62%	0.618	71%	0.705	S	S	*	*				67.6	119.4	57.5	-76.8	108.3	0	0	0	114.3	I696	I696-L698 VanDerWaalsContact N-CD1 3.34Å
699	S	24.8	Very low	28.3	Very low	73 Å²	73	132.8 Å²	132.8	51%	0.51	71%	0.705	S	S	.	*				77.7	160.3	129.6	-64.3	0	0	0	0	117.6
700	N	31.8	Very low	28.1	Very low	140 Å²	140	133.1 Å²	133.1	75%	0.749	71%	0.706	S	S	*	*			cis	-122.2	140.3	19.8	-81.5	-84.2	0	0	0	111.9
701	H	27.7	Very low	27.8	Very low	146 Å²	146	131.4 Å²	131.4	68%	0.676	71%	0.706	S	S	*	*				56	147.8	81.7	-76.4	-74.7	0	0	0	112.3
702	I	30.6	Very low	27.8	Very low	143 Å²	143	129 Å²	129	73%	0.733	71%	0.712	S	S	*	*			cis	-119.3	160.1	19.9	-52.4	163.8	0	0	0	106.2
703	E	31.1	Very low	27.8	Very low	167 Å²	167	132.5 Å²	132.5	78%	0.78	72%	0.721	S	S	*	*			cis	-150.7	-133.3	43.4	-163.9	134.1	-112.9	0	0	115.5
704	S	29.3	Very low	27.7	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	73%	0.73	S	S	*	*			trans	-163.7	170	-135	-67.9	0	0	0	0	114
705	N	26.3	Very low	27.5	Very low	149 Å²	149	131.5 Å²	131.5	80%	0.797	72%	0.72	S	S	*	*			cis	-177.1	171.9	-34.6	-159	-21.9	0	0	0	108.3
706	R	29.7	Very low	27.3	Very low	213 Å²	213	131.6 Å²	131.6	80%	0.804	72%	0.72	S	S	*	*			trans	100.4	111.2	155.4	-66.7	-175.3	171.6	-161.4	-1.8	123
707	I	28.6	Very low	27	Very low	135 Å²	135	132.1 Å²	132.1	69%	0.692	72%	0.724	S	S	*	*				100.4	120.7	118.8	-71.1	171.5	0	0	0	121.8
708	S	29.3	Very low	26.6	Very low	100 Å²	100	127.9 Å²	127.9	70%	0.699	71%	0.712	S	S	*	*			trans	70.1	148	152.2	70	0	0	0	0	121.3
709	N	28	Very low	26.5	Very low	159 Å²	159	129.2 Å²	129.2	85%	0.85	72%	0.716	S	S	*	*			cis	-159.9	162.5	-36.3	-114.2	0.3	0	0	0	111.1
710	C	22.5	Very low	26.4	Very low	114 Å²	114	131.2 Å²	131.2	77%	0.77	72%	0.717	S	S	*	*			trans	-66	-177.3	-175	-40.5	0	0	0	0	115.3
711	P	31.9	Very low	26	Very low	132 Å²	132	131.2 Å²	131.2	86%	0.857	71%	0.707	S	S	*	*			cis	-137.9	-178.5	-2.7	43	-26.3	0	0	0	115.5
712	G	24	Very low	25.9	Very low	81 Å²	81	129.3 Å²	129.3	84%	0.835	70%	0.697	S	S	*	*			trans	153.2	149.5	155.8	0	0	0	0	0	117.7
713	K	27.3	Very low	25.6	Very low	205 Å²	205	131.1 Å²	131.1	89%	0.891	69%	0.694	S	S	*	*			trans	-90.8	163.8	176.9	-64.9	175.5	178.2	175.3	0	112.4
714	L	24.5	Very low	25.5	Very low	154 Å²	154	130.4 Å²	130.4	81%	0.806	69%	0.691	S	S	*	*			trans	75.3	155	152.5	-109.2	159.6	0	0	0	118.1
715	S	21.9	Very low	25.8	Very low	62 Å²	62	131.9 Å²	131.9	43%	0.434	70%	0.698	S	S	.	*			trans	72.1	170.5	168	83.5	0	0	0	0	118.8
716	T	22.1	Very low	25.8	Very low	95 Å²	95	132.9 Å²	132.9	58%	0.583	70%	0.703	S	S	*	*			trans	71.8	127.4	172.9	53.8	0	0	0	0	117.8	V1752	T716-V1752 HydrophobicContact CG2-CG2 3.47Å; T716-V1752 VanDerWaalsContact CG2-CG2 3.47Å
717	L	21.2	Very low	25.7	Very low	126 Å²	126	130 Å²	130	66%	0.66	71%	0.708	S	S	*	*				73.6	121.1	58.6	-77.6	165.8	0	0	0	111.7
718	S	21.4	Very low	25.5	Very low	76 Å²	76	126.7 Å²	126.7	53%	0.531	71%	0.707	S	S	.	*				67.3	148.9	99.5	88.9	0	0	0	0	114
719	E	22.1	Very low	25.5	Very low	146 Å²	146	128.6 Å²	128.6	68%	0.682	72%	0.715	S	S	*	*			cis	-156.2	-155.7	-1.6	-140.2	-165.6	153.6	0	0	110.9
720	Q	22.8	Very low	25.4	Very low	114 Å²	114	126 Å²	126	53%	0.533	71%	0.707	S	S	.	*			trans	-23.3	154.8	156.4	-58.1	174	49	0	0	115.7
721	Y	24	Very low	25.5	Very low	141 Å²	141	127.3 Å²	127.3	55%	0.553	71%	0.706	S	S	*	*				-167.9	129.2	80.3	-110.2	-112.5	0	0	0	114.5
722	K	25.3	Very low	25.2	Very low	105 Å²	105	127 Å²	127	46%	0.457	70%	0.702	S	S	.	*				44.1	141.8	128.6	-63.3	-173.4	-165.7	157.5	0	121.2
723	R	23.9	Very low	25.3	Very low	181 Å²	181	131.9 Å²	131.9	68%	0.683	71%	0.705	S	S	*	*			cis	-179.3	155.8	-10.3	-122.6	173.1	179.8	-159.7	2.6	110.9
724	H	28.7	Very low	25.5	Very low	152 Å²	152	126.9 Å²	126.9	70%	0.704	69%	0.693	S	S	*	*			trans	64.4	165	159	-53	-40.7	0	0	0	116.8
725	P	35.8	Very low	25.4	Very low	130 Å²	130	125.3 Å²	125.3	84%	0.844	69%	0.691	S	S	*	*			cis	-112.5	-168.5	-10.2	41.9	-30.4	0	0	0	113.7
726	L	26.9	Very low	25.5	Very low	169 Å²	169	129.4 Å²	129.4	89%	0.885	71%	0.707	S	S	*	*			trans	-74.9	132.6	-170.5	-60.6	152.3	0	0	0	115.1
727	V	26.9	Very low	26.2	Very low	153 Å²	153	131.6 Å²	131.6	93%	0.927	71%	0.714	S	S	*	*			trans	-137.2	144.2	131.1	179.9	0	0	0	0	106.5
728	G	25.1	Very low	26.7	Very low	65 Å²	65	131 Å²	131	67%	0.67	72%	0.718	S	S	*	*			trans	-111.4	164.6	-173.5	0	0	0	0	0	114.5
729	T	29	Very low	26.7	Very low	140 Å²	140	135.1 Å²	135.1	86%	0.859	73%	0.729	S	S	*	*			trans	-148.2	133.1	158.5	6.6	0	0	0	0	109.5
730	P	26.5	Very low	27	Very low	105 Å²	105	132.8 Å²	132.8	68%	0.682	73%	0.726	S	S	*	*			trans	-89.4	-169.4	169.1	38	-35.2	0	0	0	110.9
731	N	24.3	Very low	27	Very low	141 Å²	141	136 Å²	136	75%	0.754	74%	0.739	S	S	*	*			trans	88.9	122	153.4	-66.2	-16.3	0	0	0	120.7
732	V	25	Very low	27	Very low	127 Å²	127	137.4 Å²	137.4	77%	0.77	75%	0.75	S	S	*	*				67.1	100.3	128.9	-177.8	0	0	0	0	118.3
733	M	26.7	Very low	27	Very low	182 Å²	182	140.9 Å²	140.9	90%	0.897	77%	0.768	S	S	*	*				-158.3	152.1	125.2	-118.7	-173.4	170.3	0	0	110.8
734	P	31.2	Very low	27.1	Very low	100 Å²	100	137.4 Å²	137.4	65%	0.649	77%	0.77	S	S	*	*				-127.8	170.1	-73.1	39.5	-30.1	0	0	0	115.1
735	T	23.8	Very low	27.1	Very low	122 Å²	122	137.7 Å²	137.7	75%	0.748	78%	0.775	S	S	*	*			trans	-55.2	153	155.7	16.5	0	0	0	0	113.4
736	L	23.1	Very low	26.7	Very low	147 Å²	147	139 Å²	139	77%	0.77	76%	0.763	S	S	*	*	S	Bend	trans	65.8	106.1	152	-63.9	163.4	0	0	0	118.7
737	L	37.1	Very low	26.7	Very low	141 Å²	141	135 Å²	135	74%	0.738	75%	0.746	S	S	*	*			trans	33.7	93.4	134.6	-77.2	162	0	0	0	119.1
738	P	30.3	Very low	26.5	Very low	114 Å²	114	135 Å²	135	74%	0.74	73%	0.733	S	S	*	*				-63.9	134.3	119.3	32.7	-30.9	0	0	0	108.5
739	Q	22.6	Very low	26.5	Very low	163 Å²	163	139.7 Å²	139.7	76%	0.762	74%	0.736	S	S	*	*			cis	61.2	155.6	19.6	-58.9	-151.7	15.9	0	0	114.9
740	P	27.9	Very low	26.3	Very low	97 Å²	97	138.6 Å²	138.6	63%	0.63	73%	0.729	S	S	*	*				-138.8	141.1	-58.8	36.8	-21.2	0	0	0	113.9
741	K	22.1	Very low	26.2	Very low	182 Å²	182	139 Å²	139	79%	0.791	73%	0.729	S	S	*	*			trans	61.7	153.4	156.3	-58	175.7	176.7	-177.8	0	118.9
742	Q	25	Very low	26.1	Very low	169 Å²	169	138.6 Å²	138.6	79%	0.79	73%	0.727	S	S	*	*			trans	66	135.5	156.5	-70.2	153	-78.6	0	0	115.3
743	E	25.2	Very low	26.2	Very low	179 Å²	179	138.3 Å²	138.3	84%	0.836	73%	0.726	S	S	*	*			cis	-129.5	169	3.2	-53.8	175.6	127.4	0	0	108.6
744	C	25.8	Very low	26.1	Very low	107 Å²	107	134.4 Å²	134.4	72%	0.723	71%	0.709	S	S	*	*			cis	-152.3	161.5	3.3	-155.5	0	0	0	0	109.3
745	I	28.9	Very low	26	Very low	158 Å²	158	135.7 Å²	135.7	81%	0.81	71%	0.709	S	S	*	*			trans	67	124.4	171.2	-49.4	169	0	0	0	114.6
746	R	27.2	Very low	26	Very low	159 Å²	159	132.6 Å²	132.6	60%	0.6	69%	0.692	S	S	*	*			cis	-145.1	-170.7	-10.3	-142.2	-169.4	177.7	178.6	-1.6	110.2	D913	R746-D913 IonicContact NH1-OD2 2.77Å; R746-D913 PolarHBondContact NH1-OD2 2.81Å
747	T	26.4	Very low	26.2	Very low	83 Å²	83	128.8 Å²	128.8	51%	0.509	67%	0.672	S	S	.	*			trans	-54.4	157.5	174.1	39.9	0	0	0	0	114.7
748	K	23.5	Very low	25.9	Very low	153 Å²	153	128.1 Å²	128.1	67%	0.665	67%	0.665	S	S	*	*			cis	97.1	127.4	31.1	-126.5	-179.4	173.8	-164.4	0	113.7
749	F	25.2	Very low	25.6	Very low	165 Å²	165	132.8 Å²	132.8	72%	0.724	67%	0.668	S	S	*	*			trans	105.1	134.9	143.6	-78.3	-49.5	0	0	0	124.5
750	T	23.9	Very low	25.9	Very low	117 Å²	117	130.9 Å²	130.9	72%	0.718	67%	0.672	S	S	*	*			trans	75.6	117.2	138.2	48.9	0	0	0	0	125.8
751	V	24.7	Very low	25.9	Very low	114 Å²	114	134 Å²	134	69%	0.691	68%	0.679	S	S	*	*				85.4	100.7	118.6	175.8	0	0	0	0	121.5
752	D	22.2	Very low	26	Very low	131 Å²	131	133.7 Å²	133.7	70%	0.701	69%	0.686	S	S	*	*				56.1	152.2	119.9	-48.4	-35.9	0	0	0	126.3
753	T	26.9	Very low	26.1	Very low	122 Å²	122	130.8 Å²	130.8	75%	0.748	68%	0.679	S	S	*	*			trans	79.5	139.5	161.7	76	0	0	0	0	118
754	N	25.2	Very low	26	Very low	100 Å²	100	127.9 Å²	127.9	54%	0.535	68%	0.679	S	S	.	*			cis	-163.3	-168.4	-24.7	-111.7	-28.3	0	0	0	109.2	L898	N754-L898 PolarHBondContact OD1-O 2.83Å
755	I	28.6	Very low	26.1	Very low	127 Å²	127	130.2 Å²	130.2	65%	0.651	68%	0.681	S	S	*	*			trans	82.9	138.3	164.3	-61.2	-177.5	0	0	0	113.7	S899 M900 N901	I755-S899 WeakPolarHBondContact CA-O 3.42Å; I755-M900 CarbonylContact C-O 3.55Å; I755-M900 VanDerWaalsContact CA-O 3.26Å; I755-M900 WeakPolarHBondContact CA-O 3.37Å; I755-M900 WeakPolarHBondContact CB-O 3.03Å; I755-M900 WeakPolarHBondContact CG2-O 3.24Å; I755-N901 WeakPolarHBondContact CG2-O 3.38Å
756	S	24	Very low	26.1	Very low	57 Å²	57	127.8 Å²	127.8	40%	0.399	68%	0.676	S	S	.	*	B	Isolated β-bridge		-160.5	-132.8	-129.5	-42.1	0	0	0	0	119.6	M900 N901 K902	S756-M900 PolarHBondContact N-O 2.92Å; S756-N901 VanDerWaalsContact C-N 3.29Å; S756-N901 CarbonylContact O-C 2.73Å; S756-N901 VanDerWaalsContact O-CA 3.25Å; S756-N901 WeakPolarHBondContact O-CA 3.03Å; S756-N901 PolarHBondContact O-N 2.92Å; S756-K902 PolarHBondContact O-N 2.85Å
757	D	28.4	Very low	26.1	Very low	66 Å²	66	128.4 Å²	128.4	35%	0.353	69%	0.69	S	S	.	*			trans	85.7	138.9	166.4	-89.3	-25.5	0	0	0	127.8	M900 N901	D757-M900 VanDerWaalsContact CG-CA 3.48Å; D757-M900 WeakPolarHBondContact OD2-CA 3.49Å; D757-M900 WeakPolarHBondContact OD2-CB 3.36Å; D757-M900 VanDerWaalsContact OD2-CG 3.25Å; D757-M900 WeakPolarHBondContact OD2-CG 3.36Å; D757-N901 PolarHBondContact OD2-N 2.7Å; D757-N901 PolarHBondContact OD2-ND2 3.36Å
758	H	29.9	Very low	26.1	Very low	127 Å²	127	133.2 Å²	133.2	59%	0.588	70%	0.704	S	S	*	*			trans	71.7	86.8	136.1	-76.8	28.2	0	0	0	121.9
759	R	24.4	Very low	26.3	Very low	213 Å²	213	134.6 Å²	134.6	80%	0.804	71%	0.71	S	S	*	*				61.4	89.6	102.1	-170.8	-170.2	-173.3	174.1	2.1	117.5
760	S	28.4	Very low	26.4	Very low	122 Å²	122	137 Å²	137	85%	0.853	71%	0.714	S	S	*	*			trans	-130.8	164.6	137.3	72.1	0	0	0	0	110.2
761	Q	29.1	Very low	26.6	Very low	164 Å²	164	137 Å²	137	77%	0.766	71%	0.709	S	S	*	*			trans	-102.6	123.7	-161	-70.5	-177.2	-32.1	0	0	114.3	T763	Q761-T763 PolarHBondContact O-N 3.45Å; Q761-T763 VanDerWaalsContact O-N 3.16Å
762	N	22.7	Very low	26.7	Very low	175 Å²	175	138 Å²	138	94%	0.936	71%	0.709	S	S	*	*			trans	-68.7	102.3	158.3	-93.7	-39.1	0	0	0	110.2
763	T	27.8	Very low	27	Very low	107 Å²	107	139.4 Å²	139.4	66%	0.656	71%	0.711	S	S	*	*			trans	-120.1	84.2	163.2	57.5	0	0	0	0	111.1	Q761 M765	Q761-T763 PolarHBondContact O-N 3.45Å; Q761-T763 VanDerWaalsContact O-N 3.16Å; T763-M765 PolarHBondContact O-N 3.36Å
764	S	23.6	Very low	26.9	Very low	119 Å²	119	144.8 Å²	144.8	83%	0.832	72%	0.718	S	S	*	*			trans	-56.5	123.4	158.5	175.3	0	0	0	0	109.6
765	M	26.7	Very low	26.9	Very low	155 Å²	155	150 Å²	150	76%	0.764	73%	0.732	S	S	*	*			trans	-142.6	126.9	175.6	-94.2	-77.2	105.6	0	0	108.8	T763 L767	T763-M765 PolarHBondContact O-N 3.36Å; M765-L767 PolarHBondContact O-N 2.87Å
766	P	29.4	Very low	26.7	Very low	107 Å²	107	152.9 Å²	152.9	70%	0.695	74%	0.742	S	S	*	*			trans	-74.5	127.9	-171.1	28.4	-34.2	0	0	0	112.3	K768	P766-K768 PolarHBondContact O-N 2.85Å
767	L	27	Very low	26.7	Very low	172 Å²	172	154.6 Å²	154.6	90%	0.901	76%	0.76	S	S	*	*			trans	-71.9	65.5	176.8	-71.9	171.4	0	0	0	112.6	M765	M765-L767 PolarHBondContact O-N 2.87Å
768	K	26.8	Very low	26.5	Very low	185 Å²	185	158.6 Å²	158.6	80%	0.804	78%	0.782	S	S	*	*			trans	-118.9	20.8	178.2	-147.6	165	-173.3	169.1	0	114	P766	P766-K768 PolarHBondContact O-N 2.85Å
769	K	27.2	Very low	26.4	Very low	181 Å²	181	164.2 Å²	164.2	79%	0.787	80%	0.798	S	S	*	*	S	Bend	trans	-141.8	47.2	179.4	-79.2	-161.8	169.7	-168.7	0	114.1
770	R	27.3	Very low	26.6	Very low	216 Å²	216	158.9 Å²	158.9	82%	0.815	79%	0.788	S	S	*	*	S	Bend	trans	-128.8	-10.9	166.7	-96.9	-174	173.5	173.4	-2	117
771	L	27.5	Very low	26.5	Very low	118 Å²	118	160.6 Å²	160.6	62%	0.618	79%	0.788	S	S	*	*	S	Bend	trans	-92.7	-25.7	164.3	-110.1	70.8	0	0	0	113.6	Q773 E2123	L771-Q773 PolarHBondContact O-N 2.89Å; L771-E2123 WeakPolarHBondContact CD2-O 3.47Å
772	I	27.4	Very low	26.4	Very low	133 Å²	133	160 Å²	160	68%	0.682	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	63.5	169.9	-48.2	-179.5	0	0	0	109.5
773	Q	28	Very low	26.5	Very low	161 Å²	161	161.1 Å²	161.1	75%	0.752	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.2	19.2	167.1	-144.4	170.6	11.2	0	0	112.5	L771	L771-Q773 PolarHBondContact O-N 2.89Å
774	R	26.3	Very low	26.5	Very low	236 Å²	236	161.7 Å²	161.7	89%	0.891	79%	0.789	S	S	*	*	S	Bend	trans	-112.3	-8.4	172.4	-75.9	-176.8	170.9	174.3	-2.5	114.4
775	Y	24.9	Very low	26.7	Very low	208 Å²	208	160.5 Å²	160.5	82%	0.816	78%	0.781	S	S	*	*	S	Bend	trans	-145.4	61.2	-176.9	-84.9	-75.4	0	0	0	113.1
776	E	24	Very low	26.6	Very low	188 Å²	188	161.5 Å²	161.5	88%	0.879	78%	0.784	S	S	*	*	S	Bend	trans	-160.1	56	160.8	-126.3	171	-146.1	0	0	113.7
777	A	24	Very low	26.5	Very low	93 Å²	93	164.8 Å²	164.8	77%	0.769	79%	0.794	S	S	*	*			trans	-148.7	147.1	163.7	0	0	0	0	0	110.6
778	D	24.7	Very low	26.4	Very low	151 Å²	151	161.1 Å²	161.1	81%	0.807	78%	0.783	S	S	*	*			trans	71	69.6	172.7	-64.6	-6.2	0	0	0	119.9
779	R	27.4	Very low	26.5	Very low	245 Å²	245	159 Å²	159	93%	0.925	79%	0.786	S	S	*	*				-156.9	92.7	128.1	-106.3	161.6	-168	-177.3	5.4	109.7
780	V	27.9	Very low	26.3	Very low	100 Å²	100	155.3 Å²	155.3	61%	0.606	78%	0.782	S	S	*	*				91.6	106	74.7	163.7	0	0	0	0	112	M782	V780-M782 HydrophobicContact CG1-CE 3.92Å; V780-M782 HydrophobicContact CG1-CG 4.29Å
781	D	26.6	Very low	26.4	Very low	159 Å²	159	151.9 Å²	151.9	85%	0.85	78%	0.779	S	S	*	*			trans	-131.9	111.6	139	-89.1	-47.4	0	0	0	105.4
782	M	26.7	Very low	26.2	Very low	152 Å²	152	153 Å²	153	75%	0.749	79%	0.786	S	S	*	*				67.8	91.4	79.4	-67	-64.5	157.5	0	0	113.1	V780	V780-M782 HydrophobicContact CG1-CE 3.92Å; V780-M782 HydrophobicContact CG1-CG 4.29Å
783	K	24.7	Very low	26.1	Very low	197 Å²	197	152.4 Å²	152.4	86%	0.857	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-72.9	148.1	164	-70.6	-176.7	177.9	-179.1	0	110.5
784	P	29.4	Very low	25.9	Very low	120 Å²	120	153.1 Å²	153.1	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-92.2	134.2	144.6	-5.8	25.2	0	0	0	111.2
785	S	26.2	Very low	25.8	Very low	94 Å²	94	146.7 Å²	146.7	66%	0.657	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-71.7	170.1	142.8	37.2	0	0	0	0	109.4
786	E	25.5	Very low	25.7	Very low	176 Å²	176	145.1 Å²	145.1	82%	0.822	78%	0.775	S	S	*	*			cis	-160.7	155.5	-4	-120.4	148.3	-124.4	0	0	107.3
787	L	27.6	Very low	26.4	Very low	175 Å²	175	144 Å²	144	92%	0.916	78%	0.775	S	S	*	*			trans	-171	131.2	143	-111.4	161.4	0	0	0	110.2
788	S	24.2	Very low	26.5	Very low	95 Å²	95	145 Å²	145	66%	0.664	77%	0.774	S	S	*	*			trans	-106.2	150.3	-177.7	57.1	0	0	0	0	112.2
789	T	28.3	Very low	26.5	Very low	142 Å²	142	145.2 Å²	145.2	87%	0.871	77%	0.771	S	S	*	*			trans	-139.9	143.4	135	-33	0	0	0	0	108.8
790	C	23.9	Very low	26.2	Very low	102 Å²	102	138 Å²	138	69%	0.689	75%	0.751	S	S	*	*			trans	-92.1	-169	179.6	-61	0	0	0	0	111.6
791	N	29	Very low	26.3	Very low	144 Å²	144	137.2 Å²	137.2	77%	0.77	74%	0.743	S	S	*	*			trans	94.6	142.6	161.8	-56.5	-3	0	0	0	117.1
792	L	24.3	Very low	26.1	Very low	143 Å²	143	132.5 Å²	132.5	75%	0.749	72%	0.723	S	S	*	*			cis	-167	163.2	-33.2	-144.5	71.4	0	0	0	108.2
793	V	24.3	Very low	26.2	Very low	119 Å²	119	133.3 Å²	133.3	72%	0.721	73%	0.725	S	S	*	*			trans	72.1	153.7	153.8	162.5	0	0	0	0	119
794	K	23.6	Very low	26.3	Very low	177 Å²	177	131.2 Å²	131.2	77%	0.77	72%	0.723	S	S	*	*			trans	-30.6	170.7	165.3	-46.6	175	-178.4	-178.4	0	116.4
795	T	23.7	Very low	26.1	Very low	100 Å²	100	136.1 Å²	136.1	61%	0.613	73%	0.726	S	S	*	*			cis	-157.8	170.9	23.3	-25.6	0	0	0	0	112.5
796	E	24.7	Very low	26	Very low	175 Å²	175	136.1 Å²	136.1	82%	0.818	73%	0.726	S	S	*	*			trans	61.9	131.7	149.6	-85.5	140.2	-130.6	0	0	122.2
797	L	36.7	Very low	26	Very low	165 Å²	165	133.1 Å²	133.1	86%	0.864	72%	0.72	S	S	*	*			trans	-80.2	161.3	154.2	-62.3	164.2	0	0	0	108.4
798	P	27.6	Very low	26.1	Very low	115 Å²	115	132.1 Å²	132.1	75%	0.747	72%	0.715	S	S	*	*				-148.4	149.8	94.3	38.1	-21.7	0	0	0	116.6
799	M	23.3	Very low	26.3	Very low	154 Å²	154	131.1 Å²	131.1	76%	0.759	71%	0.713	S	S	*	*				50.9	132.4	127.4	-53.7	-72.1	-82.2	0	0	122.5
800	D	21.8	Very low	26.3	Very low	94 Å²	94	130.9 Å²	130.9	50%	0.503	71%	0.706	S	S	.	*				102.6	132.4	118.3	-91.6	20.3	0	0	0	125.8
801	N	29.3	Very low	26.7	Very low	83 Å²	83	131.5 Å²	131.5	44%	0.444	70%	0.703	S	S	.	*			trans	70	149.6	142.6	-70.4	-43.8	0	0	0	120.4	S967	N801-S967 WeakPolarHBondContact ND2-CA 3.27Å; N801-S967 PolarHBondContact ND2-N 2.92Å
802	S	23.8	Very low	26.6	Very low	60 Å²	60	131.1 Å²	131.1	42%	0.42	70%	0.7	S	S	.	*			cis	-171.1	174.4	-15	45.7	0	0	0	0	109.7
803	H	29.2	Very low	26.7	Very low	170 Å²	170	132.7 Å²	132.7	79%	0.787	70%	0.701	S	S	*	*			trans	65.6	127.7	171.8	-40.7	-64.7	0	0	0	116
804	N	25.3	Very low	26.8	Very low	153 Å²	153	133.8 Å²	133.8	82%	0.818	70%	0.703	S	S	*	*			cis	78.7	113.3	10.7	-140.5	11.4	0	0	0	117.3
805	R	25.3	Very low	27.1	Very low	222 Å²	222	133.6 Å²	133.6	84%	0.838	70%	0.702	S	S	*	*			trans	56.6	119.2	165.6	-105.9	-177.1	174.5	169.1	-2.8	121.7
806	S	23.9	Very low	27.1	Very low	94 Å²	94	136.5 Å²	136.5	66%	0.657	71%	0.708	S	S	*	*				46.7	141.3	127.8	65.2	0	0	0	0	120.6
807	T	27.2	Very low	27.3	Very low	113 Å²	113	138.6 Å²	138.6	69%	0.693	71%	0.71	S	S	*	*				-165.8	161.4	51.3	39.4	0	0	0	0	112.8
808	N	28.4	Very low	26.6	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	70%	0.7	S	S	*	*			trans	65.9	143.7	156.2	-58.7	2.4	0	0	0	118.4
809	A	29.2	Very low	27	Very low	74 Å²	74	134.9 Å²	134.9	61%	0.612	70%	0.698	S	S	*	*			cis	-159.2	149	-14.5	0	0	0	0	0	109.7
810	D	28.4	Very low	27.4	Very low	136 Å²	136	136.1 Å²	136.1	73%	0.727	70%	0.702	S	S	*	*				34.5	149.3	125.2	-39.4	-35.8	0	0	0	120.4
811	D	32	Very low	27.9	Very low	116 Å²	116	136.7 Å²	136.7	62%	0.62	71%	0.713	S	S	*	*			cis	-139	164.6	2.6	-115	-11.7	0	0	0	108.3
812	L	25.9	Very low	27.9	Very low	135 Å²	135	143.6 Å²	143.6	71%	0.707	73%	0.733	S	S	*	*			cis	84.1	145.6	34.7	-122.9	173.3	0	0	0	114.3
813	K	28.2	Very low	28.2	Very low	177 Å²	177	147.5 Å²	147.5	77%	0.77	75%	0.748	S	S	*	*			trans	66.5	161	177.3	-59.3	171.8	-175.4	168.7	0	116.7
814	N	25.7	Very low	28.5	Very low	142 Å²	142	143.5 Å²	143.5	76%	0.759	74%	0.744	S	S	*	*			cis	-160	-179.8	-48.4	-154.5	-9.7	0	0	0	109.9
815	K	30.1	Very low	28.9	Very low	172 Å²	172	143.5 Å²	143.5	75%	0.748	74%	0.741	S	S	*	*			trans	67	116.4	167.3	-60.5	175.3	-178.9	-179.8	0	115.2
816	Q	23.4	Very low	29.5	Very low	161 Å²	161	139 Å²	139	75%	0.752	73%	0.728	S	S	*	*				65.1	114.6	76.3	-71.1	-179.2	-33.2	0	0	115.5
817	Y	27.9	Very low	30	Very low	219 Å²	219	138.9 Å²	138.9	86%	0.859	72%	0.72	S	S	*	*				-172.8	-174.6	105	-113.2	-91.8	0	0	0	113.1
818	S	23.7	Very low	30.3	Very low	93 Å²	93	139.8 Å²	139.8	65%	0.65	72%	0.72	S	S	*	*			trans	-99	-170.6	-164.3	62	0	0	0	0	113.5
819	P	35.1	Very low	30.4	Very low	109 Å²	109	139 Å²	139	71%	0.708	72%	0.721	S	S	*	*			cis	-146	-171.9	14.8	40.4	-16.4	0	0	0	119.3
820	E	31.4	Very low	30.5	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	73%	0.731	S	S	*	*			trans	71.3	139	164.4	-54	-150.3	127.7	0	0	119.5
821	S	32.2	Very low	30.6	Very low	106 Å²	106	144.1 Å²	144.1	74%	0.741	73%	0.731	S	S	*	*			cis	-142.2	143.2	0.8	55.4	0	0	0	0	114.6
822	R	30.1	Very low	30.5	Very low	228 Å²	228	148.3 Å²	148.3	86%	0.86	74%	0.744	S	S	*	*			trans	20.5	129.5	147.4	-66.8	178.4	-172.5	-172	3.2	119.4
823	I	30	Very low	30.7	Very low	143 Å²	143	149 Å²	149	73%	0.733	75%	0.747	S	S	*	*			cis	-151.9	105.7	7.6	-82.5	140.6	0	0	0	106.6
824	A	35.1	Very low	30.5	Very low	85 Å²	85	147.8 Å²	147.8	70%	0.702	75%	0.749	S	S	*	*				65.9	133.5	90.7	0	0	0	0	0	116.4
825	M	34.4	Very low	30.9	Very low	154 Å²	154	146.3 Å²	146.3	76%	0.759	75%	0.749	S	S	*	*			cis	-167.9	-179.4	-4	-98.1	179	-179.8	0	0	105.9	N879	M825-N879 PolarHBondContact O-ND2 3.07Å
826	K	37.6	Very low	30.8	Very low	127 Å²	127	146.4 Å²	146.4	55%	0.552	75%	0.752	S	S	*	*			cis	-165.5	178	-13.1	-108.7	177.3	153.3	-74.9	0	104.6	N879	K826-N879 PolarHBondContact O-ND2 2.86Å
827	D	35	Very low	30.9	Very low	92 Å²	92	144.9 Å²	144.9	49%	0.492	75%	0.745	S	S	.	*			cis	-163.3	169.2	-2	-106.8	-20.1	0	0	0	107.4
828	N	31.5	Very low	31	Very low	132 Å²	132	144.3 Å²	144.3	71%	0.706	74%	0.741	S	S	*	*			cis	80.4	105.3	19.8	-42.1	-39.4	0	0	0	116.6
829	V	31.3	Very low	32	Very low	138 Å²	138	149 Å²	149	84%	0.836	75%	0.75	S	S	*	*			cis	78.4	119.1	-7	-171.2	0	0	0	0	119.1
830	I	32.3	Very low	31.7	Very low	160 Å²	160	153.8 Å²	153.8	82%	0.821	76%	0.76	S	S	*	*			trans	-162.7	169.3	159.2	-109.7	164.8	0	0	0	113.6
831	E	30.1	Very low	31.7	Very low	158 Å²	158	154.2 Å²	154.2	74%	0.738	76%	0.759	S	S	*	*			trans	-50.1	159.7	-162.4	-60.2	159.2	152.3	0	0	123.8
832	K	29.1	Very low	31.7	Very low	204 Å²	204	160.9 Å²	160.9	89%	0.887	77%	0.768	S	S	*	*				-129.6	142.4	128.8	-107.8	-171.8	179.5	-177.9	0	109
833	L	31	Very low	31.9	Very low	148 Å²	148	159.9 Å²	159.9	78%	0.775	77%	0.77	S	S	*	*	S	Bend	trans	-77.4	159.3	176.1	-72.7	158	0	0	0	111.6
834	D	24.2	Very low	32	Very low	152 Å²	152	162.4 Å²	162.4	81%	0.813	78%	0.775	S	S	*	*	S	Bend	cis	-123.3	111.9	-0.9	-162.8	-0.9	0	0	0	109.7
835	C	32.7	Very low	31.7	Very low	112 Å²	112	167.5 Å²	167.5	76%	0.757	78%	0.777	S	S	*	*			trans	-159.1	-179.3	-171.7	-158.8	0	0	0	0	111.5
836	Q	27.5	Very low	31.5	Very low	173 Å²	173	165.7 Å²	165.7	81%	0.808	77%	0.774	S	S	*	*			trans	-66	168.3	-164.5	-56.5	-175.2	5.4	0	0	116.1
837	E	26.1	Very low	31.4	Very low	130 Å²	130	166 Å²	166	61%	0.607	78%	0.775	S	S	*	*			trans	126.1	148.7	147	-62.7	-144.2	150.6	0	0	115.2
838	R	31.4	Very low	31.1	Very low	206 Å²	206	170.7 Å²	170.7	78%	0.777	79%	0.788	S	S	*	*			cis	-154.3	179.9	-10.5	-122.2	179.5	-166	149.6	3.5	113.1
839	K	44.3	Very low	30.9	Very low	192 Å²	192	169.9 Å²	169.9	84%	0.835	78%	0.78	S	S	*	*			trans	-91.1	166.4	-179.4	-53.7	158.9	-176.6	169.8	0	112.7
840	F	28	Very low	31.4	Very low	209 Å²	209	170.2 Å²	170.2	92%	0.917	78%	0.782	S	S	*	*			trans	-129.6	174.5	160.1	-107.5	-83.7	0	0	0	115.9
841	K	32.3	Very low	31.3	Very low	189 Å²	189	170.9 Å²	170.9	82%	0.822	79%	0.787	S	S	*	*				-166.3	148.6	-127.2	-161.8	178.5	-171.9	179.1	0	113.7
842	R	31.6	Very low	31.3	Very low	247 Å²	247	166.3 Å²	166.3	93%	0.932	78%	0.783	S	S	*	*			trans	-165.6	169.1	172.1	-114.9	166.9	-179.9	153.6	-0.1	116.2
843	K	33.4	Very low	31.1	Very low	206 Å²	206	165.4 Å²	165.4	90%	0.896	78%	0.784	S	S	*	*			trans	-174.3	179.8	171.3	-104	155	-172.9	175	0	110.2
844	K	32.4	Very low	30.9	Very low	196 Å²	196	162.9 Å²	162.9	85%	0.852	78%	0.779	S	S	*	*			cis	-129.1	-135.3	18.7	-148.6	-164.1	173	-179.6	0	112
845	R	30.2	Very low	31.2	Very low	193 Å²	193	160.5 Å²	160.5	73%	0.728	77%	0.774	S	S	*	*			cis	-109.7	-86.1	5.3	179.2	-165.3	158.4	-166.6	-5.8	112.9
846	T	29.6	Very low	30.9	Very low	116 Å²	116	161.7 Å²	161.7	71%	0.712	77%	0.772	S	S	*	*			cis	-157.4	138.1	-21.2	-42.8	0	0	0	0	106.7
847	K	35.7	Very low	30.9	Very low	132 Å²	132	160.5 Å²	160.5	57%	0.574	77%	0.771	S	S	*	*			trans	-170.4	174.7	177.4	-129.1	-153.6	175.3	-157	0	118.5	E849	K847-E849 VanDerWaalsContact CD-OE1 3.31Å; K847-E849 WeakPolarHBondContact CD-OE1 3.39Å; K847-E849 WeakPolarHBondContact CE-OE1 3.38Å; K847-E849 WeakPolarHBondContact CE-OE2 3.11Å; K847-E849 IonicContact NZ-OE1 2.62Å; K847-E849 PolarHBondContact NZ-OE1 3.05Å; K847-E849 VanDerWaalsContact NZ-OE1 3.16Å; K847-E849 IonicContact NZ-OE2 3.97Å; K847-E849 PolarHBondContact NZ-OE2 2.93Å
848	Y	27.6	Very low	31	Very low	192 Å²	192	159.7 Å²	159.7	75%	0.753	78%	0.775	S	S	*	*			trans	89.3	138.5	166.4	-52.3	-74.3	0	0	0	117.9
849	E	28.2	Very low	31.2	Very low	115 Å²	115	157.8 Å²	157.8	54%	0.537	78%	0.781	S	S	.	*			cis	-172.3	150	-40.2	-132.4	95.8	-84.6	0	0	110.1	K847	K847-E849 VanDerWaalsContact CD-OE1 3.31Å; K847-E849 WeakPolarHBondContact CD-OE1 3.39Å; K847-E849 WeakPolarHBondContact CE-OE1 3.38Å; K847-E849 WeakPolarHBondContact CE-OE2 3.11Å; K847-E849 IonicContact NZ-OE1 2.62Å; K847-E849 PolarHBondContact NZ-OE1 3.05Å; K847-E849 VanDerWaalsContact NZ-OE1 3.16Å; K847-E849 IonicContact NZ-OE2 3.97Å; K847-E849 PolarHBondContact NZ-OE2 2.93Å
850	T	40.7	Very low	30.3	Very low	145 Å²	145	157.1 Å²	157.1	89%	0.89	78%	0.778	S	S	*	*			trans	-152.6	94.9	171.3	-18.5	0	0	0	0	114.3
851	D	30.1	Very low	30.6	Very low	173 Å²	173	154.5 Å²	154.5	93%	0.925	77%	0.774	S	S	*	*			trans	-162.3	132.5	161.8	-116.9	-32.4	0	0	0	105.4
852	G	30.3	Very low	30.3	Very low	63 Å²	63	154.9 Å²	154.9	65%	0.649	78%	0.775	S	S	*	*			trans	-129.3	141.4	-163.5	0	0	0	0	0	114.3
853	M	26	Very low	30.5	Very low	185 Å²	185	148 Å²	148	91%	0.911	76%	0.763	S	S	*	*				73.9	140.9	69.2	-70.2	171.1	57.3	0	0	112.5
854	S	27.2	Very low	30.2	Very low	94 Å²	94	144.1 Å²	144.1	66%	0.657	76%	0.756	S	S	*	*			cis	-129.1	-162.8	23.1	58.3	0	0	0	0	112.7
855	S	29.5	Very low	29.9	Very low	103 Å²	103	143.4 Å²	143.4	72%	0.72	75%	0.753	S	S	*	*			cis	-170.6	162.8	14.1	6.1	0	0	0	0	110.1
856	L	26	Very low	30.1	Very low	137 Å²	137	141.9 Å²	141.9	72%	0.717	76%	0.758	S	S	*	*			cis	-173.2	-171.2	-28.6	-124.2	166.2	0	0	0	110.4
857	N	27.6	Very low	30.1	Very low	147 Å²	147	146.9 Å²	146.9	79%	0.786	76%	0.763	S	S	*	*			trans	87.5	160.8	173.7	-63.2	-11.6	0	0	0	115.8
858	T	28.3	Very low	29.7	Very low	113 Å²	113	145.3 Å²	145.3	69%	0.693	77%	0.765	S	S	*	*			trans	-158.4	153.6	-139.7	51.5	0	0	0	0	114.1
859	N	35.4	Very low	29.6	Very low	167 Å²	167	145.2 Å²	145.2	89%	0.893	77%	0.769	S	S	*	*			trans	-141.8	171.9	149.7	-121.1	-29.9	0	0	0	111.3
860	K	26.1	Very low	29.7	Very low	178 Å²	178	144.9 Å²	144.9	77%	0.774	78%	0.779	S	S	*	*			trans	-120.8	161.5	-159.8	-62.5	169.8	-176.2	167.1	0	114.3
861	N	33.5	Very low	29.2	Very low	154 Å²	154	142.7 Å²	142.7	82%	0.824	77%	0.77	S	S	*	*			trans	106.5	121.4	176.9	-57.4	-24.7	0	0	0	113.1
862	K	26.1	Very low	29.4	Very low	197 Å²	197	142 Å²	142	86%	0.857	77%	0.765	S	S	*	*			cis	73.6	144.9	35.3	-73.6	-171.1	174.1	178.3	0	115.2
863	P	36.9	Very low	29.5	Very low	103 Å²	103	144.4 Å²	144.4	67%	0.669	77%	0.772	S	S	*	*			cis	-140.1	-166.4	-28.2	35.9	-14.4	0	0	0	114.2
864	T	26.2	Very low	29.6	Very low	123 Å²	123	140.9 Å²	140.9	76%	0.755	77%	0.765	S	S	*	*			trans	74.2	170.2	172.5	82.4	0	0	0	0	115.5
865	K	27.1	Very low	29.6	Very low	182 Å²	182	142 Å²	142	79%	0.791	76%	0.763	S	S	*	*			cis	-161.2	167.3	1.2	-137	160.6	-175.2	178.1	0	109.2
866	I	32.9	Very low	29.5	Very low	161 Å²	161	147.1 Å²	147.1	83%	0.826	77%	0.767	S	S	*	*			trans	67	171.8	165.1	-119.7	171.8	0	0	0	114.6
867	R	30	Very low	29.6	Very low	220 Å²	220	149.1 Å²	149.1	83%	0.83	77%	0.769	S	S	*	*			cis	-127	-136.3	-0.3	-145.2	170.6	-176.8	164.4	0.7	112.7
868	T	27.2	Very low	29.6	Very low	100 Å²	100	146.9 Å²	146.9	61%	0.613	77%	0.765	S	S	*	*			trans	-154	138.9	-162.2	43.9	0	0	0	0	113.6
869	K	27	Very low	29.8	Very low	190 Å²	190	146.7 Å²	146.7	83%	0.826	76%	0.76	S	S	*	*				62.2	147.5	96.7	-51.9	170.3	-174.8	171.2	0	114.9
870	S	29.3	Very low	29.5	Very low	107 Å²	107	144 Å²	144	75%	0.748	75%	0.754	S	S	*	*			cis	-152.7	151.3	7.6	32.8	0	0	0	0	109.1
871	S	31.1	Very low	29.5	Very low	100 Å²	100	144.7 Å²	144.7	70%	0.699	76%	0.757	S	S	*	*			cis	86.4	115.8	41.1	-51.1	0	0	0	0	116.5
872	L	33	Very low	29.1	Very low	157 Å²	157	141.2 Å²	141.2	82%	0.822	75%	0.745	S	S	*	*	S	Bend	trans	71	142.8	154.3	-71.8	160.3	0	0	0	119.6
873	S	32.9	Very low	29	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	145.3	154.8	44.7	0	0	0	0	110.3	I875	S873-I875 PolarHBondContact O-N 3.45Å
874	S	29.4	Very low	28.6	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.5	118.3	-134.4	-62.4	0	0	0	0	118.6
875	I	27	Very low	28.6	Very low	117 Å²	117	147.8 Å²	147.8	60%	0.6	75%	0.752	S	S	*	*				79	101.6	127	-64.6	176.9	0	0	0	117.9	S873	S873-I875 PolarHBondContact O-N 3.45Å
876	R	26.1	Very low	28.4	Very low	212 Å²	212	145.8 Å²	145.8	80%	0.8	75%	0.749	S	S	*	*			trans	69.1	175.4	141	-56.6	175.9	-176.6	151.7	-6.4	115.4
877	K	27.7	Very low	28	Very low	179 Å²	179	146 Å²	146	78%	0.778	74%	0.744	S	S	*	*			cis	-149.7	-163.1	0.7	-142.5	160.5	-174.9	-175	0	109.7
878	S	28.8	Very low	27.9	Very low	100 Å²	100	141.7 Å²	141.7	70%	0.699	73%	0.733	S	S	*	*			trans	80.4	142.7	163.4	84.9	0	0	0	0	118.3
879	N	33.4	Very low	27.8	Very low	108 Å²	108	141.3 Å²	141.3	58%	0.578	74%	0.735	S	S	*	*			cis	-153.2	-178.6	-11.8	-117.3	-4.2	0	0	0	113.8	M825 K826	M825-N879 PolarHBondContact O-ND2 3.07Å; K826-N879 PolarHBondContact O-ND2 2.86Å
880	S	28.5	Very low	27.8	Very low	111 Å²	111	139.1 Å²	139.1	78%	0.776	73%	0.731	S	S	*	*			trans	82.4	136	-172.7	78	0	0	0	0	114.8
881	K	26.5	Very low	27.7	Very low	192 Å²	192	139.5 Å²	139.5	84%	0.835	73%	0.725	S	S	*	*			cis	-149.6	143.5	7	-139.2	177.3	-175.5	-178	0	113.2
882	S	23.5	Very low	27.8	Very low	82 Å²	82	140 Å²	140	57%	0.573	72%	0.72	S	S	*	*			trans	59.1	130.8	149.5	-66.3	0	0	0	0	122.7
883	T	25.3	Very low	27.6	Very low	131 Å²	131	139.3 Å²	139.3	80%	0.804	72%	0.717	S	S	*	*			trans	57.6	127.9	137.1	62.6	0	0	0	0	118.8
884	R	28.2	Very low	27.5	Very low	224 Å²	224	139.2 Å²	139.2	85%	0.845	71%	0.711	S	S	*	*				-152.3	161.6	52.4	-107.8	179.6	-179.8	167.7	-1.1	113.8
885	R	26.1	Very low	27.4	Very low	205 Å²	205	140.9 Å²	140.9	77%	0.774	71%	0.707	S	S	*	*			trans	13.3	138.9	138.5	-80.5	176.3	162	-173	-3.7	120.5
886	L	23.7	Very low	27.4	Very low	140 Å²	140	139.4 Å²	139.4	73%	0.733	71%	0.707	S	S	*	*				66	143.5	129.5	-65.4	168.3	0	0	0	121.6
887	K	24.4	Very low	27.5	Very low	165 Å²	165	136.3 Å²	136.3	72%	0.717	70%	0.699	S	S	*	*			trans	74.3	135.2	143.2	-95.4	179.7	168.7	-98.4	0	119.4
888	H	27.1	Very low	27.4	Very low	130 Å²	130	134.2 Å²	134.2	60%	0.602	70%	0.696	S	S	*	*			trans	68.6	131.6	158.3	-65.6	-52.8	0	0	0	116.2
889	S	24.7	Very low	27.2	Very low	92 Å²	92	132 Å²	132	64%	0.643	68%	0.681	S	S	*	*				71.5	135.8	59.8	-53.3	0	0	0	0	110.8
890	L	26.3	Very low	26.8	Very low	145 Å²	145	132 Å²	132	76%	0.759	68%	0.678	S	S	*	*			cis	-164.1	177.5	0.1	-119.5	174.9	0	0	0	109
891	N	29.2	Very low	26.6	Very low	114 Å²	114	130.5 Å²	130.5	61%	0.61	66%	0.662	S	S	*	*			trans	64.3	143.3	156.4	-70	44.2	0	0	0	119.6
892	D	31.7	Very low	26.5	Very low	111 Å²	111	128.7 Å²	128.7	59%	0.594	65%	0.654	S	S	*	*			cis	-150.6	134.7	-10.7	-88.3	-27.6	0	0	0	110.4
893	D	29.8	Very low	26.5	Very low	143 Å²	143	131.9 Å²	131.9	77%	0.765	66%	0.66	S	S	*	*				48.2	152.3	121.4	-60.4	0.5	0	0	0	122.2
894	V	31.1	Very low	26.5	Very low	113 Å²	113	132.6 Å²	132.6	69%	0.685	66%	0.658	S	S	*	*			cis	-154.5	136.3	-8.2	121.3	0	0	0	0	105.9
895	E	26.8	Very low	26.1	Very low	145 Å²	145	127.1 Å²	127.1	68%	0.678	65%	0.654	S	S	*	*				55.7	151.8	92	-95.9	-156.3	149.6	0	0	116.7	K897	E895-K897 IonicContact OE1-NZ 3.93Å; E895-K897 PolarHBondContact OE1-NZ 3.44Å
896	S	27.3	Very low	26	Very low	86 Å²	86	122.9 Å²	122.9	60%	0.601	65%	0.651	S	S	*	*			cis	-152.2	145.6	-8.7	89.8	0	0	0	0	110
897	K	27.9	Very low	25.9	Very low	146 Å²	146	124.1 Å²	124.1	64%	0.635	66%	0.655	S	S	*	*				73.1	148	92.6	-66.1	178.5	-172.6	142	0	118.7	E895	E895-K897 IonicContact OE1-NZ 3.93Å; E895-K897 PolarHBondContact OE1-NZ 3.44Å
898	L	24.9	Very low	25.9	Very low	135 Å²	135	124.8 Å²	124.8	71%	0.707	66%	0.658	S	S	*	*			trans	74.7	163.9	161.2	-62.7	144.9	0	0	0	117.3	N754	N754-L898 PolarHBondContact OD1-O 2.83Å
899	S	25.2	Very low	25.8	Very low	55 Å²	55	124.8 Å²	124.8	39%	0.385	66%	0.662	S	S	.	*			cis	-171.8	144.9	-37.4	-167.2	0	0	0	0	113.5	I755	I755-S899 WeakPolarHBondContact CA-O 3.42Å
900	M	24.7	Very low	25.8	Very low	107 Å²	107	127.7 Å²	127.7	53%	0.527	67%	0.665	S	S	.	*			trans	53.9	141	157	-73.2	-169.8	163.9	0	0	123.9	I755 S756 D757	I755-M900 CarbonylContact C-O 3.55Å; I755-M900 VanDerWaalsContact CA-O 3.26Å; I755-M900 WeakPolarHBondContact CA-O 3.37Å; I755-M900 WeakPolarHBondContact CB-O 3.03Å; I755-M900 WeakPolarHBondContact CG2-O 3.24Å; S756-M900 PolarHBondContact N-O 2.92Å; D757-M900 VanDerWaalsContact CG-CA 3.48Å; D757-M900 WeakPolarHBondContact OD2-CA 3.49Å; D757-M900 WeakPolarHBondContact OD2-CB 3.36Å; D757-M900 VanDerWaalsContact OD2-CG 3.25Å; D757-M900 WeakPolarHBondContact OD2-CG 3.36Å
901	N	23.8	Very low	25.9	Very low	80 Å²	80	128.7 Å²	128.7	43%	0.428	66%	0.663	S	S	.	*	B	Isolated β-bridge	trans	60.7	114.9	160.8	-77.7	-72	0	0	0	127.8	I755 S756 D757	I755-N901 WeakPolarHBondContact CG2-O 3.38Å; S756-N901 VanDerWaalsContact C-N 3.29Å; S756-N901 CarbonylContact O-C 2.73Å; S756-N901 VanDerWaalsContact O-CA 3.25Å; S756-N901 WeakPolarHBondContact O-CA 3.03Å; S756-N901 PolarHBondContact O-N 2.92Å; D757-N901 PolarHBondContact OD2-N 2.7Å; D757-N901 PolarHBondContact OD2-ND2 3.36Å
902	K	25.7	Very low	25.7	Very low	153 Å²	153	129.5 Å²	129.5	67%	0.665	67%	0.668	S	S	*	*				97.9	124.6	127.8	-79.9	-180	170.4	-170.8	0	123.1	S756	S756-K902 PolarHBondContact O-N 2.85Å
903	Q	23	Very low	25.6	Very low	149 Å²	149	129.3 Å²	129.3	70%	0.696	67%	0.667	S	S	*	*				73.7	150.5	129.6	-73.8	-175.3	-89.9	0	0	123.4
904	L	24.1	Very low	25.4	Very low	147 Å²	147	125.9 Å²	125.9	77%	0.77	65%	0.651	S	S	*	*			trans	72.2	153.9	149.6	-106.2	72.9	0	0	0	120.8
905	S	21.7	Very low	25.4	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	65%	0.651	S	S	*	*			trans	-115.3	132.2	166.6	-45.3	0	0	0	0	107.9
906	T	22.3	Very low	25.4	Very low	116 Å²	116	125.9 Å²	125.9	71%	0.712	66%	0.656	S	S	*	*			trans	-178.4	144.8	145.1	25	0	0	0	0	111.1
907	M	22.5	Very low	25.4	Very low	166 Å²	166	128.5 Å²	128.5	82%	0.818	66%	0.663	S	S	*	*			trans	63.2	164	162.4	-69.3	-178.9	-76.8	0	0	116.6
908	K	24.7	Very low	25.5	Very low	178 Å²	178	128.9 Å²	128.9	77%	0.774	67%	0.672	S	S	*	*			cis	169.6	128.9	-43.2	-114	-170.2	171.7	-174.2	0	105.3
909	L	25.5	Very low	25.7	Very low	130 Å²	130	130.8 Å²	130.8	68%	0.681	68%	0.677	S	S	*	*			trans	66.6	99.6	148.9	-56.9	170.9	0	0	0	120.6
910	E	23.1	Very low	25.9	Very low	153 Å²	153	134.4 Å²	134.4	72%	0.715	69%	0.693	S	S	*	*				74.4	140.8	104.5	-124.7	160.3	-135.4	0	0	122.3
911	F	28.7	Very low	26.1	Very low	166 Å²	166	137 Å²	137	73%	0.728	70%	0.704	S	S	*	*			trans	72.9	144.3	171.6	-61.3	-84.4	0	0	0	119.7
912	D	26	Very low	26.4	Very low	131 Å²	131	138.8 Å²	138.8	70%	0.701	71%	0.713	S	S	*	*			cis	-175.2	166.5	-39.5	-107.6	-3	0	0	0	110.6
913	D	28	Very low	26.8	Very low	108 Å²	108	137.3 Å²	137.3	58%	0.578	72%	0.717	S	S	*	*			trans	47.8	121.4	164.9	-91.9	14	0	0	0	119.4	R746	R746-D913 IonicContact NH1-OD2 2.77Å; R746-D913 PolarHBondContact NH1-OD2 2.81Å
914	V	26.6	Very low	27.1	Very low	70 Å²	70	136.3 Å²	136.3	42%	0.424	72%	0.715	S	S	.	*				71	112.2	65	174.2	0	0	0	0	114.4
915	T	32	Very low	27.5	Very low	113 Å²	113	134.8 Å²	134.8	69%	0.693	71%	0.711	S	S	*	*			trans	-163.5	146	131.2	24	0	0	0	0	111.4
916	N	25.9	Very low	27.8	Very low	146 Å²	146	135.8 Å²	135.8	78%	0.781	71%	0.708	S	S	*	*			trans	-126.9	161.9	149.4	-102.8	45.5	0	0	0	105.8
917	D	28.1	Very low	28.1	Very low	141 Å²	141	136.5 Å²	136.5	75%	0.754	71%	0.707	S	S	*	*			trans	70.4	118.7	-172.9	-36.4	-26.9	0	0	0	110
918	D	28.2	Very low	28.3	Very low	154 Å²	154	134.3 Å²	134.3	82%	0.824	70%	0.699	S	S	*	*			cis	-125.3	-175.9	17.2	-65.9	-58.7	0	0	0	114.3
919	E	29	Very low	28.1	Very low	174 Å²	174	133.2 Å²	133.2	81%	0.813	70%	0.702	S	S	*	*			trans	78.8	93.7	166.1	-61.3	-170.4	177.8	0	0	120.2
920	D	30.9	Very low	28.2	Very low	132 Å²	132	135.2 Å²	135.2	71%	0.706	71%	0.708	S	S	*	*				92.9	113.1	113.7	-66.8	6.8	0	0	0	123.3
921	E	28.3	Very low	28.2	Very low	162 Å²	162	135.9 Å²	135.9	76%	0.757	71%	0.711	S	S	*	*				64.2	152.9	126.3	-54.4	-68.9	-158.5	0	0	119.9
922	D	29.9	Very low	28.2	Very low	116 Å²	116	133.1 Å²	133.1	62%	0.62	71%	0.707	S	S	*	*			cis	-150.2	170.4	14.9	-156.3	-30.4	0	0	0	111.1
923	V	33.5	Very low	28.1	Very low	123 Å²	123	132.8 Å²	132.8	75%	0.745	71%	0.71	S	S	*	*			trans	75.9	118.2	162.8	-167.9	0	0	0	0	118.2
924	I	31	Very low	28.2	Very low	128 Å²	128	134.9 Å²	134.9	66%	0.656	71%	0.714	S	S	*	*			cis	-172.4	141.3	-28.3	-113.3	160.5	0	0	0	108.4
925	V	32.3	Very low	28.2	Very low	114 Å²	114	138 Å²	138	69%	0.691	72%	0.723	S	S	*	*			trans	38.8	139	144.1	-178.5	0	0	0	0	120.3
926	N	28	Very low	28.1	Very low	130 Å²	130	139.8 Å²	139.8	70%	0.695	72%	0.724	S	S	*	*			cis	-177.3	169.6	-19.6	-95.2	-11.1	0	0	0	106.3
927	D	28.5	Very low	27.9	Very low	131 Å²	131	139.2 Å²	139.2	70%	0.701	72%	0.717	S	S	*	*			trans	62.8	147	153.7	-70.3	16.6	0	0	0	118.7
928	N	25.5	Very low	27.7	Very low	120 Å²	120	139.9 Å²	139.9	64%	0.642	72%	0.715	S	S	*	*			cis	-162.2	109.8	-10	-108.5	-34.2	0	0	0	109.5
929	N	22.1	Very low	27.4	Very low	156 Å²	156	140 Å²	140	83%	0.834	71%	0.711	S	S	*	*			trans	61.4	-172.9	-177.3	-51.7	-75.7	0	0	0	115.4
930	E	26.9	Very low	27.6	Very low	172 Å²	172	138.5 Å²	138.5	80%	0.804	71%	0.709	S	S	*	*			trans	67.3	139.9	-176.1	-54.7	-167.5	165.3	0	0	113.6
931	E	23.3	Very low	27.3	Very low	167 Å²	167	137.9 Å²	137.9	78%	0.78	71%	0.705	S	S	*	*			cis	81.1	157.7	34.3	-162.9	162.7	-148.4	0	0	113.7
932	V	27.6	Very low	27.7	Very low	108 Å²	108	136.9 Å²	136.9	66%	0.655	71%	0.705	S	S	*	*			trans	73.5	85	-179.8	-168.2	0	0	0	0	113.3
933	V	24.6	Very low	28	Very low	124 Å²	124	138 Å²	138	75%	0.752	71%	0.711	S	S	*	*				54.6	114.6	69.8	-175	0	0	0	0	113.3
934	K	30.3	Very low	28	Very low	152 Å²	152	138.6 Å²	138.6	66%	0.661	71%	0.71	S	S	*	*			trans	-162.2	129.4	149.1	-105.3	165.6	-176.4	-66.8	0	107.5
935	E	27.3	Very low	28.5	Very low	134 Å²	134	139.4 Å²	139.4	63%	0.626	72%	0.716	S	S	*	*				66	130	92.6	-70.7	168.5	-149.1	0	0	112.2
936	E	28.3	Very low	28.4	Very low	151 Å²	151	141.6 Å²	141.6	71%	0.706	72%	0.724	S	S	*	*			cis	-157.2	-160.4	-9.4	-133.8	169.4	178.4	0	0	114
937	Q	22.8	Very low	28.6	Very low	135 Å²	135	141.8 Å²	141.8	63%	0.631	73%	0.729	S	S	*	*			trans	-61.7	170.4	-173.9	-62.1	142	36.7	0	0	115.6
938	E	23.5	Very low	28.7	Very low	154 Å²	154	142.9 Å²	142.9	72%	0.72	74%	0.735	S	S	*	*			trans	70.4	120	150.9	-77	164.2	-167.7	0	0	116.9
939	E	22.9	Very low	28.7	Very low	157 Å²	157	144.1 Å²	144.1	73%	0.734	74%	0.741	S	S	*	*				64.1	78	86.2	-67	-167.4	171.7	0	0	113.5	N941	E939-N941 PolarHBondContact O-ND2 3.29Å
940	N	32.7	Very low	28.9	Very low	143 Å²	143	142.7 Å²	142.7	77%	0.765	73%	0.73	S	S	*	*			trans	-126.2	131.5	135.3	-68.5	-63.4	0	0	0	106.8
941	N	24.8	Very low	29.1	Very low	118 Å²	118	141.7 Å²	141.7	63%	0.631	72%	0.723	S	S	*	*			cis	71.4	161.8	40.5	-49.9	-40.5	0	0	0	112.2	E939	E939-N941 PolarHBondContact O-ND2 3.29Å
942	D	35.9	Very low	29.6	Very low	142 Å²	142	140.6 Å²	140.6	76%	0.759	72%	0.721	S	S	*	*			trans	81.2	127.6	-165.3	-51.9	3.1	0	0	0	113.9
943	D	36.6	Very low	29.9	Very low	139 Å²	139	146 Å²	146	74%	0.743	73%	0.73	S	S	*	*			cis	-167.8	159.2	-49.1	-101.7	1.5	0	0	0	107.5
944	D	33.1	Very low	31	Very low	136 Å²	136	145.2 Å²	145.2	73%	0.727	73%	0.727	S	S	*	*			trans	16.1	147.6	160.5	-61.7	-21.4	0	0	0	123.6
945	N	41.7	Very low	30.9	Very low	145 Å²	145	144.3 Å²	144.3	78%	0.775	73%	0.734	S	S	*	*			trans	99.6	96.2	156.2	-52	-78.8	0	0	0	118.6
946	N	29.6	Very low	31	Very low	160 Å²	160	143.8 Å²	143.8	86%	0.856	74%	0.74	S	S	*	*	S	Bend	trans	65.1	118.1	167.8	-57.6	-57.7	0	0	0	116.9
947	V	32.2	Very low	30.9	Very low	133 Å²	133	147.7 Å²	147.7	81%	0.806	75%	0.748	S	S	*	*	S	Bend	cis	-163.9	147.7	-4.7	156.5	0	0	0	0	104.4
948	D	30.9	Very low	31	Very low	155 Å²	155	151.2 Å²	151.2	83%	0.829	76%	0.756	S	S	*	*			cis	-137.6	161.7	15.9	-166.1	15.4	0	0	0	110.6
949	D	26.5	Very low	31	Very low	145 Å²	145	153.9 Å²	153.9	78%	0.775	76%	0.759	S	S	*	*			trans	-95.8	125.1	-158.3	-84.1	-36.8	0	0	0	118.7
950	E	26	Very low	31.1	Very low	127 Å²	127	157.6 Å²	157.6	59%	0.593	77%	0.766	S	S	*	*				60.5	114.5	124.1	-69.4	-73.3	93.5	0	0	125.5
951	K	30.2	Very low	30.7	Very low	150 Å²	150	155.4 Å²	155.4	65%	0.652	76%	0.762	S	S	*	*				50.5	121.7	124.9	-70.4	-169.8	-166.2	87.7	0	125.7
952	I	34.9	Very low	30.7	Very low	144 Å²	144	160.3 Å²	160.3	74%	0.738	77%	0.772	S	S	*	*				63.6	133	120.9	-56.8	175.5	0	0	0	122.5
953	R	34.1	Very low	30.2	Very low	223 Å²	223	161.3 Å²	161.3	84%	0.842	77%	0.77	S	S	*	*			trans	-154.4	148.7	145.2	-111.2	-176.4	-169.2	-139.6	2.2	112.2
954	P	47.1	Very low	29.7	Very low	107 Å²	107	161.4 Å²	161.4	70%	0.695	77%	0.765	S	S	*	*				-152.8	145.9	117.5	36.7	-20.2	0	0	0	116.6
955	T	28.2	Very low	29.3	Very low	133 Å²	133	159.9 Å²	159.9	82%	0.816	77%	0.765	S	S	*	*			trans	170	140.6	130.4	32.3	0	0	0	0	116
956	V	28.5	Very low	28.5	Very low	122 Å²	122	156.3 Å²	156.3	74%	0.739	75%	0.751	S	S	*	*			trans	69.8	140	137.7	174.9	0	0	0	0	123.4
957	R	26.4	Very low	28.4	Very low	233 Å²	233	152.4 Å²	152.4	88%	0.879	74%	0.737	S	S	*	*			trans	79.8	92.5	157.4	-88.2	168.1	-173.2	170.7	1.8	123.3
958	R	24.9	Very low	28.2	Very low	210 Å²	210	149.4 Å²	149.4	79%	0.792	73%	0.726	S	S	*	*				32.7	119.8	121.6	-77.3	-175.4	170.1	174.7	-0.7	122.2
959	R	23.7	Very low	28.1	Very low	209 Å²	209	149.6 Å²	149.6	79%	0.789	73%	0.727	S	S	*	*				85.1	130.7	123.2	-75.8	-178.2	168.5	177.9	-4.6	122
960	R	25.5	Very low	28	Very low	235 Å²	235	147 Å²	147	89%	0.887	72%	0.72	S	S	*	*			trans	77.1	146.9	158.3	-68.7	176.8	171.5	177.7	-4.3	116.7
961	S	23.6	Very low	28	Very low	98 Å²	98	146.9 Å²	146.9	69%	0.685	73%	0.729	S	S	*	*			cis	-174	140	-23.6	-102.8	0	0	0	0	113.1
962	R	25.5	Very low	27.8	Very low	220 Å²	220	145.3 Å²	145.3	83%	0.83	74%	0.736	S	S	*	*			trans	75.7	124.7	151.1	-68.3	172.8	170.1	174.3	-4.7	121.8
963	K	25.2	Very low	27.3	Very low	164 Å²	164	143.3 Å²	143.3	71%	0.713	74%	0.735	S	S	*	*			trans	71.8	149.7	132.8	-69.7	-178.4	162.3	-137.3	0	118.5
964	H	25.5	Very low	27	Very low	141 Å²	141	139.9 Å²	139.9	65%	0.653	73%	0.732	S	S	*	*			cis	-165.3	146.5	1.6	-115.3	-31.8	0	0	0	111.7
965	S	24.9	Very low	26	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	73%	0.734	S	S	*	*			trans	41.5	153.8	144.1	57.4	0	0	0	0	123.7
966	S	26.2	Very low	25.8	Very low	69 Å²	69	141.6 Å²	141.6	48%	0.483	73%	0.733	S	S	.	*			cis	179	163.1	-14.5	53.4	0	0	0	0	112.1
967	S	27.3	Very low	25.6	Very low	79 Å²	79	141.5 Å²	141.5	55%	0.552	73%	0.733	S	S	*	*			trans	65.4	153	154.3	54.5	0	0	0	0	121.7	N801	N801-S967 WeakPolarHBondContact ND2-CA 3.27Å; N801-S967 PolarHBondContact ND2-N 2.92Å
968	A	28.2	Very low	25.7	Very low	70 Å²	70	134.8 Å²	134.8	58%	0.579	72%	0.722	S	S	*	*			cis	-172	-176.3	-19.1	0	0	0	0	0	111.3
969	N	28.6	Very low	25.7	Very low	158 Å²	158	132 Å²	132	85%	0.845	72%	0.722	S	S	*	*			trans	79.3	151.1	166.8	-63.8	-8	0	0	0	120.1
970	S	24.6	Very low	25.7	Very low	90 Å²	90	127 Å²	127	63%	0.629	72%	0.718	S	S	*	*			cis	-176.6	166.8	-33.5	51	0	0	0	0	113.4
971	T	24.4	Very low	25.9	Very low	126 Å²	126	121.8 Å²	121.8	77%	0.773	71%	0.708	S	S	*	*			trans	97.3	136.8	155.5	70.9	0	0	0	0	122.9
972	S	27.4	Very low	26.1	Very low	116 Å²	116	122.8 Å²	122.8	81%	0.811	71%	0.705	S	S	*	*			trans	63.7	138.9	169	71.7	0	0	0	0	118.4
973	S	24	Very low	26	Very low	102 Å²	102	119.1 Å²	119.1	71%	0.713	70%	0.701	S	S	*	*			cis	-171.6	169.3	-14.7	55.1	0	0	0	0	108.7
974	L	26.5	Very low	26.1	Very low	151 Å²	151	118 Å²	118	79%	0.791	70%	0.7	S	S	*	*			cis	-108	-91.7	-4.9	-75.6	82.7	0	0	0	111.7
975	S	26.2	Very low	26.2	Very low	105 Å²	105	122 Å²	122	73%	0.734	71%	0.71	S	S	*	*			cis	-159.8	-177.5	-1.5	62.6	0	0	0	0	112.7
976	H	24.1	Very low	26.3	Very low	171 Å²	171	120.2 Å²	120.2	79%	0.792	71%	0.708	S	S	*	*			trans	-136.8	158.4	-173.5	-48.1	-93	0	0	0	110.8
977	T	25.5	Very low	26.3	Very low	121 Å²	121	122.2 Å²	122.2	74%	0.742	72%	0.721	S	S	*	*			cis	-147	151.6	16.1	50.4	0	0	0	0	114.9
978	S	27.1	Very low	26.2	Very low	92 Å²	92	125 Å²	125	64%	0.643	73%	0.729	S	S	*	*				72.8	133	129.8	68.2	0	0	0	0	126.8
979	L	25.9	Very low	26.1	Very low	152 Å²	152	131 Å²	131	80%	0.796	74%	0.742	S	S	*	*			trans	71.2	114.9	138.5	-62.7	164.1	0	0	0	119.8
980	C	23.8	Very low	25.9	Very low	102 Å²	102	133 Å²	133	69%	0.689	74%	0.743	S	S	*	*				90.7	144.8	90.9	-75.2	0	0	0	0	114.3
981	N	28.9	Very low	25.8	Very low	127 Å²	127	139.5 Å²	139.5	68%	0.679	75%	0.754	S	S	*	*			cis	-159.5	168.6	-2.7	-93.9	-2.2	0	0	0	107.1
982	D	27.7	Very low	25.8	Very low	118 Å²	118	140.4 Å²	140.4	63%	0.631	75%	0.752	S	S	*	*			cis	-156.7	127.8	-16.1	-100.8	-41.6	0	0	0	105.4
983	L	24.8	Very low	25.8	Very low	144 Å²	144	139.4 Å²	139.4	75%	0.754	75%	0.751	S	S	*	*				79.9	151.5	79.3	-103	173.6	0	0	0	117.1
984	M	27.3	Very low	25.8	Very low	139 Å²	139	138.9 Å²	138.9	69%	0.685	75%	0.753	S	S	*	*			trans	77.6	133.8	178.9	-50.9	-59.8	176.7	0	0	117.7
985	R	26.9	Very low	25.8	Very low	227 Å²	227	137.9 Å²	137.9	86%	0.857	75%	0.753	S	S	*	*			cis	-158.7	169.4	-20.7	-129.9	175.2	-165.4	-161.2	3.5	110.2
986	G	27.2	Very low	25.7	Very low	66 Å²	66	140.2 Å²	140.2	68%	0.68	76%	0.757	S	S	*	*			trans	-69.7	-160.8	-177.2	0	0	0	0	0	115.4
987	S	25.8	Very low	25.9	Very low	110 Å²	110	135.5 Å²	135.5	77%	0.769	76%	0.755	S	S	*	*			cis	157.1	162	-9	-86.6	0	0	0	0	106.9
988	I	24.8	Very low	26	Very low	139 Å²	139	137.2 Å²	137.2	71%	0.713	76%	0.759	S	S	*	*			trans	84.9	109.9	145.7	-80	162.9	0	0	0	122.1
989	K	26.9	Very low	25.9	Very low	195 Å²	195	140.4 Å²	140.4	85%	0.848	77%	0.768	S	S	*	*			trans	69.7	176.6	135.5	-60.7	179.5	-169.8	169.7	0	121.4
990	K	24.2	Very low	26.3	Very low	201 Å²	201	141.1 Å²	141.1	87%	0.874	77%	0.769	S	S	*	*			trans	-122.5	149.3	-162.3	-61.9	173.1	178.3	172.7	0	112.1
991	R	22.9	Very low	26.4	Very low	226 Å²	226	143.8 Å²	143.8	85%	0.853	77%	0.774	S	S	*	*			trans	76	115.4	156.9	-75.6	-174.4	173.1	-179.7	-1.6	121.4
992	I	24.4	Very low	26.4	Very low	144 Å²	144	146.3 Å²	146.3	74%	0.738	78%	0.784	S	S	*	*			trans	72	100.3	130.1	-52.5	166	0	0	0	119.8
993	A	26	Very low	26.5	Very low	95 Å²	95	144.6 Å²	144.6	79%	0.785	78%	0.777	S	S	*	*				-170	130.2	120.4	0	0	0	0	0	106.7
994	A	24	Very low	26.7	Very low	92 Å²	92	142.7 Å²	142.7	76%	0.76	77%	0.772	S	S	*	*			cis	103.1	115	32.5	0	0	0	0	0	112.6
995	V	26.9	Very low	26.8	Very low	130 Å²	130	140.7 Å²	140.7	79%	0.788	78%	0.778	S	S	*	*			trans	176.5	116.8	135.6	150.8	0	0	0	0	111.8
996	N	25.7	Very low	26.8	Very low	153 Å²	153	138 Å²	138	82%	0.818	77%	0.774	S	S	*	*			trans	28.5	147.3	146.8	-49.7	-24.2	0	0	0	123.9
997	G	27.2	Very low	27.1	Very low	72 Å²	72	138.4 Å²	138.4	74%	0.742	77%	0.771	S	S	*	*			cis	159.1	-168.3	-7.1	0	0	0	0	0	117.3
998	N	27.8	Very low	27.2	Very low	158 Å²	158	141.5 Å²	141.5	85%	0.845	77%	0.773	S	S	*	*			trans	78.6	69.3	160.5	-66.3	-3.7	0	0	0	123
999	L	24.1	Very low	27.4	Very low	158 Å²	158	146.1 Å²	146.1	83%	0.827	78%	0.782	S	S	*	*				42.6	118	107.8	-164	71.7	0	0	0	122.5
1000	M	34.7	Very low	27.3	Very low	167 Å²	167	141.5 Å²	141.5	82%	0.823	77%	0.774	S	S	*	*			trans	4.6	151.3	132	-56.7	-81.4	-95.3	0	0	121.2
1001	M	26.2	Very low	27.4	Very low	159 Å²	159	138 Å²	138	78%	0.783	77%	0.769	S	S	*	*			trans	-154.5	158.5	161.5	-117.3	-165	-65.2	0	0	111.9	V1003	M1001-V1003 HydrophobicContact CG-CG2 4.33Å; M1001-V1003 HydrophobicContact SD-CG2 3.56Å; M1001-V1003 VanDerWaalsContact SD-CG2 3.56Å
1002	M	29.7	Very low	27.5	Very low	180 Å²	180	131.9 Å²	131.9	89%	0.887	76%	0.762	S	S	*	*				-155.1	177.3	54.3	-82.2	-164	-168.2	0	0	112.8
1003	V	28.1	Very low	27.5	Very low	82 Å²	82	130.8 Å²	130.8	50%	0.497	77%	0.767	S	S	.	*			cis	-176.9	137.2	-29.7	145.8	0	0	0	0	105.2	M1001	M1001-V1003 HydrophobicContact CG-CG2 4.33Å; M1001-V1003 HydrophobicContact SD-CG2 3.56Å; M1001-V1003 VanDerWaalsContact SD-CG2 3.56Å
1004	T	29.3	Very low	27.5	Very low	103 Å²	103	129.7 Å²	129.7	63%	0.632	77%	0.765	S	S	*	*			cis	-168.8	145.8	-23.4	45.6	0	0	0	0	104.8
1005	A	30.2	Very low	27.5	Very low	98 Å²	98	130.8 Å²	130.8	81%	0.81	77%	0.767	S	S	*	*			cis	-148.7	-65.9	-13.1	0	0	0	0	0	109
1006	H	27.3	Very low	27.4	Very low	170 Å²	170	131.6 Å²	131.6	79%	0.787	77%	0.767	S	S	*	*			cis	-167.8	172.6	-22.8	-177.7	63.2	0	0	0	108.5
1007	A	33.3	Very low	27.3	Very low	74 Å²	74	131.7 Å²	131.7	61%	0.612	77%	0.767	S	S	*	*			trans	72.5	135.1	158.1	0	0	0	0	0	119.2
1008	Q	27.9	Very low	27.2	Very low	175 Å²	175	133.5 Å²	133.5	82%	0.818	77%	0.769	S	S	*	*			cis	-148.5	126.4	-14.8	-67	-171.5	-96.6	0	0	111.7
1009	R	28.1	Very low	27.1	Very low	237 Å²	237	133.1 Å²	133.1	89%	0.894	77%	0.766	S	S	*	*			trans	-163.3	105.9	133.5	-102	-178.4	-177.8	-150.3	-2.3	105.5
1010	S	24.7	Very low	27.1	Very low	98 Å²	98	128.2 Å²	128.2	69%	0.685	75%	0.746	S	S	*	*				66.2	118.7	84.8	-55.7	0	0	0	0	110.5
1011	T	26.4	Very low	26.6	Very low	126 Å²	126	124.3 Å²	124.3	77%	0.773	73%	0.734	S	S	*	*			cis	-154	142.5	41.3	42.4	0	0	0	0	116.2
1012	S	25.5	Very low	26.5	Very low	99 Å²	99	122.2 Å²	122.2	69%	0.692	74%	0.736	S	S	*	*			trans	29.3	131.3	140.2	65	0	0	0	0	125.4
1013	S	24	Very low	26.2	Very low	121 Å²	121	118 Å²	118	85%	0.846	72%	0.724	S	S	*	*			trans	46.8	145.9	133.1	62.3	0	0	0	0	123.1
1014	G	26.6	Very low	26.1	Very low	72 Å²	72	119.2 Å²	119.2	74%	0.742	74%	0.736	S	S	*	*			cis	152.4	153.6	-7.8	0	0	0	0	0	115
1015	S	24.5	Very low	25.7	Very low	114 Å²	114	120.8 Å²	120.8	80%	0.797	74%	0.74	S	S	*	*			trans	70.3	147.4	164.4	-133.5	0	0	0	0	121.9
1016	N	23.7	Very low	25.4	Very low	147 Å²	147	124 Å²	124	79%	0.786	74%	0.738	S	S	*	*			trans	86.9	159	155.6	-64.9	14.1	0	0	0	121.5
1017	N	23.8	Very low	25.2	Very low	156 Å²	156	120.8 Å²	120.8	83%	0.834	74%	0.735	S	S	*	*			trans	-60.8	170.8	-180	-55.6	0.7	0	0	0	112.2
1018	S	25.2	Very low	24.9	Very low	110 Å²	110	124.5 Å²	124.5	77%	0.769	75%	0.75	S	S	*	*			cis	-154.1	-175.8	33.6	-58.7	0	0	0	0	115.1
1019	N	24.9	Very low	24.8	Very low	149 Å²	149	119.3 Å²	119.3	80%	0.797	74%	0.743	S	S	*	*			trans	-44.4	172.2	157	-48.4	-12.6	0	0	0	112.5
1020	S	24.2	Very low	24.8	Very low	56 Å²	56	111 Å²	111	39%	0.392	73%	0.731	S	S	.	*			cis	-145.6	145.6	23.2	-51.8	0	0	0	0	110.4	N1347	S1020-N1347 PolarHBondContact O-ND2 2.93Å
1021	S	24.2	Very low	24.6	Very low	84 Å²	84	115.2 Å²	115.2	59%	0.587	74%	0.74	S	S	*	*				53.7	113.1	89.3	-32.2	0	0	0	0	112.6	N1347	S1021-N1347 PolarHBondContact O-ND2 3.36Å
1022	S	24.3	Very low	24.8	Very low	116 Å²	116	115.5 Å²	115.5	81%	0.811	74%	0.741	S	S	*	*				86.8	168.2	96.7	73	0	0	0	0	111.9
1023	S	23.8	Very low	24.8	Very low	91 Å²	91	114.6 Å²	114.6	64%	0.636	74%	0.735	S	S	*	*			cis	-146.6	160.6	-0.4	52.6	0	0	0	0	110.2
1024	S	25.8	Very low	25	Very low	108 Å²	108	115.2 Å²	115.2	76%	0.755	73%	0.729	S	S	*	*			trans	170.3	118	137.8	-75.5	0	0	0	0	107.3
1025	L	22	Very low	25.2	Very low	135 Å²	135	118.5 Å²	118.5	71%	0.707	73%	0.73	S	S	*	*				79.3	136.1	52.8	-70.4	172.3	0	0	0	114
1026	Q	22.3	Very low	25.5	Very low	165 Å²	165	119.3 Å²	119.3	77%	0.771	73%	0.725	S	S	*	*			trans	62.5	119.5	160.5	-66.8	154.4	-17.6	0	0	116.9
1027	S	23.3	Very low	25.8	Very low	104 Å²	104	118.4 Å²	118.4	73%	0.727	72%	0.72	S	S	*	*			cis	83.8	94.3	36	84.6	0	0	0	0	115.1
1028	V	28.8	Very low	26	Very low	152 Å²	152	117.5 Å²	117.5	92%	0.921	72%	0.715	S	S	*	*			trans	-144.5	138.2	144.9	-171.6	0	0	0	0	103.8
1029	G	23.9	Very low	26.2	Very low	65 Å²	65	117.5 Å²	117.5	67%	0.67	71%	0.71	S	S	*	*			cis	131.9	141.4	12.4	0	0	0	0	0	107.9
1030	G	28.3	Very low	26.1	Very low	64 Å²	64	115.5 Å²	115.5	66%	0.66	71%	0.707	S	S	*	*			trans	86.3	90.5	-161	0	0	0	0	0	111.2
1031	E	22	Very low	26.1	Very low	185 Å²	185	119.7 Å²	119.7	86%	0.864	72%	0.724	S	S	*	*			cis	78.9	156.5	32.4	-53.7	171.8	150.6	0	0	115
1032	V	29.9	Very low	26	Very low	132 Å²	132	122.3 Å²	122.3	80%	0.8	73%	0.731	S	S	*	*			trans	98.9	92.3	-161.6	-177.8	0	0	0	0	110.8
1033	S	25.3	Very low	26.2	Very low	80 Å²	80	122 Å²	122	56%	0.559	73%	0.73	S	S	*	*			cis	71	152.9	34.5	98.9	0	0	0	0	113.6
1034	D	29.1	Very low	26.2	Very low	135 Å²	135	122.3 Å²	122.3	72%	0.722	73%	0.732	S	S	*	*			cis	-102.7	-133.3	-7.9	-72.8	-84.6	0	0	0	109.1
1035	D	30.4	Very low	26	Very low	141 Å²	141	122.1 Å²	122.1	75%	0.754	73%	0.73	S	S	*	*			cis	-156.2	155.4	-7.7	37.2	-104.2	0	0	0	106.2
1036	D	30.6	Very low	26.2	Very low	131 Å²	131	122.7 Å²	122.7	70%	0.701	73%	0.734	S	S	*	*			cis	-128.8	151.7	-4.3	-103.8	-41.9	0	0	0	107.1
1037	N	29.2	Very low	26.4	Very low	127 Å²	127	119 Å²	119	68%	0.679	73%	0.727	S	S	*	*				52.6	142	81.7	-55.6	-46.4	0	0	0	114.5
1038	D	28.4	Very low	26.3	Very low	137 Å²	137	119.3 Å²	119.3	73%	0.733	73%	0.729	S	S	*	*			cis	-160.7	-179.5	14.5	-143.9	-26.5	0	0	0	113.3
1039	V	30	Very low	26.2	Very low	111 Å²	111	117.9 Å²	117.9	67%	0.673	72%	0.72	S	S	*	*			trans	42.9	106.5	154.6	178.5	0	0	0	0	117.2
1040	C	22.1	Very low	26.1	Very low	107 Å²	107	122 Å²	122	72%	0.723	73%	0.727	S	S	*	*			cis	69	118.3	15.8	-128.1	0	0	0	0	117.3
1041	L	23.4	Very low	26.1	Very low	143 Å²	143	125.1 Å²	125.1	75%	0.749	73%	0.733	S	S	*	*			trans	69.5	122.1	161.2	-51.6	171.2	0	0	0	119.5
1042	N	23.3	Very low	26.2	Very low	139 Å²	139	122.9 Å²	122.9	74%	0.743	73%	0.732	S	S	*	*				177	172.3	95.8	-92.6	-64	0	0	0	112.6
1043	S	28.6	Very low	26.1	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	74%	0.738	S	S	*	*			trans	66.6	69.2	172.6	-48.6	0	0	0	0	114.7
1044	S	23.3	Very low	26	Very low	97 Å²	97	129.2 Å²	129.2	68%	0.678	75%	0.745	S	S	*	*			cis	69	140.9	32.3	88.6	0	0	0	0	116.4
1045	S	22.4	Very low	26	Very low	103 Å²	103	132.3 Å²	132.3	72%	0.72	75%	0.752	S	S	*	*			trans	77.7	98.6	163.5	-49.6	0	0	0	0	119.2
1046	N	25.5	Very low	25.9	Very low	148 Å²	148	131.3 Å²	131.3	79%	0.791	76%	0.755	S	S	*	*				176.1	111.8	118.9	-85.1	-11.1	0	0	0	108.5
1047	S	26.1	Very low	25.4	Very low	88 Å²	88	130.4 Å²	130.4	62%	0.615	76%	0.758	S	S	*	*				53.4	97.3	84.8	74.3	0	0	0	0	112.6
1048	S	21.1	Very low	25.4	Very low	110 Å²	110	131.2 Å²	131.2	77%	0.769	77%	0.768	S	S	*	*				75.2	169	66.1	81.3	0	0	0	0	114.5
1049	V	27.3	Very low	25.1	Very low	122 Å²	122	130.5 Å²	130.5	74%	0.739	76%	0.764	S	S	*	*			trans	83.8	91.7	176.9	-166.7	0	0	0	0	117.4
1050	N	22.3	Very low	24.9	Very low	152 Å²	152	134.3 Å²	134.3	81%	0.813	77%	0.767	S	S	*	*				17.8	134.1	126.2	-63.2	-29.8	0	0	0	119.4
1051	T	27	Very low	25.1	Very low	129 Å²	129	135.6 Å²	135.6	79%	0.791	76%	0.762	S	S	*	*			trans	-147.9	122.8	156.4	-66.1	0	0	0	0	113.4	R1053	T1051-R1053 HydrophobicContact CG2-CB 4.43Å
1052	T	24.9	Very low	25.3	Very low	138 Å²	138	134.2 Å²	134.2	85%	0.847	76%	0.755	S	S	*	*			trans	-98.5	115.2	163.8	43.2	0	0	0	0	110.2
1053	R	28.2	Very low	25.4	Very low	243 Å²	243	130.3 Å²	130.3	92%	0.917	74%	0.738	S	S	*	*			trans	-161.4	165.9	166.9	-123.3	166.1	178.2	170.6	-0.4	115.8	T1051	T1051-R1053 HydrophobicContact CG2-CB 4.43Å
1054	S	23.1	Very low	25.4	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	74%	0.741	S	S	*	*			trans	-107.7	150.8	-160.7	52.4	0	0	0	0	115.7
1055	K	28.2	Very low	25.8	Very low	201 Å²	201	135.2 Å²	135.2	87%	0.874	74%	0.741	S	S	*	*			trans	-173.4	132.9	146.8	-96.4	146.4	-175	-177.9	0	107.3
1056	C	29.8	Very low	26.3	Very low	120 Å²	120	138.4 Å²	138.4	81%	0.811	74%	0.738	S	S	*	*				82.1	130.3	60.8	-164.9	0	0	0	0	112.5
1057	S	19.4	Very low	26.3	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	73%	0.734	S	S	*	*			trans	-103.8	130.5	-170.7	-52.7	0	0	0	0	112.7
1058	T	28.2	Very low	26.4	Very low	145 Å²	145	141.1 Å²	141.1	89%	0.89	74%	0.739	S	S	*	*			trans	-162.8	130.5	139.8	18.8	0	0	0	0	113
1059	D	22.8	Very low	26.7	Very low	121 Å²	121	141.1 Å²	141.1	65%	0.647	74%	0.739	S	S	*	*			trans	-5.1	163.8	153.9	-158	20.5	0	0	0	123.3
1060	R	26.2	Very low	26.6	Very low	191 Å²	191	144.7 Å²	144.7	72%	0.721	74%	0.741	S	S	*	*			trans	76.6	113.4	162.7	-78.5	155.9	-161.3	-122.5	-5.2	119.2
1061	Q	25	Very low	26.8	Very low	135 Å²	135	144.7 Å²	144.7	63%	0.631	73%	0.734	S	S	*	*				69.8	144.2	74.7	-71	-172.3	-0	0	0	112.9
1062	L	27.5	Very low	27.2	Very low	113 Å²	113	143.6 Å²	143.6	59%	0.592	73%	0.731	S	S	*	*			cis	-166.8	153	-7.4	-99	165.1	0	0	0	104.7	R1066	L1062-R1066 VanDerWaalsContact CD2-NH1 3.31Å
1063	S	27.3	Very low	27.5	Very low	57 Å²	57	143.9 Å²	143.9	40%	0.399	73%	0.733	S	S	.	*			cis	-161.8	-178.9	-14.2	26.8	0	0	0	0	106.1
1064	Y	28	Very low	27.3	Very low	215 Å²	215	139 Å²	139	84%	0.843	73%	0.725	S	S	*	*	S	Bend	cis	-159	159.9	33.9	-76.1	-94.8	0	0	0	109.5
1065	S	31.9	Very low	27.5	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	72%	0.724	S	S	*	*			cis	-171	142.4	-24.7	47.9	0	0	0	0	110.6
1066	R	32.1	Very low	27.2	Very low	169 Å²	169	140 Å²	140	64%	0.638	71%	0.713	S	S	*	*			cis	-173.6	99.6	-25.8	-138.3	172.4	-177.5	173.5	1.1	108.6	L1062	L1062-R1066 VanDerWaalsContact CD2-NH1 3.31Å
1067	L	27	Very low	26.8	Very low	136 Å²	136	140.3 Å²	140.3	71%	0.712	71%	0.706	S	S	*	*				80.6	107.2	97.1	-74.9	170.9	0	0	0	120.5
1068	Q	28	Very low	27.1	Very low	157 Å²	157	139.9 Å²	139.9	73%	0.734	70%	0.699	S	S	*	*				50.7	160	123.9	-70.7	-178.6	-22.8	0	0	126.2
1069	S	26.1	Very low	26.9	Very low	110 Å²	110	140.1 Å²	140.1	77%	0.769	69%	0.692	S	S	*	*			trans	100.5	144.5	146.7	-160.2	0	0	0	0	121.2
1070	Y	25.4	Very low	27	Very low	197 Å²	197	140.7 Å²	140.7	77%	0.773	70%	0.695	S	S	*	*			cis	-172.2	154.9	-42.8	-102.2	-55.5	0	0	0	113.6
1071	K	27.4	Very low	26.9	Very low	152 Å²	152	135.3 Å²	135.3	66%	0.661	69%	0.686	S	S	*	*			trans	65.8	-178.5	153.4	-123.7	168.8	-178.1	172.9	0	123.2	D1331 D1332	K1071-D1331 VanDerWaalsContact CE-O 3.32Å; K1071-D1331 WeakPolarHBondContact CE-O 3.29Å; K1071-D1332 WeakPolarHBondContact CE-O 3.44Å; K1071-D1332 PolarHBondContact NZ-O 3.17Å
1072	S	34.9	Very low	26.8	Very low	106 Å²	106	135.4 Å²	135.4	74%	0.741	69%	0.691	S	S	*	*			trans	-122.5	-168.2	-156.5	-69.8	0	0	0	0	114.7
1073	T	30.7	Very low	26.9	Very low	145 Å²	145	135.8 Å²	135.8	89%	0.89	70%	0.698	S	S	*	*			trans	94.5	174.5	159.6	-51.9	0	0	0	0	117.5
1074	L	23.4	Very low	26.8	Very low	140 Å²	140	139.5 Å²	139.5	73%	0.733	71%	0.712	S	S	*	*			trans	-104.4	135.8	-147.5	-100.5	165.3	0	0	0	116.3
1075	K	28.5	Very low	26.9	Very low	161 Å²	161	134.6 Å²	134.6	70%	0.7	71%	0.705	S	S	*	*			trans	5	124.3	154.4	-62.2	-179.8	-172.5	66.4	0	118
1076	Y	21.6	Very low	26.8	Very low	163 Å²	163	136.3 Å²	136.3	64%	0.639	71%	0.706	S	S	*	*				-162.1	155.4	97.9	-111.9	-44.2	0	0	0	114.2	K244	K244-Y1076 HydrophobicContact CD-CE1 3.9Å; K244-Y1076 PolarHBondContact NZ-OH 2.69Å
1077	L	22.4	Very low	26.6	Very low	126 Å²	126	134.1 Å²	134.1	66%	0.66	71%	0.707	S	S	*	*			trans	32.9	113.2	148.1	-70	158.9	0	0	0	119.8
1078	T	24	Very low	26.6	Very low	102 Å²	102	133.3 Å²	133.3	63%	0.626	70%	0.703	S	S	*	*				31.6	139.8	110.3	59.2	0	0	0	0	118.6
1079	M	24.4	Very low	26.6	Very low	150 Å²	150	131.5 Å²	131.5	74%	0.739	70%	0.699	S	S	*	*			cis	-173.7	160.8	31.7	-134.7	163.7	-172.9	0	0	113.2
1080	N	24.7	Very low	26.7	Very low	133 Å²	133	132.4 Å²	132.4	71%	0.711	70%	0.695	S	S	*	*			trans	66.4	168.4	143.1	-79.7	4.4	0	0	0	118.4
1081	S	25.1	Very low	27	Very low	77 Å²	77	128 Å²	128	54%	0.538	69%	0.693	S	S	.	*			cis	-151.2	160.5	5.5	-138.2	0	0	0	0	113.5
1082	N	23.4	Very low	26.7	Very low	137 Å²	137	128.6 Å²	128.6	73%	0.733	70%	0.702	S	S	*	*			trans	71.9	152.9	152.7	-56.7	-8.9	0	0	0	114.7
1083	T	28.6	Very low	26.1	Very low	121 Å²	121	126.7 Å²	126.7	74%	0.742	70%	0.699	S	S	*	*			cis	-116.1	132.6	25.3	46.8	0	0	0	0	113.4
1084	I	26	Very low	25.8	Very low	136 Å²	136	126.6 Å²	126.6	70%	0.697	69%	0.693	S	S	*	*				61.7	113.9	106.1	-54.7	165.9	0	0	0	110.9
1085	T	29.4	Very low	26	Very low	111 Å²	111	126.1 Å²	126.1	68%	0.681	69%	0.692	S	S	*	*			cis	-131.8	158.2	36.4	54.1	0	0	0	0	115.3
1086	N	30.4	Very low	26.4	Very low	133 Å²	133	124.9 Å²	124.9	71%	0.711	69%	0.692	S	S	*	*				33	124.8	128.5	-49	-2.7	0	0	0	117.3
1087	N	27.1	Very low	26.4	Very low	123 Å²	123	124.1 Å²	124.1	66%	0.658	70%	0.699	S	S	*	*			cis	-163.5	160.8	26.5	-110	-12.6	0	0	0	111.9
1088	N	28.1	Very low	26.8	Very low	119 Å²	119	122.9 Å²	122.9	64%	0.636	69%	0.693	S	S	*	*			trans	34.1	144.8	131.3	-54	-14.6	0	0	0	120.6
1089	N	26.5	Very low	26.8	Very low	119 Å²	119	124.7 Å²	124.7	64%	0.636	70%	0.698	S	S	*	*			cis	-169.6	176.5	-7.8	-110.3	-19.6	0	0	0	109.6
1090	N	29.2	Very low	26.8	Very low	130 Å²	130	124.2 Å²	124.2	70%	0.695	70%	0.699	S	S	*	*			trans	28.9	126.9	140.7	-54.8	-17.8	0	0	0	120.6
1091	S	30.7	Very low	27.2	Very low	105 Å²	105	121.2 Å²	121.2	73%	0.734	69%	0.688	S	S	*	*	S	Bend	trans	-32.7	136	137.2	170.2	0	0	0	0	113.9
1092	I	21.2	Very low	27.5	Very low	163 Å²	163	126.1 Å²	126.1	84%	0.836	70%	0.702	S	S	*	*			trans	76.3	131.5	174.7	-54.1	150.3	0	0	0	115.1
1093	G	21.9	Very low	27.9	Very low	67 Å²	67	123.6 Å²	123.6	69%	0.691	70%	0.695	S	S	*	*			trans	124	66.8	142.7	0	0	0	0	0	119
1094	N	24.4	Very low	27.8	Very low	143 Å²	143	122.2 Å²	122.2	77%	0.765	68%	0.683	S	S	*	*			trans	-11.1	142.6	151.6	-61.2	8.8	0	0	0	120.2
1095	N	29.5	Very low	27.8	Very low	130 Å²	130	119.5 Å²	119.5	70%	0.695	67%	0.67	S	S	*	*			trans	59.7	139.6	133.2	-54.8	6.9	0	0	0	121.6
1096	N	35.3	Very low	27.8	Very low	134 Å²	134	119.6 Å²	119.6	72%	0.717	68%	0.675	S	S	*	*				-170.8	155	116.1	-83.9	-26.7	0	0	0	108	N1098	N1096-N1098 PolarHBondContact OD1-N 3.39Å
1097	D	22.1	Very low	27.7	Very low	147 Å²	147	119.5 Å²	119.5	79%	0.786	68%	0.675	S	S	*	*	S	Bend	cis	-42	112	17.5	-73	-47	0	0	0	115
1098	N	30.5	Very low	27.7	Very low	100 Å²	100	120.2 Å²	120.2	54%	0.535	68%	0.678	S	S	.	*				88.7	125.8	61.4	-86.1	-40.1	0	0	0	110.8	N1096	N1096-N1098 PolarHBondContact OD1-N 3.39Å
1099	I	23.9	Very low	27.9	Very low	141 Å²	141	117.1 Å²	117.1	72%	0.723	67%	0.674	S	S	*	*			trans	68.8	125.8	168.6	-57	157.5	0	0	0	113.3
1100	N	25	Very low	28.1	Very low	140 Å²	140	115.8 Å²	115.8	75%	0.749	68%	0.675	S	S	*	*			trans	61.8	105.4	163.2	-62.9	-9.7	0	0	0	116.7
1101	S	32.6	Very low	27.8	Very low	70 Å²	70	114.8 Å²	114.8	49%	0.49	68%	0.675	S	S	.	*				81.2	147.8	74.9	82.4	0	0	0	0	115.1	S1103	S1101-S1103 PolarHBondContact O-OG 3.26Å
1102	Q	31.7	Very low	27.5	Very low	180 Å²	180	113.1 Å²	113.1	84%	0.841	68%	0.675	S	S	*	*			trans	60.3	-161.9	156.4	-57.7	168.9	27.7	0	0	115.1
1103	S	32.2	Very low	27.6	Very low	83 Å²	83	113.1 Å²	113.1	58%	0.58	68%	0.675	S	S	*	*			trans	53.7	119.6	149.9	28.6	0	0	0	0	119.7	S1101	S1101-S1103 PolarHBondContact O-OG 3.26Å
1104	L	26.4	Very low	27.7	Very low	93 Å²	93	114.9 Å²	114.9	49%	0.487	67%	0.672	S	S	.	*				70.5	120.2	51.3	-62.2	166.5	0	0	0	114.1	S1110	L1104-S1110 VanDerWaalsContact CD2-CA 3.48Å
1105	N	26	Very low	27.9	Very low	78 Å²	78	116.6 Å²	116.6	42%	0.417	68%	0.675	S	S	.	*				71.1	164	129.6	-61.7	21.9	0	0	0	115.6	D1108 G1109	N1105-D1108 PolarHBondContact ND2-OD1 2.81Å; N1105-G1109 PolarHBondContact ND2-N 3.29Å; N1105-G1109 PolarHBondContact OD1-N 3.36Å; N1105-G1109 VanDerWaalsContact OD1-N 3.11Å
1106	S	30	Very low	27.8	Very low	113 Å²	113	115 Å²	115	79%	0.79	67%	0.674	S	S	*	*	S	Bend	cis	-135.3	127.9	33.8	-69.4	0	0	0	0	113
1107	N	27.4	Very low	27.3	Very low	132 Å²	132	113.2 Å²	113.2	71%	0.706	67%	0.672	S	S	*	*	S	Bend	cis	-136.8	146.4	2	-69.5	-29.6	0	0	0	108.1
1108	D	27.7	Very low	27.4	Very low	137 Å²	137	113.4 Å²	113.4	73%	0.733	67%	0.671	S	S	*	*	S	Bend	cis	-146.7	157.3	4.7	-95.6	-44.7	0	0	0	110.7	N1105	N1105-D1108 PolarHBondContact ND2-OD1 2.81Å
1109	G	31.2	Very low	27	Very low	54 Å²	54	114.7 Å²	114.7	56%	0.557	68%	0.678	S	S	*	*			trans	126.8	61.2	139.7	0	0	0	0	0	119.8	N1105	N1105-G1109 PolarHBondContact ND2-N 3.29Å; N1105-G1109 PolarHBondContact OD1-N 3.36Å; N1105-G1109 VanDerWaalsContact OD1-N 3.11Å
1110	S	31.3	Very low	26.9	Very low	92 Å²	92	112.5 Å²	112.5	64%	0.643	68%	0.676	S	S	*	*			trans	51.8	94.7	134.2	-54.6	0	0	0	0	120.1	L1104	L1104-S1110 VanDerWaalsContact CD2-CA 3.48Å
1111	P	24	Very low	26.8	Very low	109 Å²	109	110.3 Å²	110.3	71%	0.708	68%	0.677	S	S	*	*			trans	-89.9	139.4	171.9	34.5	-33.1	0	0	0	114.9
1112	G	23.5	Very low	26.3	Very low	70 Å²	70	115.1 Å²	115.1	72%	0.722	69%	0.692	S	S	*	*			trans	89.6	177.1	134.8	0	0	0	0	0	121.1
1113	I	23.6	Very low	25.8	Very low	163 Å²	163	111.6 Å²	111.6	84%	0.836	68%	0.683	S	S	*	*			trans	52	114.4	163.3	-4.3	-179.3	0	0	0	116.7
1114	T	24.3	Very low	25.4	Very low	103 Å²	103	113 Å²	113	63%	0.632	69%	0.688	S	S	*	*				-179.6	152.5	69.2	45.7	0	0	0	0	110.6
1115	H	28.4	Very low	25.3	Very low	179 Å²	179	119.6 Å²	119.6	83%	0.829	71%	0.707	S	S	*	*			trans	61.5	143.1	167.1	-53.5	-62.3	0	0	0	117.3
1116	S	27.3	Very low	25.2	Very low	96 Å²	96	118.5 Å²	118.5	67%	0.671	72%	0.715	S	S	*	*			cis	-157.5	139.1	-12.6	49.7	0	0	0	0	111
1117	S	24.2	Very low	25.2	Very low	97 Å²	97	120.9 Å²	120.9	68%	0.678	72%	0.724	S	S	*	*				29.2	135.7	127.4	-43.4	0	0	0	0	121.6
1118	I	23.9	Very low	25.2	Very low	151 Å²	151	117.4 Å²	117.4	77%	0.774	72%	0.72	S	S	*	*			trans	70.6	136	132.6	-66.9	171.4	0	0	0	116
1119	D	22.9	Very low	25.2	Very low	127 Å²	127	116.5 Å²	116.5	68%	0.679	72%	0.724	S	S	*	*			cis	-141.8	162.9	4.9	-123.2	-15.9	0	0	0	109.7
1120	S	22.1	Very low	25	Very low	96 Å²	96	117 Å²	117	67%	0.671	73%	0.73	S	S	*	*				48.5	148.8	79.5	-44.1	0	0	0	0	117.9
1121	A	23	Very low	25	Very low	94 Å²	94	116.6 Å²	116.6	78%	0.777	74%	0.74	S	S	*	*			trans	63.2	149.1	164.5	0	0	0	0	0	116.4
1122	Q	21.2	Very low	25.1	Very low	171 Å²	171	117.9 Å²	117.9	80%	0.799	74%	0.74	S	S	*	*			cis	64.1	111.3	44.8	-81.6	-157.3	35.7	0	0	115.8
1123	T	21.6	Very low	25.2	Very low	106 Å²	106	121 Å²	121	65%	0.65	74%	0.74	S	S	*	*				67.3	98.2	125.2	-45.4	0	0	0	0	119
1124	V	23.1	Very low	25.4	Very low	112 Å²	112	124.3 Å²	124.3	68%	0.679	74%	0.742	S	S	*	*			trans	68.8	132.1	143.7	-176.5	0	0	0	0	114.5
1125	Y	25.2	Very low	25.4	Very low	231 Å²	231	128.7 Å²	128.7	91%	0.906	75%	0.752	S	S	*	*			cis	-124.3	168.3	36.2	-71.8	-101.7	0	0	0	111.9
1126	G	24.1	Very low	25.5	Very low	56 Å²	56	124.1 Å²	124.1	58%	0.577	74%	0.738	S	S	*	*			cis	153.5	170	-0.5	0	0	0	0	0	110.5
1127	V	29.7	Very low	25.5	Very low	162 Å²	162	123.1 Å²	123.1	98%	0.982	72%	0.722	S	S	*	*			trans	68.3	133.6	-173.7	-166.5	0	0	0	0	113.6
1128	G	27.1	Very low	25.7	Very low	60 Å²	60	123.6 Å²	123.6	62%	0.619	71%	0.709	S	S	*	*			cis	169.7	149	-9.7	0	0	0	0	0	112.8
1129	S	28.5	Very low	26	Very low	118 Å²	118	122 Å²	122	83%	0.825	71%	0.706	S	S	*	*			trans	65.7	144.6	176.9	-56.7	0	0	0	0	116.8
1130	G	26.4	Very low	26.1	Very low	65 Å²	65	120 Å²	120	67%	0.67	71%	0.708	S	S	*	*			cis	154.6	132	-8.6	0	0	0	0	0	111.9
1131	G	30.3	Very low	26.3	Very low	82 Å²	82	121.8 Å²	121.8	85%	0.845	71%	0.714	S	S	*	*			trans	172.8	102.1	178.9	0	0	0	0	0	115.9
1132	N	25.9	Very low	26.8	Very low	136 Å²	136	124.7 Å²	124.7	73%	0.727	72%	0.716	S	S	*	*			trans	-87.2	168.9	177.5	-73.1	-57.3	0	0	0	113.8
1133	L	26.6	Very low	27.1	Very low	136 Å²	136	120.6 Å²	120.6	71%	0.712	71%	0.712	S	S	*	*				106.9	133.3	126.1	-125.8	77.3	0	0	0	121.1
1134	R	27.9	Very low	27.5	Very low	233 Å²	233	120.9 Å²	120.9	88%	0.879	71%	0.713	S	S	*	*			trans	84	150.8	149.6	-84.4	169.4	-167.9	-172.1	2.8	122.7
1135	K	23	Very low	27.6	Very low	194 Å²	194	120.2 Å²	120.2	84%	0.843	72%	0.719	S	S	*	*			trans	-108.6	-174.5	175.5	-56	175.5	179	177.6	0	107.7
1136	P	31.5	Very low	27.5	Very low	83 Å²	83	114.8 Å²	114.8	54%	0.539	72%	0.715	S	S	.	*			cis	-134.7	-171.6	-40.9	34.3	-15.1	0	0	0	114.4	H1509	P1136-H1509 WeakPolarHBondContact CB-ND1 3.49Å; P1136-H1509 WeakPolarHBondContact CG-CE1 3.41Å
1137	K	27.8	Very low	27.7	Very low	75 Å²	75	115.1 Å²	115.1	33%	0.326	72%	0.719	S	S	.	*			trans	-28.2	151.3	159.7	-96.4	178.5	175.3	153.2	0	115	S1166 S1167 T1510	K1137-S1166 PolarHBondContact NZ-O 3.15Å; K1137-S1167 PolarHBondContact NZ-OG 3.06Å; K1137-T1510 WeakPolarHBondContact CD-OG1 3.48Å; K1137-T1510 WeakPolarHBondContact CE-OG1 3.44Å; K1137-T1510 WeakPolarHBondContact CG-OG1 3.33Å; K1137-T1510 VanDerWaalsContact NZ-CG2 3.3Å; K1137-T1510 PolarHBondContact NZ-OG1 2.93Å
1138	R	28.5	Very low	27.4	Very low	107 Å²	107	114.1 Å²	114.1	40%	0.404	71%	0.713	S	S	.	*				-172.7	166.2	51.5	-155.4	-175.6	-161.6	169.8	5.1	114.4	S1167 S1507	R1138-S1167 PolarHBondContact NH2-O 3.22Å; R1138-S1167 VanDerWaalsContact NH2-O 3.15Å; R1138-S1507 PolarHBondContact NH1-OG 2.72Å; R1138-S1507 VanDerWaalsContact NH1-OG 3.14Å
1139	T	29	Very low	27.6	Very low	118 Å²	118	117 Å²	117	72%	0.724	72%	0.719	S	S	*	*			trans	88.9	91.1	146.4	5.2	0	0	0	0	122.7
1140	A	26.2	Very low	27.6	Very low	85 Å²	85	119.3 Å²	119.3	70%	0.702	72%	0.72	S	S	*	*				70.4	157.7	114.8	0	0	0	0	0	124.8
1141	T	25.5	Very low	27.8	Very low	133 Å²	133	119.5 Å²	119.5	82%	0.816	72%	0.722	S	S	*	*			trans	73.6	80.3	153.8	23.6	0	0	0	0	120.4
1142	L	32.9	Very low	27.8	Very low	156 Å²	156	120.9 Å²	120.9	82%	0.817	72%	0.719	S	S	*	*				-141.7	143.2	124.4	-93.6	116.8	0	0	0	106.3	V1144	L1142-V1144 HydrophobicContact CD2-CG2 4.44Å
1143	A	28.8	Very low	28.2	Very low	85 Å²	85	120.5 Å²	120.5	70%	0.702	72%	0.722	S	S	*	*			cis	73.7	151.4	34.5	0	0	0	0	0	113.6
1144	V	29.4	Very low	28.4	Very low	111 Å²	111	121.5 Å²	121.5	67%	0.673	73%	0.726	S	S	*	*			trans	65.2	99	-175.7	-173.7	0	0	0	0	114.9	L1142	L1142-V1144 HydrophobicContact CD2-CG2 4.44Å
1145	A	25	Very low	28.7	Very low	98 Å²	98	117.1 Å²	117.1	81%	0.81	72%	0.719	S	S	*	*	S	Bend		-90.6	136.7	124.1	0	0	0	0	0	106.6
1146	S	24.2	Very low	29.1	Very low	117 Å²	117	114.1 Å²	114.1	82%	0.818	72%	0.717	S	S	*	*			trans	60.6	126	178.3	-50.1	0	0	0	0	116.2
1147	G	27	Very low	29.1	Very low	64 Å²	64	114.4 Å²	114.4	66%	0.66	73%	0.726	S	S	*	*			cis	140.1	129.6	7.1	0	0	0	0	0	109.9
1148	T	24	Very low	29.4	Very low	141 Å²	141	121.1 Å²	121.1	87%	0.865	76%	0.755	S	S	*	*			trans	-157.3	136.3	177.6	19.8	0	0	0	0	106.9
1149	T	31.7	Very low	29.6	Very low	119 Å²	119	123.9 Å²	123.9	73%	0.73	77%	0.77	S	S	*	*	S	Bend	cis	-139	125.4	18.9	-59	0	0	0	0	110.8
1150	I	28.7	Very low	29.9	Very low	167 Å²	167	122 Å²	122	86%	0.856	76%	0.761	S	S	*	*			trans	48.1	95.6	166.1	-51.8	172.9	0	0	0	117.1
1151	G	29.6	Very low	30.1	Very low	70 Å²	70	128.9 Å²	128.9	72%	0.722	77%	0.768	S	S	*	*			trans	81.2	153.2	152.8	0	0	0	0	0	118
1152	S	31.6	Very low	30.4	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	76%	0.764	S	S	*	*			cis	-156.9	144.1	-10.8	-81.3	0	0	0	0	111.1
1153	T	32.9	Very low	30.3	Very low	129 Å²	129	124.1 Å²	124.1	79%	0.791	74%	0.742	S	S	*	*			trans	61.7	137.5	164.2	47.7	0	0	0	0	120.4
1154	I	31.9	Very low	30.4	Very low	156 Å²	156	121.4 Å²	121.4	80%	0.8	72%	0.718	S	S	*	*			trans	73	149.7	158.8	-68.2	165.9	0	0	0	116.9
1155	I	33	Very low	30.6	Very low	142 Å²	142	120.8 Å²	120.8	73%	0.728	71%	0.714	S	S	*	*			cis	-162.2	150.4	-30.7	-93.8	177.8	0	0	0	105.1
1156	T	31.7	Very low	30.9	Very low	131 Å²	131	119.6 Å²	119.6	80%	0.804	70%	0.7	S	S	*	*			cis	-146.4	-60.4	-48.3	46.7	0	0	0	0	109
1157	A	32.7	Very low	31.2	Very low	89 Å²	89	115.8 Å²	115.8	74%	0.736	67%	0.673	S	S	*	*			trans	64.4	158.8	171.2	0	0	0	0	0	119.7
1158	K	32.7	Very low	31.5	Very low	215 Å²	215	118.5 Å²	118.5	94%	0.935	67%	0.672	S	S	*	*			trans	-150.5	159.1	174.5	-61.4	-172.4	-178.6	179.7	0	109.7
1159	K	32.5	Very low	31.8	Very low	165 Å²	165	114.8 Å²	114.8	72%	0.717	65%	0.649	S	S	*	*			trans	-138.6	146.7	-166.5	-152.4	165.3	-172.3	174.7	0	116
1160	P	35.7	Very low	31.8	Very low	80 Å²	80	113.5 Å²	113.5	52%	0.519	64%	0.641	S	S	.	*			trans	-106.8	177	-176.9	41.8	-37.1	0	0	0	114.5
1161	R	30.7	Very low	31.8	Very low	229 Å²	229	110.3 Å²	110.3	86%	0.864	63%	0.629	S	S	*	*			cis	-174.3	155.2	-20.6	-100.8	172.2	176.2	164.4	-2.6	109.9
1162	L	31.2	Very low	31.8	Very low	138 Å²	138	112.9 Å²	112.9	72%	0.723	62%	0.621	S	S	*	*			trans	67	162.1	158.6	-65.1	168.2	0	0	0	119.1
1163	S	31.7	Very low	32.3	Very low	51 Å²	51	112.9 Å²	112.9	36%	0.357	62%	0.618	S	S	.	*			cis	-179.8	141.4	-33.3	59.1	0	0	0	0	115.8	E1512	S1163-E1512 VanDerWaalsContact C-CD 3.41Å; S1163-E1512 WeakPolarHBondContact O-CB 3.37Å
1164	S	30.7	Very low	32.2	Very low	28 Å²	28	111.9 Å²	111.9	20%	0.196	61%	0.612	C	S	.	*			trans	88.4	72.2	158.8	67.8	0	0	0	0	123.1	E1512 N1515	S1164-E1512 WeakPolarHBondContact CA-OE1 3.48Å; S1164-E1512 PolarHBondContact N-OE1 3.01Å; S1164-E1512 WeakPolarHBondContact O-CB 3.28Å; S1164-E1512 WeakPolarHBondContact O-CG 3.5Å; S1164-N1515 PolarHBondContact OG-N 3Å
1165	V	33.2	Very low	32.2	Very low	98 Å²	98	110.2 Å²	110.2	59%	0.594	61%	0.609	S	S	*	*			trans	85.9	130.9	149.9	-173.7	0	0	0	0	119.5	E1512	V1165-E1512 PolarHBondContact N-OE1 2.71Å; V1165-E1512 WeakPolarHBondContact O-CG 3.18Å
1166	S	31.3	Very low	31.9	Very low	73 Å²	73	110.8 Å²	110.8	51%	0.51	61%	0.611	S	S	.	*			cis	-141.4	-135.7	-10.8	51.5	0	0	0	0	112	K1137	K1137-S1166 PolarHBondContact NZ-O 3.15Å
1167	S	31.6	Very low	31.8	Very low	36 Å²	36	112.6 Å²	112.6	25%	0.252	61%	0.612	S	S	.	*			cis	170.3	169.9	48.2	52.7	0	0	0	0	112	K1137 R1138 H1509	K1137-S1167 PolarHBondContact NZ-OG 3.06Å; R1138-S1167 PolarHBondContact NH2-O 3.22Å; R1138-S1167 VanDerWaalsContact NH2-O 3.15Å; S1167-H1509 PolarHBondContact OG-O 2.8Å
1168	L	31.9	Very low	31.7	Very low	121 Å²	121	116.8 Å²	116.8	63%	0.634	62%	0.618	S	S	*	*				-138.7	-147.4	-77.4	-154.8	69.2	0	0	0	110.8	I1506	L1168-I1506 PolarHBondContact O-N 2.82Å
1169	T	31.9	Very low	31.4	Very low	64 Å²	64	113.3 Å²	113.3	39%	0.393	61%	0.606	S	S	.	*	B	Isolated β-bridge	trans	-63.7	162.2	177.4	40.5	0	0	0	0	114.8	R1505 I1506 S1507	T1169-R1505 VanDerWaalsContact CA-C 3.46Å; T1169-I1506 CarbonylContact C-O 3.39Å; T1169-I1506 CarbonylContact O-C 3.47Å; T1169-S1507 PolarHBondContact O-N 2.98Å
1170	T	30.1	Very low	31.2	Very low	92 Å²	92	108.5 Å²	108.5	56%	0.564	60%	0.602	S	S	*	*			cis	-158.1	139.5	6.6	4.5	0	0	0	0	108.2	N1504 R1505 I1506	T1170-N1504 WeakPolarHBondContact CA-O 3.33Å; T1170-N1504 WeakPolarHBondContact CG2-O 3.46Å; T1170-R1505 CarbonylContact C-O 2.96Å; T1170-R1505 VanDerWaalsContact CA-C 3.41Å; T1170-R1505 WeakPolarHBondContact CA-O 3.44Å; T1170-R1505 PolarHBondContact N-O 2.84Å; T1170-I1506 CarbonylContact C-O 3.37Å; T1170-I1506 PolarHBondContact N-O 3.21Å
1171	T	29.7	Very low	30.9	Very low	99 Å²	99	111.9 Å²	111.9	61%	0.607	61%	0.609	S	S	*	*			cis	-143.8	-152.6	12.4	63.4	0	0	0	0	113.1	R1505 I1506	T1171-R1505 VanDerWaalsContact CA-O 3.23Å; T1171-R1505 WeakPolarHBondContact CA-O 3.46Å; T1171-R1505 PolarHBondContact N-O 3.47Å; T1171-I1506 WeakPolarHBondContact O-CB 3.09Å; T1171-I1506 WeakPolarHBondContact O-CD1 3.07Å
1172	K	30.2	Very low	30.9	Very low	124 Å²	124	106.7 Å²	106.7	54%	0.539	60%	0.603	S	S	.	*			trans	-151.6	173	-168.8	-153.3	-155.3	-179.4	-154.4	0	112.9	T1174 I1506	K1172-T1174 PolarHBondContact NZ-O 2.97Å; K1172-I1506 HydrophobicContact CB-CD1 4.45Å; K1172-I1506 HydrophobicContact CG-CD1 4.41Å
1173	P	41.1	Very low	31	Very low	110 Å²	110	106 Å²	106	71%	0.714	61%	0.605	S	S	*	*				-149.3	-167.9	106	39.3	-21.2	0	0	0	116.8
1174	T	31.1	Very low	31	Very low	109 Å²	109	112.4 Å²	112.4	67%	0.669	63%	0.626	S	S	*	*			trans	97.3	154.6	170.6	-47.4	0	0	0	0	118.8	K1172	K1172-T1174 PolarHBondContact NZ-O 2.97Å
1175	T	31.5	Very low	31	Very low	120 Å²	120	116.3 Å²	116.3	74%	0.736	65%	0.649	S	S	*	*			trans	-123.2	-144.6	-168.8	45.3	0	0	0	0	112.1
1176	M	27.4	Very low	30.8	Very low	155 Å²	155	117.8 Å²	117.8	76%	0.764	66%	0.658	S	S	*	*			cis	-166	177.4	9.9	-155.3	62.1	170.7	0	0	111.2
1177	M	29.1	Very low	30.8	Very low	168 Å²	168	120 Å²	120	83%	0.828	67%	0.673	S	S	*	*			trans	70.2	158.1	157.2	-80.1	173.1	167.2	0	0	120
1178	M	29.8	Very low	30.7	Very low	177 Å²	177	126.6 Å²	126.6	87%	0.872	70%	0.698	S	S	*	*			cis	-155.8	-146.8	-25.1	-155.4	157.5	179	0	0	111.7
1179	E	26.1	Very low	30.6	Very low	143 Å²	143	128.3 Å²	128.3	67%	0.668	70%	0.702	S	S	*	*			trans	-151	149.6	-163.2	-172.4	-95.6	-44.3	0	0	116.5	K1181	E1179-K1181 IonicContact OE1-NZ 2.75Å; E1179-K1181 PolarHBondContact OE1-NZ 3.03Å; E1179-K1181 WeakPolarHBondContact OE2-CG 3.13Å; E1179-K1181 IonicContact OE2-NZ 2.79Å; E1179-K1181 PolarHBondContact OE2-NZ 2.75Å
1180	G	29.5	Very low	30.4	Very low	63 Å²	63	130.8 Å²	130.8	65%	0.649	71%	0.709	S	S	*	*			trans	122.2	145.4	155	0	0	0	0	0	118.5
1181	K	29.4	Very low	30.1	Very low	151 Å²	151	132.1 Å²	132.1	66%	0.657	70%	0.704	S	S	*	*			cis	-168	155.1	-9.3	-124.1	-178.3	-167.9	70.1	0	114.9	E1179	E1179-K1181 IonicContact OE1-NZ 2.75Å; E1179-K1181 PolarHBondContact OE1-NZ 3.03Å; E1179-K1181 WeakPolarHBondContact OE2-CG 3.13Å; E1179-K1181 IonicContact OE2-NZ 2.79Å; E1179-K1181 PolarHBondContact OE2-NZ 2.75Å
1182	T	30.9	Very low	30	Very low	120 Å²	120	135.1 Å²	135.1	74%	0.736	70%	0.704	S	S	*	*			trans	77.2	154.3	145.8	53.6	0	0	0	0	125.9
1183	V	33	Very low	30	Very low	125 Å²	125	132.3 Å²	132.3	76%	0.758	71%	0.711	S	S	*	*			trans	75.1	123.8	163.9	-168.7	0	0	0	0	116
1184	K	31.4	Very low	29.3	Very low	184 Å²	184	133.5 Å²	133.5	80%	0.8	71%	0.711	S	S	*	*			cis	-156.2	160.1	-7.8	-102.8	171.6	-175.6	175.9	0	105.8
1185	T	30	Very low	29.2	Very low	111 Å²	111	135.5 Å²	135.5	68%	0.681	72%	0.718	S	S	*	*			cis	-157.9	148.8	10.5	-3.2	0	0	0	0	109.8
1186	T	30.7	Very low	29.1	Very low	128 Å²	128	133 Å²	133	79%	0.785	72%	0.716	S	S	*	*			trans	51.1	144.9	148.8	54	0	0	0	0	122.2
1187	S	31.4	Very low	29.1	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	72%	0.723	S	S	*	*			cis	-162.9	-175.9	-19.7	-158.4	0	0	0	0	109.9
1188	K	28.6	Very low	29	Very low	176 Å²	176	133.8 Å²	133.8	77%	0.765	73%	0.727	S	S	*	*			trans	-98.7	165.1	-177.3	-65.2	-179.4	177.3	178.2	0	114.3
1189	Q	29.3	Very low	28.8	Very low	157 Å²	157	136.2 Å²	136.2	73%	0.734	73%	0.726	S	S	*	*			trans	82.9	134	139.9	-90.7	168.4	-57.4	0	0	121.8
1190	H	28.2	Very low	28.9	Very low	115 Å²	115	135.2 Å²	135.2	53%	0.532	73%	0.73	S	S	.	*			trans	70.3	118.3	141.3	-89.4	-138.7	0	0	0	122.5
1191	R	24.6	Very low	28.8	Very low	120 Å²	120	137.6 Å²	137.6	45%	0.453	73%	0.732	S	S	.	*			trans	70.3	138.1	130.9	-70.3	-174	-178.6	-158.7	5.1	120.7	L156 L157	L156-R1191 PolarHBondContact O-NH1 2.92Å; L156-R1191 PolarHBondContact O-NH2 2.9Å; L157-R1191 HydrophobicContact CB-CG 3.89Å; L157-R1191 HydrophobicContact CD2-CG 4.44Å; L157-R1191 PolarHBondContact O-NE 3.42Å; L157-R1191 PolarHBondContact O-NH2 3.26Å
1192	R	27.8	Very low	28.7	Very low	162 Å²	162	136.8 Å²	136.8	61%	0.611	73%	0.733	S	S	*	*			trans	67	151.7	155	-72	-177.4	178.4	-156.4	-0.3	117	P154 G155 L156	P154-R1192 PolarHBondContact O-NH2 3.01Å; G155-R1192 PolarHBondContact O-NH2 3.11Å; L156-R1192 HydrophobicContact CD1-CG 4.09Å
1193	G	29.1	Very low	28.6	Very low	66 Å²	66	138 Å²	138	68%	0.68	73%	0.731	S	S	*	*			trans	96.9	65.7	136.3	0	0	0	0	0	115.8
1194	D	27.4	Very low	28.5	Very low	134 Å²	134	139.8 Å²	139.8	72%	0.717	72%	0.724	S	S	*	*			trans	11.9	131.3	133.8	-66.9	-85.1	0	0	0	119.8
1195	N	28.1	Very low	28.4	Very low	152 Å²	152	136.9 Å²	136.9	81%	0.813	71%	0.713	S	S	*	*			trans	45.8	99.5	132.6	-49.6	-42.2	0	0	0	116.7
1196	G	29.8	Very low	28.5	Very low	68 Å²	68	139.3 Å²	139.3	70%	0.701	72%	0.722	S	S	*	*			cis	118.7	175.1	27.4	0	0	0	0	0	110.4
1197	K	28	Very low	28.4	Very low	208 Å²	208	137 Å²	137	90%	0.904	72%	0.723	S	S	*	*			trans	60.8	122.9	172.9	-52	170.4	-174.7	168.6	0	117.2
1198	S	25.4	Very low	28.1	Very low	130 Å²	130	139.1 Å²	139.1	91%	0.909	73%	0.725	S	S	*	*			trans	-164	107.9	141.9	-93.8	0	0	0	0	113
1199	R	25.7	Very low	27.9	Very low	228 Å²	228	138.1 Å²	138.1	86%	0.86	73%	0.728	S	S	*	*	S	Bend	trans	-155.9	113.4	144.6	-173.6	170.6	-178.7	155.2	2.6	108.4
1200	T	28.2	Very low	27.6	Very low	122 Å²	122	134.8 Å²	134.8	75%	0.748	72%	0.722	S	S	*	*	S	Bend	trans	58.3	121.8	165.9	51.4	0	0	0	0	116.2
1201	T	27.4	Very low	27.3	Very low	114 Å²	114	135.5 Å²	135.5	70%	0.699	74%	0.735	S	S	*	*			cis	-157	122.7	21.4	-45.4	0	0	0	0	112.3
1202	I	28.3	Very low	27.2	Very low	133 Å²	133	135.8 Å²	135.8	68%	0.682	75%	0.75	S	S	*	*			trans	53.4	122.1	141.6	-57.3	174.8	0	0	0	120.7
1203	H	28.7	Very low	26.9	Very low	146 Å²	146	132.9 Å²	132.9	68%	0.676	75%	0.753	S	S	*	*			trans	67.9	153.3	153.5	-67.5	-19.6	0	0	0	118.9
1204	R	31.1	Very low	26.7	Very low	163 Å²	163	136.5 Å²	136.5	62%	0.615	75%	0.754	S	S	*	*			cis	-159.7	156.8	-12.3	-118.2	168.1	142.5	124.1	3.9	112.6
1205	E	29.6	Very low	26.5	Very low	122 Å²	122	137.2 Å²	137.2	57%	0.57	75%	0.751	S	S	*	*			trans	38	117.6	142.5	-68.2	150.4	-170.8	0	0	121.4
1206	D	30.3	Very low	26.4	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	75%	0.75	S	S	*	*				61.5	150.9	117.4	-44.8	-15.5	0	0	0	122.7
1207	G	29.7	Very low	26.3	Very low	79 Å²	79	143.7 Å²	143.7	81%	0.814	75%	0.753	S	S	*	*			trans	148.4	91.6	164	0	0	0	0	0	115
1208	D	25.6	Very low	26.3	Very low	165 Å²	165	138.7 Å²	138.7	88%	0.882	74%	0.74	S	S	*	*			trans	-87.6	165.8	174	-77.8	-62.1	0	0	0	113.6
1209	D	23.7	Very low	26.4	Very low	154 Å²	154	138.8 Å²	138.8	82%	0.824	73%	0.73	S	S	*	*			trans	95.6	140.5	138.8	-127.7	-14.8	0	0	0	123.1
1210	S	22.1	Very low	26.4	Very low	87 Å²	87	134.5 Å²	134.5	61%	0.608	72%	0.724	S	S	*	*			trans	73.5	107.6	151.1	74.7	0	0	0	0	123.3
1211	T	22.3	Very low	26.3	Very low	130 Å²	130	135.4 Å²	135.4	80%	0.798	72%	0.723	S	S	*	*			trans	70.9	165	130.4	67.2	0	0	0	0	122.2
1212	V	23.8	Very low	26.2	Very low	127 Å²	127	135.5 Å²	135.5	77%	0.77	72%	0.719	S	S	*	*			trans	61.6	90.1	166.5	-164.9	0	0	0	0	118.3
1213	C	21.4	Very low	26.1	Very low	100 Å²	100	135.6 Å²	135.6	68%	0.676	72%	0.717	S	S	*	*				37.3	146.7	113.2	-159.5	0	0	0	0	121.3
1214	M	23.8	Very low	25.9	Very low	142 Å²	142	134.2 Å²	134.2	70%	0.7	71%	0.714	S	S	*	*			trans	78.2	144.3	174.5	-44.2	-70.9	-169.3	0	0	114.2
1215	K	24.3	Very low	25.6	Very low	150 Å²	150	132 Å²	132	65%	0.652	72%	0.715	S	S	*	*			cis	-172	156.1	-24.7	-116.2	164.4	-170.4	162.4	0	106.1
1216	F	26.2	Very low	25.3	Very low	180 Å²	180	136.1 Å²	136.1	79%	0.789	73%	0.727	S	S	*	*			cis	-132.8	-173.3	6.2	-55.1	-103.3	0	0	0	108.3
1217	K	27.1	Very low	25	Very low	175 Å²	175	133.4 Å²	133.4	76%	0.761	72%	0.716	S	S	*	*			cis	-150	132.5	3.6	-155.9	178.2	177.9	-173.7	0	111.4
1218	T	27.6	Very low	24.7	Very low	104 Å²	104	135 Å²	135	64%	0.638	71%	0.706	S	S	*	*			trans	55.4	91.7	156.5	51.3	0	0	0	0	119.9
1219	D	26.7	Very low	24.5	Very low	131 Å²	131	134.7 Å²	134.7	70%	0.701	70%	0.701	S	S	*	*				85.9	93.4	113.4	-52.4	-19.3	0	0	0	122
1220	L	25.7	Very low	24.5	Very low	139 Å²	139	132.5 Å²	132.5	73%	0.728	70%	0.696	S	S	*	*				64.1	105.1	122.7	-65.2	142.6	0	0	0	118
1221	L	26.4	Very low	24.6	Very low	140 Å²	140	135.2 Å²	135.2	73%	0.733	70%	0.699	S	S	*	*				67.9	130.4	61.5	-57.7	168.1	0	0	0	111.8
1222	N	26.2	Very low	24.6	Very low	116 Å²	116	136.2 Å²	136.2	62%	0.62	70%	0.699	S	S	*	*			cis	-143.1	144.5	17.8	-108.9	4	0	0	0	111.6
1223	Q	26	Very low	24.6	Very low	136 Å²	136	135 Å²	135	64%	0.636	70%	0.696	S	S	*	*				60.8	133.3	84.7	-62.2	-166.4	-71.1	0	0	114.6
1224	D	25.4	Very low	24.8	Very low	116 Å²	116	139.3 Å²	139.3	62%	0.62	71%	0.709	S	S	*	*			cis	-166.2	175.5	-2	-111.4	-11.4	0	0	0	112.7
1225	D	24.6	Very low	24.9	Very low	118 Å²	118	135 Å²	135	63%	0.631	70%	0.697	S	S	*	*			trans	69.6	117.2	149.1	-73.4	14.5	0	0	0	120.1
1226	Y	22.4	Very low	24.9	Very low	208 Å²	208	132.6 Å²	132.6	82%	0.816	69%	0.691	S	S	*	*				76.7	145.3	79.3	-75.5	-45.5	0	0	0	113.7
1227	T	23.2	Very low	25	Very low	105 Å²	105	132 Å²	132	64%	0.644	69%	0.69	S	S	*	*			cis	-166.7	156.2	12.3	-126	0	0	0	0	115.5
1228	L	23.7	Very low	25.1	Very low	113 Å²	113	128.3 Å²	128.3	59%	0.592	68%	0.678	S	S	*	*			trans	54.2	116.9	156.4	-84.3	41.5	0	0	0	125.5	L166	L166-L1228 HydrophobicContact CD1-CD2 3.48Å; L166-L1228 VanDerWaalsContact CD1-CD2 3.48Å; L166-L1228 HydrophobicContact CD1-CG 3.95Å
1229	M	21.8	Very low	25.1	Very low	158 Å²	158	126.3 Å²	126.3	78%	0.778	67%	0.669	S	S	*	*				45.9	129	110.4	-56.5	-61.7	169.3	0	0	122.6
1230	C	23.1	Very low	25.2	Very low	107 Å²	107	120.3 Å²	120.3	72%	0.723	64%	0.637	S	S	*	*				-169.2	138.6	103	-113.1	0	0	0	0	116.5
1231	E	24.2	Very low	25.3	Very low	145 Å²	145	117.3 Å²	117.3	68%	0.678	63%	0.633	S	S	*	*			trans	12.5	141.3	163	-51.3	-170.9	151.6	0	0	124.9
1232	N	23.9	Very low	25.4	Very low	150 Å²	150	117.1 Å²	117.1	80%	0.802	63%	0.632	S	S	*	*			trans	108.4	149	147.1	-62.1	-74.6	0	0	0	119.6
1233	S	24.1	Very low	25.5	Very low	101 Å²	101	115.5 Å²	115.5	71%	0.706	63%	0.634	S	S	*	*			trans	96.8	159.2	159.4	-151.7	0	0	0	0	118.9	A1235	S1233-A1235 VanDerWaalsContact C-N 3.35Å; S1233-A1235 PolarHBondContact O-N 3Å; S1233-A1235 VanDerWaalsContact O-N 3.1Å
1234	M	24.6	Very low	25.5	Very low	191 Å²	191	111.7 Å²	111.7	94%	0.941	62%	0.616	S	S	*	*	S	Bend	trans	-85.9	65.8	-171.1	-63.7	170.1	-73.7	0	0	111.3
1235	A	25.2	Very low	25.8	Very low	53 Å²	53	114.5 Å²	114.5	44%	0.438	63%	0.626	S	S	.	*			trans	-106.7	-27.4	-178.8	0	0	0	0	0	114.1	S1233 E1237 L1238	S1233-A1235 VanDerWaalsContact C-N 3.35Å; S1233-A1235 PolarHBondContact O-N 3Å; S1233-A1235 VanDerWaalsContact O-N 3.1Å; A1235-E1237 PolarHBondContact O-N 2.67Å; A1235-L1238 PolarHBondContact O-N 3.32Å; A1235-L1238 VanDerWaalsContact O-N 3.15Å
1236	D	25.3	Very low	26.1	Very low	99 Å²	99	116.9 Å²	116.9	53%	0.529	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	-0.8	-167.2	-60.3	-34.9	0	0	0	116
1237	E	28.8	Very low	26.5	Very low	166 Å²	166	112.9 Å²	112.9	78%	0.776	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-2.6	176.1	-150.7	174.4	-134	0	0	112.7	A1235	A1235-E1237 PolarHBondContact O-N 2.67Å
1238	L	28.5	Very low	26.9	Very low	99 Å²	99	114.9 Å²	114.9	52%	0.518	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.2	-28.6	176.3	-140.9	81.8	0	0	0	113.9	A1235	A1235-L1238 PolarHBondContact O-N 3.32Å; A1235-L1238 VanDerWaalsContact O-N 3.15Å
1239	S	27.5	Very low	27.5	Very low	62 Å²	62	114.5 Å²	114.5	43%	0.434	62%	0.621	S	S	.	*	S	Bend	trans	-78.8	-24.8	176.9	-53.3	0	0	0	0	113.3	A1243	S1239-A1243 WeakPolarHBondContact O-CB 3.38Å; S1239-A1243 PolarHBondContact O-N 3.26Å
1240	A	28.4	Very low	28.1	Very low	5 Å²	5	114 Å²	114	4%	0.041	62%	0.617	C	S	.	*	G	3₁₀ helix	trans	-62.4	-57.2	172.1	0	0	0	0	0	110.9	P331 E335 L1242 A1243	P331-A1240 HydrophobicContact CB-CB 3.77Å; E335-A1240 WeakPolarHBondContact OE2-CA 3.48Å; E335-A1240 VanDerWaalsContact OE2-CB 3.25Å; E335-A1240 WeakPolarHBondContact OE2-CB 3.36Å; A1240-L1242 PolarHBondContact O-N 2.72Å; A1240-A1243 PolarHBondContact O-N 2.81Å
1241	A	27.3	Very low	28.7	Very low	76 Å²	76	115.2 Å²	115.2	63%	0.628	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-68.5	18.2	177.1	0	0	0	0	0	115.6
1242	L	29.7	Very low	29.3	Very low	136 Å²	136	112.4 Å²	112.4	71%	0.712	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-136.1	5.9	171.4	-70.8	175.1	0	0	0	112.5	A1240	A1240-L1242 PolarHBondContact O-N 2.72Å
1243	A	28	Very low	30.2	Very low	81 Å²	81	109 Å²	109	67%	0.669	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	-6.9	-179.3	0	0	0	0	0	113.9	S1239 A1240	S1239-A1243 WeakPolarHBondContact O-CB 3.38Å; S1239-A1243 PolarHBondContact O-N 3.26Å; A1240-A1243 PolarHBondContact O-N 2.81Å
1244	E	26.8	Very low	30.9	Very low	57 Å²	57	112 Å²	112	27%	0.266	59%	0.587	S	S	.	*			trans	-111.9	48.2	-179	-142.2	-175.9	-125.5	0	0	112.9	E335 F1247	E335-E1244 WeakPolarHBondContact CA-OE1 3.11Å; E335-E1244 HydrophobicContact CB-CG 4.49Å; E335-E1244 VanDerWaalsContact CB-OE1 3.27Å; E335-E1244 WeakPolarHBondContact CB-OE1 3.47Å; E1244-F1247 HydrophobicContact CB-CE2 4.42Å; E1244-F1247 HydrophobicContact CG-CE2 3.77Å; E1244-F1247 HydrophobicContact CG-CZ 4.41Å; E1244-F1247 VanDerWaalsContact O-CD2 3.25Å; E1244-F1247 WeakPolarHBondContact O-CD2 3.41Å; E1244-F1247 WeakPolarHBondContact O-CE2 3.35Å; E1244-F1247 WeakPolarHBondContact OE2-CE2 3.4Å
1245	E	31.1	Very low	31.5	Very low	174 Å²	174	110.4 Å²	110.4	81%	0.813	58%	0.577	S	S	*	*			trans	-104	63.5	167.9	-76.2	-168.8	177.6	0	0	111.5
1246	N	31	Very low	32	Very low	168 Å²	168	111 Å²	111	90%	0.898	57%	0.572	S	S	*	*			trans	-123.3	45.5	164.3	-111.8	-26.7	0	0	0	109.9
1247	F	30.6	Very low	32.7	Very low	125 Å²	125	109.5 Å²	109.5	55%	0.548	57%	0.568	S	S	.	*			trans	-108.7	139.4	-177.2	-80.3	-71.8	0	0	0	112.9	E1244 F1249 L1252	E1244-F1247 HydrophobicContact CB-CE2 4.42Å; E1244-F1247 HydrophobicContact CG-CE2 3.77Å; E1244-F1247 HydrophobicContact CG-CZ 4.41Å; E1244-F1247 VanDerWaalsContact O-CD2 3.25Å; E1244-F1247 WeakPolarHBondContact O-CD2 3.41Å; E1244-F1247 WeakPolarHBondContact O-CE2 3.35Å; E1244-F1247 WeakPolarHBondContact OE2-CE2 3.4Å; F1247-F1249 PolarHBondContact O-N 3.36Å; F1247-L1252 HydrophobicContact CB-CD1 4.44Å
1248	Q	30.5	Very low	33.3	Very low	147 Å²	147	103.9 Å²	103.9	69%	0.687	56%	0.555	S	S	*	*			trans	-67	124.7	175.4	-68.8	-178.3	-42.7	0	0	110.8	E1250 K1251	Q1248-E1250 VanDerWaalsContact C-N 3.26Å; Q1248-E1250 PolarHBondContact O-N 3.02Å; Q1248-E1250 VanDerWaalsContact O-N 3.13Å; Q1248-K1251 PolarHBondContact O-N 2.78Å
1249	F	36.7	Very low	34.3	Very low	105 Å²	105	103.4 Å²	103.4	46%	0.461	56%	0.557	S	S	.	*	H	α-helix	trans	-48.2	-41.7	-171.1	-178.9	-106.5	0	0	0	114.2	F1247 K1251 L1252 V1253	F1247-F1249 PolarHBondContact O-N 3.36Å; F1249-K1251 PolarHBondContact O-N 2.98Å; F1249-L1252 WeakPolarHBondContact O-CA 3.49Å; F1249-L1252 WeakPolarHBondContact O-CB 3.3Å; F1249-L1252 PolarHBondContact O-N 2.64Å; F1249-V1253 HydrophobicContact CD1-CG2 4.2Å; F1249-V1253 HydrophobicContact CE1-CG2 3.9Å; F1249-V1253 HydrophobicContact CE2-CG2 4.37Å; F1249-V1253 HydrophobicContact CZ-CG2 3.99Å; F1249-V1253 PolarHBondContact O-N 3.24Å
1250	E	35.8	Very low	35.5	Very low	148 Å²	148	100.9 Å²	100.9	69%	0.692	54%	0.54	S	S	*	.	H	α-helix	trans	-61.6	-41.8	-174.9	-64.7	157	129	0	0	112.5	Q1248 L1252 V1253 E1254	Q1248-E1250 VanDerWaalsContact C-N 3.26Å; Q1248-E1250 PolarHBondContact O-N 3.02Å; Q1248-E1250 VanDerWaalsContact O-N 3.13Å; E1250-L1252 VanDerWaalsContact C-N 3.26Å; E1250-L1252 PolarHBondContact O-N 3.44Å; E1250-V1253 PolarHBondContact O-N 3.16Å; E1250-E1254 PolarHBondContact O-N 3.14Å
1251	K	35.4	Very low	37	Very low	132 Å²	132	104.1 Å²	104.1	57%	0.574	56%	0.556	S	S	*	*	H	α-helix	trans	-69.9	-22.4	174.9	-80.5	-175.6	174.9	176.5	0	113.5	Q1248 F1249 Q1255	Q1248-K1251 PolarHBondContact O-N 2.78Å; F1249-K1251 PolarHBondContact O-N 2.98Å; K1251-Q1255 WeakPolarHBondContact O-CB 3.45Å; K1251-Q1255 WeakPolarHBondContact O-CG 3.15Å; K1251-Q1255 PolarHBondContact O-N 3.45Å
1252	L	36.8	Very low	38.4	Very low	85 Å²	85	101.3 Å²	101.3	45%	0.445	53%	0.53	S	S	.	.	H	α-helix	trans	-80	-38.1	177.6	-131.2	167.9	0	0	0	110.3	F1247 F1249 E1250 Q1255 L1256	F1247-L1252 HydrophobicContact CB-CD1 4.44Å; F1249-L1252 WeakPolarHBondContact O-CA 3.49Å; F1249-L1252 WeakPolarHBondContact O-CB 3.3Å; F1249-L1252 PolarHBondContact O-N 2.64Å; E1250-L1252 VanDerWaalsContact C-N 3.26Å; E1250-L1252 PolarHBondContact O-N 3.44Å; L1252-Q1255 CarbonylContact O-C 3.57Å; L1252-Q1255 PolarHBondContact O-N 3.43Å; L1252-L1256 WeakPolarHBondContact O-CG 3.25Å; L1252-L1256 PolarHBondContact O-N 3.05Å
1253	V	42.2	Very low	39.7	Very low	79 Å²	79	99.4 Å²	99.4	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-63	-41.8	172.8	176.6	0	0	0	0	111.6	F1249 E1250 Q1255 L1256	F1249-V1253 HydrophobicContact CD1-CG2 4.2Å; F1249-V1253 HydrophobicContact CE1-CG2 3.9Å; F1249-V1253 HydrophobicContact CE2-CG2 4.37Å; F1249-V1253 HydrophobicContact CZ-CG2 3.99Å; F1249-V1253 PolarHBondContact O-N 3.24Å; E1250-V1253 PolarHBondContact O-N 3.16Å; V1253-Q1255 VanDerWaalsContact C-N 3.26Å; V1253-Q1255 PolarHBondContact O-N 2.83Å; V1253-L1256 PolarHBondContact O-N 3.21Å
1254	E	38.6	Very low	41.1	Very low	165 Å²	165	100.4 Å²	100.4	77%	0.771	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-21.8	174.3	-69.8	-172.8	146.6	0	0	114	E1250	E1250-E1254 PolarHBondContact O-N 3.14Å
1255	Q	37	Very low	42.6	Very low	157 Å²	157	98.6 Å²	98.6	73%	0.734	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-7.8	178.8	-72.5	-175.3	47	0	0	114.2	K1251 L1252 V1253 P1257	K1251-Q1255 WeakPolarHBondContact O-CB 3.45Å; K1251-Q1255 WeakPolarHBondContact O-CG 3.15Å; K1251-Q1255 PolarHBondContact O-N 3.45Å; L1252-Q1255 CarbonylContact O-C 3.57Å; L1252-Q1255 PolarHBondContact O-N 3.43Å; V1253-Q1255 VanDerWaalsContact C-N 3.26Å; V1253-Q1255 PolarHBondContact O-N 2.83Å; Q1255-P1257 WeakPolarHBondContact O-CD 2.87Å
1256	L	37	Very low	43.7	Very low	66 Å²	66	91.4 Å²	91.4	35%	0.346	47%	0.471	S	S	.	.	S	Bend	trans	-63.7	123	168.7	-79.7	173.9	0	0	0	108.9	L1252 V1253 G1258 Y1450	L1252-L1256 WeakPolarHBondContact O-CG 3.25Å; L1252-L1256 PolarHBondContact O-N 3.05Å; V1253-L1256 PolarHBondContact O-N 3.21Å; L1256-G1258 PolarHBondContact O-N 3.4Å; L1256-G1258 VanDerWaalsContact O-N 3.09Å; L1256-Y1450 HydrophobicContact CD2-CD1 4Å; L1256-Y1450 HydrophobicContact CD2-CE1 3.91Å
1257	P	39.6	Very low	44.7	Very low	67 Å²	67	86.5 Å²	86.5	44%	0.435	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-65.5	117.9	177.9	26.6	-33	0	0	0	109	Q1255	Q1255-P1257 WeakPolarHBondContact O-CD 2.87Å
1258	G	41.6	Very low	45.8	Very low	48 Å²	48	83.6 Å²	83.6	50%	0.495	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-51.5	160.6	176.2	0	0	0	0	0	113	L1256	L1256-G1258 PolarHBondContact O-N 3.4Å; L1256-G1258 VanDerWaalsContact O-N 3.09Å
1259	P	48.3	Very low	47	Very low	88 Å²	88	76.8 Å²	76.8	57%	0.571	40%	0.4	S	S	*	.	S	Bend	trans	-46.7	122.3	-165.2	17	-32	0	0	0	111.6	D1261 H1451	P1259-D1261 PolarHBondContact O-N 2.83Å; P1259-H1451 HydrophobicContact CB-CB 4.36Å
1260	P	53.5	Low	47.7	Very low	10 Å²	10	72.3 Å²	72.3	7%	0.065	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-63.2	127.2	-156.3	21	-33.7	0	0	0	112.5	L1262 L1442 S1445	P1260-L1262 WeakPolarHBondContact O-CG 3.32Å; P1260-L1262 PolarHBondContact O-N 3.3Å; P1260-L1442 HydrophobicContact CB-CD1 3.66Å; P1260-L1442 HydrophobicContact CB-CG 4.39Å; P1260-S1445 WeakPolarHBondContact CB-OG 3.46Å
1261	D	59.3	Low	48.6	Very low	73 Å²	73	68.2 Å²	68.2	39%	0.39	36%	0.362	S	S	.	.			trans	-62.3	99.8	174.5	-180	-2.5	0	0	0	110.3	P1259 N1263 R1264 T1265	P1259-D1261 PolarHBondContact O-N 2.83Å; D1261-N1263 PolarHBondContact O-N 3.4Å; D1261-N1263 VanDerWaalsContact O-N 3.1Å; D1261-N1263 WeakPolarHBondContact OD1-CA 3.4Å; D1261-N1263 VanDerWaalsContact OD1-CB 3.26Å; D1261-N1263 WeakPolarHBondContact OD1-CB 3.34Å; D1261-N1263 PolarHBondContact OD1-N 2.84Å; D1261-N1263 PolarHBondContact OD1-ND2 3.5Å; D1261-R1264 HydrophobicContact CB-CB 3.72Å; D1261-R1264 WeakPolarHBondContact O-CB 3.46Å; D1261-R1264 PolarHBondContact O-N 3.44Å; D1261-R1264 PolarHBondContact OD1-N 3.06Å; D1261-R1264 WeakPolarHBondContact OD2-CB 3.32Å; D1261-T1265 PolarHBondContact O-N 2.84Å
1262	L	57.9	Low	49.2	Very low	16 Å²	16	65.2 Å²	65.2	8%	0.084	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-3.7	179.2	-59.4	-177.8	0	0	0	113.5	P1260 T1265 L1446 V1453 K1531 F1978	P1260-L1262 WeakPolarHBondContact O-CG 3.32Å; P1260-L1262 PolarHBondContact O-N 3.3Å; L1262-T1265 PolarHBondContact O-OG1 2.77Å; L1262-L1446 HydrophobicContact CD2-CD1 3.69Å; L1262-V1453 HydrophobicContact CD1-CG1 4.28Å; L1262-K1531 WeakPolarHBondContact O-CD 3.43Å; L1262-K1531 PolarHBondContact O-NZ 3.36Å; L1262-F1978 HydrophobicContact CB-CD2 4.25Å; L1262-F1978 HydrophobicContact CD1-CB 4.21Å; L1262-F1978 HydrophobicContact CD2-CB 4.33Å; L1262-F1978 HydrophobicContact CD2-CD2 4.1Å
1263	N	56.7	Low	49.7	Very low	97 Å²	97	66.1 Å²	66.1	52%	0.519	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-37.7	167.1	-51.9	-53.5	0	0	0	110.7	D1261 T1265 A1266 K1531	D1261-N1263 PolarHBondContact O-N 3.4Å; D1261-N1263 VanDerWaalsContact O-N 3.1Å; D1261-N1263 WeakPolarHBondContact OD1-CA 3.4Å; D1261-N1263 VanDerWaalsContact OD1-CB 3.26Å; D1261-N1263 WeakPolarHBondContact OD1-CB 3.34Å; D1261-N1263 PolarHBondContact OD1-N 2.84Å; D1261-N1263 PolarHBondContact OD1-ND2 3.5Å; N1263-T1265 VanDerWaalsContact C-N 3.31Å; N1263-T1265 PolarHBondContact O-N 2.91Å; N1263-A1266 WeakPolarHBondContact O-CB 3.31Å; N1263-A1266 PolarHBondContact O-N 3.03Å; N1263-A1266 VanDerWaalsContact O-N 3.11Å; N1263-K1531 PolarHBondContact OD1-NZ 3.37Å
1264	R	57.7	Low	50.3	Low	102 Å²	102	65.1 Å²	65.1	39%	0.385	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-64.6	-30.9	178.9	-162.2	173.9	-163.7	-168.5	10.4	113.5	E514 D1261 A1266 N1267 L1442	E514-R1264 VanDerWaalsContact CD-CZ 3.44Å; E514-R1264 IonicContact OE1-CZ 3.66Å; E514-R1264 IonicContact OE1-NE 3.44Å; E514-R1264 IonicContact OE1-NH1 3.65Å; E514-R1264 PolarHBondContact OE1-NH1 3.18Å; E514-R1264 IonicContact OE1-NH2 3.38Å; E514-R1264 PolarHBondContact OE1-NH2 2.81Å; E514-R1264 VanDerWaalsContact OE1-NH2 3.14Å; E514-R1264 IonicContact OE2-CZ 2.74Å; E514-R1264 IonicContact OE2-NH1 2.84Å; E514-R1264 PolarHBondContact OE2-NH1 2.79Å; E514-R1264 IonicContact OE2-NH2 3.25Å; E514-R1264 PolarHBondContact OE2-NH2 2.75Å; D1261-R1264 HydrophobicContact CB-CB 3.72Å; D1261-R1264 WeakPolarHBondContact O-CB 3.46Å; D1261-R1264 PolarHBondContact O-N 3.44Å; D1261-R1264 PolarHBondContact OD1-N 3.06Å; D1261-R1264 WeakPolarHBondContact OD2-CB 3.32Å; R1264-A1266 PolarHBondContact O-N 3.37Å; R1264-N1267 PolarHBondContact O-N 2.77Å; R1264-N1267 VanDerWaalsContact O-N 3.11Å; R1264-L1442 HydrophobicContact CB-CD2 4.12Å; R1264-L1442 HydrophobicContact CG-CD2 4.3Å
1265	T	58	Low	51.1	Low	18 Å²	18	60.7 Å²	60.7	11%	0.11	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-57	-33.7	171.4	49.8	0	0	0	0	112.9	D1261 L1262 N1263 N1267 L1442	D1261-T1265 PolarHBondContact O-N 2.84Å; L1262-T1265 PolarHBondContact O-OG1 2.77Å; N1263-T1265 VanDerWaalsContact C-N 3.31Å; N1263-T1265 PolarHBondContact O-N 2.91Å; T1265-N1267 VanDerWaalsContact C-N 3.34Å; T1265-N1267 PolarHBondContact O-N 3.42Å; T1265-L1442 HydrophobicContact CG2-CD2 3.59Å; T1265-L1442 HydrophobicContact CG2-CG 3.71Å
1266	A	54.3	Low	52.2	Low	24 Å²	24	56.9 Å²	56.9	20%	0.198	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-71.9	-25.9	177.6	0	0	0	0	0	113.4	N1263 R1264 K1268 S1269 I1290	N1263-A1266 WeakPolarHBondContact O-CB 3.31Å; N1263-A1266 PolarHBondContact O-N 3.03Å; N1263-A1266 VanDerWaalsContact O-N 3.11Å; R1264-A1266 PolarHBondContact O-N 3.37Å; A1266-K1268 PolarHBondContact O-N 3.22Å; A1266-S1269 PolarHBondContact O-N 3.13Å; A1266-I1290 HydrophobicContact CB-CD1 4.08Å; A1266-I1290 WeakPolarHBondContact O-CD1 3.46Å
1267	N	51.5	Low	53.3	Low	65 Å²	65	58.6 Å²	58.6	35%	0.348	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-76.9	7	-169.8	-63.8	-23.6	0	0	0	114.8	R1264 T1265 R1284	R1264-N1267 PolarHBondContact O-N 2.77Å; R1264-N1267 VanDerWaalsContact O-N 3.11Å; T1265-N1267 VanDerWaalsContact C-N 3.34Å; T1265-N1267 PolarHBondContact O-N 3.42Å; N1267-R1284 PolarHBondContact O-NH1 3.22Å
1268	K	54.7	Low	54.6	Low	64 Å²	64	59.4 Å²	59.4	28%	0.278	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-97.3	-10	176.3	-67.4	178.8	-177.2	174.4	0	114	A1266 D1440	A1266-K1268 PolarHBondContact O-N 3.22Å; K1268-D1440 VanDerWaalsContact CD-OD2 3.3Å; K1268-D1440 WeakPolarHBondContact CD-OD2 3.4Å; K1268-D1440 WeakPolarHBondContact CE-OD2 2.72Å; K1268-D1440 IonicContact NZ-OD1 3.63Å; K1268-D1440 PolarHBondContact NZ-OD1 3.34Å; K1268-D1440 IonicContact NZ-OD2 2.74Å; K1268-D1440 PolarHBondContact NZ-OD2 3.3Å
1269	S	54.3	Low	55.5	Low	4 Å²	4	57.2 Å²	57.2	3%	0.028	31%	0.311	C	S	.	.	S	Bend	trans	-89	172.1	167.9	-72.4	0	0	0	0	112.3	A1266 H1271 Y1279 Q1288 I1290	A1266-S1269 PolarHBondContact O-N 3.13Å; S1269-H1271 PolarHBondContact O-N 2.85Å; S1269-Y1279 WeakPolarHBondContact O-CE1 3.42Å; S1269-Y1279 PolarHBondContact O-OH 3.47Å; S1269-Q1288 CarbonylContact C-O 3.58Å; S1269-Q1288 WeakPolarHBondContact CA-O 3.48Å; S1269-Q1288 WeakPolarHBondContact CB-O 2.86Å; S1269-Q1288 PolarHBondContact OG-O 2.61Å; S1269-I1290 WeakPolarHBondContact OG-CG1 2.24Å
1270	L	52.6	Low	56.2	Low	10 Å²	10	58.3 Å²	58.3	5%	0.052	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-56.1	120.8	161.7	-88.5	161.3	0	0	0	108.1	Y1279 V1287 Q1288 L1289 L1428	L1270-Y1279 WeakPolarHBondContact CA-OH 2.95Å; L1270-Y1279 HydrophobicContact CD2-CD2 3.78Å; L1270-Y1279 HydrophobicContact CD2-CE2 3.72Å; L1270-Y1279 HydrophobicContact CD2-CG 4.45Å; L1270-V1287 HydrophobicContact CB-CG1 4.41Å; L1270-V1287 HydrophobicContact CG-CG1 3.9Å; L1270-Q1288 PolarHBondContact N-O 3.28Å; L1270-L1289 HydrophobicContact CB-CD2 3.61Å; L1270-L1289 HydrophobicContact CB-CG 4.02Å; L1270-L1289 HydrophobicContact CD1-CD1 4.18Å; L1270-L1289 HydrophobicContact CD1-CD2 4Å; L1270-L1289 HydrophobicContact CD1-CG 3.83Å; L1270-L1289 HydrophobicContact CG-CD2 4.44Å; L1270-L1428 HydrophobicContact CD1-CD2 3.83Å
1271	H	53.6	Low	56.6	Low	62 Å²	62	68.3 Å²	68.3	29%	0.287	34%	0.343	S	S	.	.			trans	-131.1	139.7	-173.3	-169.7	-93.4	0	0	0	109	S1269 T1273 H1274 Y1279	S1269-H1271 PolarHBondContact O-N 2.85Å; H1271-T1273 PolarHBondContact ND1-OG1 2.23Å; H1271-T1273 PolarHBondContact O-N 2.22Å; H1271-H1274 PolarHBondContact O-N 2.22Å; H1271-Y1279 PolarHBondContact N-OH 3.4Å
1272	S	48.9	Very low	56.8	Low	69 Å²	69	67.2 Å²	67.2	48%	0.483	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.8	-164.2	52.9	0	0	0	0	115.9	P1295	S1272-P1295 WeakPolarHBondContact O-CG 2.26Å
1273	T	46.8	Very low	56.7	Low	104 Å²	104	74.6 Å²	74.6	64%	0.638	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-25	175.1	53.3	0	0	0	0	113.4	H1271	H1271-T1273 PolarHBondContact ND1-OG1 2.23Å; H1271-T1273 PolarHBondContact O-N 2.22Å
1274	H	54.1	Low	56.6	Low	59 Å²	59	74.6 Å²	74.6	27%	0.273	37%	0.368	S	S	.	.	S	Bend	trans	-98.2	113.4	-176.4	-70.2	-90	0	0	0	110.2	H1271 F1278 Y1279	H1271-H1274 PolarHBondContact O-N 2.22Å; H1274-F1278 HydrophobicContact CB-CB 4.31Å; H1274-F1278 HydrophobicContact CB-CD1 3.86Å; H1274-F1278 HydrophobicContact CB-CE1 4.49Å; H1274-F1278 HydrophobicContact CB-CG 4.21Å; H1274-F1278 AromaticContact CE1-CE1 3.81Å; H1274-F1278 AromaticContact CE1-CZ 3.71Å; H1274-F1278 AromaticContact CG-CD1 3.84Å; H1274-F1278 AromaticContact ND1-CD1 3.29Å; H1274-F1278 VanDerWaalsContact ND1-CD1 3.29Å; H1274-F1278 WeakPolarHBondContact ND1-CD1 2.23Å; H1274-F1278 AromaticContact ND1-CD2 3.74Å; H1274-F1278 AromaticContact ND1-CE1 3.23Å; H1274-F1278 WeakPolarHBondContact ND1-CE1 3.44Å; H1274-F1278 AromaticContact ND1-CE2 3.69Å; H1274-F1278 AromaticContact ND1-CG 3.56Å; H1274-F1278 AromaticContact ND1-CZ 3.44Å; H1274-F1278 WeakPolarHBondContact ND1-CZ 3.5Å; H1274-Y1279 HydrophobicContact CB-CD2 4.34Å; H1274-Y1279 HydrophobicContact CB-CE2 3.38Å; H1274-Y1279 WeakPolarHBondContact CB-OH 2.25Å
1275	S	56.9	Low	56.3	Low	72 Å²	72	74.6 Å²	74.6	50%	0.503	38%	0.379	S	S	.	.			trans	-58.9	154.8	177.3	74.1	0	0	0	0	112.3	N1277 F1278	S1275-N1277 PolarHBondContact O-N 3.47Å; S1275-F1278 VanDerWaalsContact O-CB 3.27Å; S1275-F1278 WeakPolarHBondContact O-CB 3.42Å; S1275-F1278 PolarHBondContact O-N 3.05Å; S1275-F1278 PolarHBondContact OG-N 2.86Å
1276	L	59.4	Low	56.2	Low	76 Å²	76	78.2 Å²	78.2	40%	0.398	39%	0.394	S	S	.	.	H	α-helix	trans	-50.5	-33.7	173.3	-118.1	93.4	0	0	0	112.4	F1278 K1280 Y1422	L1276-F1278 VanDerWaalsContact C-N 3.33Å; L1276-F1278 PolarHBondContact O-N 2.62Å; L1276-K1280 WeakPolarHBondContact O-CB 3.3Å; L1276-K1280 PolarHBondContact O-N 2.2Å; L1276-Y1422 HydrophobicContact CD2-CE1 4.04Å; L1276-Y1422 WeakPolarHBondContact CG-OH 3.37Å; L1276-Y1422 PolarHBondContact O-OH 3.11Å; L1276-Y1422 VanDerWaalsContact O-OH 3.12Å
1277	N	59.5	Low	56.5	Low	103 Å²	103	77.3 Å²	77.3	55%	0.551	39%	0.386	S	S	*	.	H	α-helix	trans	-69	-25.6	178.3	-69.8	-30.5	0	0	0	113.6	S1275 R1281	S1275-N1277 PolarHBondContact O-N 3.47Å; N1277-R1281 WeakPolarHBondContact O-CB 3.02Å; N1277-R1281 WeakPolarHBondContact O-CG 3.32Å; N1277-R1281 PolarHBondContact O-N 2.74Å
1278	F	66.4	Low	56.9	Low	84 Å²	84	74.4 Å²	74.4	37%	0.368	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-54.7	174.2	174.7	-94.2	0	0	0	110.6	H1274 S1275 L1276 K1280 R1281 S1282	H1274-F1278 HydrophobicContact CB-CB 4.31Å; H1274-F1278 HydrophobicContact CB-CD1 3.86Å; H1274-F1278 HydrophobicContact CB-CE1 4.49Å; H1274-F1278 HydrophobicContact CB-CG 4.21Å; H1274-F1278 AromaticContact CE1-CE1 3.81Å; H1274-F1278 AromaticContact CE1-CZ 3.71Å; H1274-F1278 AromaticContact CG-CD1 3.84Å; H1274-F1278 AromaticContact ND1-CD1 3.29Å; H1274-F1278 VanDerWaalsContact ND1-CD1 3.29Å; H1274-F1278 WeakPolarHBondContact ND1-CD1 2.23Å; H1274-F1278 AromaticContact ND1-CD2 3.74Å; H1274-F1278 AromaticContact ND1-CE1 3.23Å; H1274-F1278 WeakPolarHBondContact ND1-CE1 3.44Å; H1274-F1278 AromaticContact ND1-CE2 3.69Å; H1274-F1278 AromaticContact ND1-CG 3.56Å; H1274-F1278 AromaticContact ND1-CZ 3.44Å; H1274-F1278 WeakPolarHBondContact ND1-CZ 3.5Å; S1275-F1278 VanDerWaalsContact O-CB 3.27Å; S1275-F1278 WeakPolarHBondContact O-CB 3.42Å; S1275-F1278 PolarHBondContact O-N 3.05Å; S1275-F1278 PolarHBondContact OG-N 2.86Å; L1276-F1278 VanDerWaalsContact C-N 3.33Å; L1276-F1278 PolarHBondContact O-N 2.62Å; F1278-K1280 VanDerWaalsContact C-N 3.26Å; F1278-K1280 PolarHBondContact O-N 3.11Å; F1278-R1281 PolarHBondContact O-N 2.67Å; F1278-R1281 VanDerWaalsContact O-N 3.09Å; F1278-S1282 WeakPolarHBondContact O-CB 3.18Å; F1278-S1282 PolarHBondContact O-N 2.99Å; F1278-S1282 PolarHBondContact O-OG 3.33Å
1279	Y	61.9	Low	57.2	Low	2 Å²	2	71.7 Å²	71.7	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-63.4	-32.4	178.2	-60.3	-89	0	0	0	112.6	S1269 L1270 H1271 H1274 S1282 V1287	S1269-Y1279 WeakPolarHBondContact O-CE1 3.42Å; S1269-Y1279 PolarHBondContact O-OH 3.47Å; L1270-Y1279 WeakPolarHBondContact CA-OH 2.95Å; L1270-Y1279 HydrophobicContact CD2-CD2 3.78Å; L1270-Y1279 HydrophobicContact CD2-CE2 3.72Å; L1270-Y1279 HydrophobicContact CD2-CG 4.45Å; H1271-Y1279 PolarHBondContact N-OH 3.4Å; H1274-Y1279 HydrophobicContact CB-CD2 4.34Å; H1274-Y1279 HydrophobicContact CB-CE2 3.38Å; H1274-Y1279 WeakPolarHBondContact CB-OH 2.25Å; Y1279-S1282 PolarHBondContact O-OG 2.04Å; Y1279-V1287 HydrophobicContact CD1-CG1 3.75Å; Y1279-V1287 HydrophobicContact CD1-CG2 3.97Å; Y1279-V1287 HydrophobicContact CE1-CG1 3.85Å; Y1279-V1287 HydrophobicContact CG-CG1 4.5Å; Y1279-V1287 HydrophobicContact CG-CG2 4.37Å
1280	K	62.8	Low	57.1	Low	110 Å²	110	74 Å²	74	48%	0.478	37%	0.37	S	S	.	.	H	α-helix	trans	-70.8	-32.4	174.7	-170.2	-179	173.7	-171.7	0	112.7	L1276 F1278 Y1422	L1276-K1280 WeakPolarHBondContact O-CB 3.3Å; L1276-K1280 PolarHBondContact O-N 2.2Å; F1278-K1280 VanDerWaalsContact C-N 3.26Å; F1278-K1280 PolarHBondContact O-N 3.11Å; K1280-Y1422 HydrophobicContact CB-CD2 4.36Å; K1280-Y1422 HydrophobicContact CB-CE2 4.18Å
1281	R	62.2	Low	57	Low	220 Å²	220	77.1 Å²	77.1	83%	0.83	39%	0.387	S	S	*	.	H	α-helix	trans	-79.3	-40.5	174.8	-85.2	-177.4	166.5	170.6	-4.7	112.9	N1277 F1278 Q1283	N1277-R1281 WeakPolarHBondContact O-CB 3.02Å; N1277-R1281 WeakPolarHBondContact O-CG 3.32Å; N1277-R1281 PolarHBondContact O-N 2.74Å; F1278-R1281 PolarHBondContact O-N 2.67Å; F1278-R1281 VanDerWaalsContact O-N 3.09Å; R1281-Q1283 PolarHBondContact O-N 2.79Å
1282	S	63.2	Low	56.9	Low	50 Å²	50	75.2 Å²	75.2	35%	0.35	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	9.2	-175.5	73.7	0	0	0	0	114.7	F1278 Y1279 R1284	F1278-S1282 WeakPolarHBondContact O-CB 3.18Å; F1278-S1282 PolarHBondContact O-N 2.99Å; F1278-S1282 PolarHBondContact O-OG 3.33Å; Y1279-S1282 PolarHBondContact O-OG 2.04Å; S1282-R1284 PolarHBondContact O-N 3.44Å
1283	Q	55.5	Low	56.8	Low	171 Å²	171	75.7 Å²	75.7	80%	0.799	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.8	24.3	-177	-56.7	-166.4	15.7	0	0	115.6	R1281 V1285	R1281-Q1283 PolarHBondContact O-N 2.79Å; Q1283-V1285 PolarHBondContact O-N 2.89Å
1284	R	54.5	Low	57	Low	98 Å²	98	71.5 Å²	71.5	37%	0.37	35%	0.351	S	S	.	.			trans	-66.4	103.7	177.7	-80.8	-175.7	177.7	177.1	1.9	107.7	N1267 S1282 F1286	N1267-R1284 PolarHBondContact O-NH1 3.22Å; S1282-R1284 PolarHBondContact O-N 3.44Å; R1284-F1286 PolarHBondContact O-N 2.79Å
1285	V	50.8	Low	56.5	Low	102 Å²	102	71.9 Å²	71.9	62%	0.618	36%	0.359	S	S	*	.	S	Bend	trans	-54.7	-32.3	-170.5	-165.6	0	0	0	0	111.7	Q1283 C1421	Q1283-V1285 PolarHBondContact O-N 2.89Å; V1285-C1421 WeakPolarHBondContact O-CB 3.21Å
1286	F	56.2	Low	56	Low	93 Å²	93	70.7 Å²	70.7	41%	0.408	36%	0.358	S	S	.	.			trans	-136.1	148.1	178.7	-50.9	-70.8	0	0	0	112.5	R1284 K1419 L1420 C1421 A1431	R1284-F1286 PolarHBondContact O-N 2.79Å; F1286-K1419 HydrophobicContact CB-CG 3.79Å; F1286-K1419 HydrophobicContact CD1-CD 4.03Å; F1286-K1419 VanDerWaalsContact CD1-CE 3.46Å; F1286-K1419 HydrophobicContact CD1-CG 3.58Å; F1286-K1419 HydrophobicContact CD2-CD 4.45Å; F1286-K1419 HydrophobicContact CE1-CD 4.36Å; F1286-K1419 HydrophobicContact CE1-CG 4.32Å; F1286-K1419 HydrophobicContact CG-CD 4.06Å; F1286-K1419 HydrophobicContact CG-CG 3.7Å; F1286-L1420 CarbonylContact C-O 3.47Å; F1286-L1420 VanDerWaalsContact CA-O 3.24Å; F1286-L1420 WeakPolarHBondContact CA-O 3.5Å; F1286-C1421 HydrophobicContact CD1-CB 4.03Å; F1286-C1421 HydrophobicContact CE1-CB 4.19Å; F1286-A1431 HydrophobicContact CD1-CB 4.22Å; F1286-A1431 HydrophobicContact CE1-CB 4.03Å
1287	V	60.5	Low	55.6	Low	5 Å²	5	69.7 Å²	69.7	3%	0.03	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-138.6	155.8	174.5	-154.8	0	0	0	0	109.3	L1270 Y1279 L1420	L1270-V1287 HydrophobicContact CB-CG1 4.41Å; L1270-V1287 HydrophobicContact CG-CG1 3.9Å; Y1279-V1287 HydrophobicContact CD1-CG1 3.75Å; Y1279-V1287 HydrophobicContact CD1-CG2 3.97Å; Y1279-V1287 HydrophobicContact CE1-CG1 3.85Å; Y1279-V1287 HydrophobicContact CG-CG1 4.5Å; Y1279-V1287 HydrophobicContact CG-CG2 4.37Å; V1287-L1420 PolarHBondContact N-O 3.36Å; V1287-L1420 WeakPolarHBondContact O-CA 3.41Å; V1287-L1420 VanDerWaalsContact O-CB 3.24Å; V1287-L1420 WeakPolarHBondContact O-CB 3.35Å; V1287-L1420 WeakPolarHBondContact O-CG 3.42Å; V1287-L1420 PolarHBondContact O-N 3.24Å
1288	Q	60.5	Low	54.8	Low	4 Å²	4	73.6 Å²	73.6	2%	0.019	37%	0.365	C	S	.	.			trans	-128.2	168.7	-179.5	-162.2	158.7	-0.5	0	0	108.6	S1269 L1270 G1416 C1434	S1269-Q1288 CarbonylContact C-O 3.58Å; S1269-Q1288 WeakPolarHBondContact CA-O 3.48Å; S1269-Q1288 WeakPolarHBondContact CB-O 2.86Å; S1269-Q1288 PolarHBondContact OG-O 2.61Å; L1270-Q1288 PolarHBondContact N-O 3.28Å; Q1288-G1416 PolarHBondContact NE2-O 2.99Å; Q1288-C1434 PolarHBondContact OE1-SG 3.45Å
1289	L	59.9	Low	53.7	Low	8 Å²	8	78.7 Å²	78.7	4%	0.042	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-120.4	105.7	-175.2	-97	161.5	0	0	0	112	L1270 D1294 L1297 W1415 G1416 L1420	L1270-L1289 HydrophobicContact CB-CD2 3.61Å; L1270-L1289 HydrophobicContact CB-CG 4.02Å; L1270-L1289 HydrophobicContact CD1-CD1 4.18Å; L1270-L1289 HydrophobicContact CD1-CD2 4Å; L1270-L1289 HydrophobicContact CD1-CG 3.83Å; L1270-L1289 HydrophobicContact CG-CD2 4.44Å; L1289-D1294 HydrophobicContact CD2-CB 4.16Å; L1289-L1297 HydrophobicContact CD1-CD1 3.93Å; L1289-L1297 HydrophobicContact CD2-CD1 3.92Å; L1289-W1415 HydrophobicContact CB-CB 3.89Å; L1289-W1415 HydrophobicContact CD1-CB 3.68Å; L1289-W1415 HydrophobicContact CD1-CD2 4.5Å; L1289-W1415 HydrophobicContact CD1-CG 4.16Å; L1289-W1415 HydrophobicContact CG-CB 4.43Å; L1289-G1416 WeakPolarHBondContact O-CA 3.39Å; L1289-G1416 PolarHBondContact O-N 3.49Å; L1289-L1420 HydrophobicContact CD1-CD1 3.97Å; L1289-L1420 HydrophobicContact CG-CD1 4.45Å
1290	I	52.2	Low	52.7	Low	51 Å²	51	80.9 Å²	80.9	26%	0.262	40%	0.403	S	S	.	.			trans	-75	-39.7	-178.2	-85.9	170.3	0	0	0	112.9	A1266 S1269 V1530	A1266-I1290 HydrophobicContact CB-CD1 4.08Å; A1266-I1290 WeakPolarHBondContact O-CD1 3.46Å; S1269-I1290 WeakPolarHBondContact OG-CG1 2.24Å; I1290-V1530 HydrophobicContact CG2-CG1 4.29Å
1291	N	51.6	Low	51.6	Low	76 Å²	76	80 Å²	80	41%	0.406	41%	0.409	S	S	.	.			trans	-124.9	144	-168.8	-156.6	-42.8	0	0	0	113.1	N1293	N1291-N1293 PolarHBondContact O-N 3.32Å; N1291-N1293 WeakPolarHBondContact OD1-CB 3.08Å; N1291-N1293 PolarHBondContact OD1-N 3.21Å; N1291-N1293 PolarHBondContact OD1-ND2 3.39Å
1292	C	51.9	Low	50.8	Low	22 Å²	22	75 Å²	75	15%	0.149	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-4	172.7	63.2	0	0	0	0	114.3	C1306 C1412	C1292-C1306 HydrophobicContact CB-CB 4.35Å; C1292-C1306 WeakPolarHBondContact CB-SG 2.94Å; C1292-C1306 WeakPolarHBondContact SG-CB 3.32Å; C1292-C1306 CovalentContact SG-SG 2.04Å; C1292-C1306 PolarHBondContact SG-SG 2.85Å; C1292-C1412 HydrophobicContact CB-CB 3.8Å
1293	N	46.2	Very low	50	Low	79 Å²	79	72.8 Å²	72.8	42%	0.422	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	9	-178.6	-64.9	-65.7	0	0	0	114.3	N1291 K1302	N1291-N1293 PolarHBondContact O-N 3.32Å; N1291-N1293 WeakPolarHBondContact OD1-CB 3.08Å; N1291-N1293 PolarHBondContact OD1-N 3.21Å; N1291-N1293 PolarHBondContact OD1-ND2 3.39Å; N1293-K1302 WeakPolarHBondContact OD1-CD 3.42Å; N1293-K1302 WeakPolarHBondContact OD1-CE 3.45Å; N1293-K1302 PolarHBondContact OD1-NZ 3.5Å
1294	D	51.3	Low	49.5	Very low	16 Å²	16	69.1 Å²	69.1	9%	0.086	36%	0.357	C	S	.	.			trans	-62.3	128.6	-177.1	-167.9	-66.5	0	0	0	112	L1289 G1296 L1297	L1289-D1294 HydrophobicContact CD2-CB 4.16Å; D1294-G1296 PolarHBondContact O-N 2.59Å; D1294-G1296 VanDerWaalsContact O-N 3.07Å; D1294-G1296 PolarHBondContact OD1-N 3.49Å; D1294-L1297 HydrophobicContact CB-CD1 4.41Å; D1294-L1297 PolarHBondContact O-N 3.36Å
1295	P	44	Very low	49.1	Very low	67 Å²	67	65.1 Å²	65.1	44%	0.435	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-8.3	-177.7	27.2	-35.2	0	0	0	114.7	S1272 L1297 K1298	S1272-P1295 WeakPolarHBondContact O-CG 2.26Å; P1295-L1297 VanDerWaalsContact C-N 3.28Å; P1295-K1298 VanDerWaalsContact O-CE 3.28Å; P1295-K1298 WeakPolarHBondContact O-CE 3.46Å; P1295-K1298 VanDerWaalsContact O-CG 3.3Å; P1295-K1298 WeakPolarHBondContact O-CG 3.14Å
1296	G	45.3	Very low	49	Very low	47 Å²	47	61.3 Å²	61.3	49%	0.485	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.2	165.8	0	0	0	0	0	114.5	D1294	D1294-G1296 PolarHBondContact O-N 2.59Å; D1294-G1296 VanDerWaalsContact O-N 3.07Å; D1294-G1296 PolarHBondContact OD1-N 3.49Å
1297	L	52	Low	48.7	Very low	55 Å²	55	64.9 Å²	64.9	29%	0.288	33%	0.333	S	S	.	.			trans	-115.4	39.7	-168.8	-64.7	173.2	0	0	0	114	L1289 D1294 P1295 Q1299 V1300	L1289-L1297 HydrophobicContact CD1-CD1 3.93Å; L1289-L1297 HydrophobicContact CD2-CD1 3.92Å; D1294-L1297 HydrophobicContact CB-CD1 4.41Å; D1294-L1297 PolarHBondContact O-N 3.36Å; P1295-L1297 VanDerWaalsContact C-N 3.28Å; L1297-Q1299 PolarHBondContact O-N 2.83Å; L1297-V1300 PolarHBondContact O-N 3.4Å
1298	K	42.8	Very low	47.8	Very low	185 Å²	185	68.7 Å²	68.7	80%	0.804	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	12.5	-170.4	-61.8	-171.7	177.5	-179.2	0	118.3	P1295	P1295-K1298 VanDerWaalsContact O-CE 3.28Å; P1295-K1298 WeakPolarHBondContact O-CE 3.46Å; P1295-K1298 VanDerWaalsContact O-CG 3.3Å; P1295-K1298 WeakPolarHBondContact O-CG 3.14Å
1299	Q	43.1	Very low	46.9	Very low	191 Å²	191	72.2 Å²	72.2	89%	0.893	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.4	14.8	-177.3	-63.6	-170.5	-0.8	0	0	114.9	L1297	L1297-Q1299 PolarHBondContact O-N 2.83Å
1300	V	40.4	Very low	45.7	Very low	49 Å²	49	80.4 Å²	80.4	30%	0.297	41%	0.407	S	S	.	.			trans	-125.6	140.4	-166.1	-157.5	0	0	0	0	116.2	L1297 F1411	L1297-V1300 PolarHBondContact O-N 3.4Å; V1300-F1411 HydrophobicContact CB-CD1 4.23Å; V1300-F1411 HydrophobicContact CB-CE1 4.11Å; V1300-F1411 HydrophobicContact CB-CZ 4.45Å; V1300-F1411 HydrophobicContact CG1-CB 4.13Å; V1300-F1411 HydrophobicContact CG1-CD1 3.45Å; V1300-F1411 VanDerWaalsContact CG1-CD1 3.45Å; V1300-F1411 HydrophobicContact CG1-CD2 3.61Å; V1300-F1411 HydrophobicContact CG1-CE1 3.55Å; V1300-F1411 HydrophobicContact CG1-CE2 3.73Å; V1300-F1411 HydrophobicContact CG1-CG 3.46Å; V1300-F1411 VanDerWaalsContact CG1-CG 3.46Å; V1300-F1411 HydrophobicContact CG1-CZ 3.68Å; V1300-F1411 HydrophobicContact CG2-CE1 3.9Å; V1300-F1411 HydrophobicContact CG2-CZ 4.03Å
1301	P	39.6	Very low	44.6	Very low	92 Å²	92	87 Å²	87	60%	0.597	44%	0.435	S	S	*	.			trans	-69	134.6	178.1	-22.7	35	0	0	0	116.2
1302	K	44.5	Very low	43.5	Very low	113 Å²	113	87.7 Å²	87.7	49%	0.491	45%	0.445	S	S	.	.			trans	-69.6	137	179.2	-50.8	-172.4	-173.5	-161.9	0	113.6	N1293 S1409	N1293-K1302 WeakPolarHBondContact OD1-CD 3.42Å; N1293-K1302 WeakPolarHBondContact OD1-CE 3.45Å; N1293-K1302 PolarHBondContact OD1-NZ 3.5Å; K1302-S1409 WeakPolarHBondContact O-CB 3.28Å; K1302-S1409 PolarHBondContact O-OG 3.14Å
1303	C	47.9	Very low	42.1	Very low	4 Å²	4	96.8 Å²	96.8	3%	0.027	48%	0.478	C	S	.	.			trans	-75.1	175.2	-170.9	81.6	0	0	0	0	115.8	C1306 R1307 S1409 C1412	C1303-C1306 WeakPolarHBondContact SG-CB 3.49Å; C1303-C1306 PolarHBondContact SG-N 2.96Å; C1303-R1307 WeakPolarHBondContact O-CG 3.49Å; C1303-S1409 WeakPolarHBondContact CA-O 3.35Å; C1303-S1409 VanDerWaalsContact CA-OG 3.32Å; C1303-S1409 WeakPolarHBondContact CA-OG 3.39Å; C1303-S1409 WeakPolarHBondContact CB-O 3.37Å; C1303-C1412 HydrophobicContact CB-CB 3.97Å; C1303-C1412 PolarHBondContact SG-SG 3.17Å
1304	R	44.9	Very low	41.2	Very low	95 Å²	95	100.7 Å²	100.7	36%	0.358	49%	0.493	S	S	.	.	S	Bend	trans	-64.9	-50.7	176.8	-174.4	177.5	176.4	-178.7	-4.1	111.7	C1306 R1307 Q1308 M1408 E1541	R1304-C1306 PolarHBondContact O-N 2.8Å; R1304-R1307 WeakPolarHBondContact O-CB 3.49Å; R1304-R1307 PolarHBondContact O-N 2.85Å; R1304-Q1308 PolarHBondContact O-N 3.02Å; R1304-M1408 HydrophobicContact CB-CE 4.23Å; R1304-E1541 IonicContact CZ-OE1 3.25Å; R1304-E1541 IonicContact NH1-OE1 2.67Å; R1304-E1541 PolarHBondContact NH1-OE1 3.05Å; R1304-E1541 IonicContact NH2-OE1 3.46Å; R1304-E1541 PolarHBondContact NH2-OE1 2.86Å; R1304-E1541 IonicContact NH2-OE2 2.7Å; R1304-E1541 PolarHBondContact NH2-OE2 2.88Å
1305	A	44.6	Very low	39.9	Very low	13 Å²	13	105.1 Å²	105.1	11%	0.107	52%	0.517	C	S	.	.	H	α-helix	trans	-58.5	-43.4	177.8	0	0	0	0	0	112.7	R1307 Q1308 T1309 V1533	A1305-R1307 PolarHBondContact O-N 2.9Å; A1305-Q1308 PolarHBondContact O-N 3.49Å; A1305-T1309 PolarHBondContact O-N 2.83Å; A1305-V1533 HydrophobicContact CB-CG1 4Å
1306	C	50.2	Low	38.9	Very low	23 Å²	23	106.9 Å²	106.9	16%	0.155	53%	0.531	C	S	.	.	H	α-helix	trans	-57	-9.9	171.3	-86.8	0	0	0	0	115.2	C1292 C1303 R1304	C1292-C1306 HydrophobicContact CB-CB 4.35Å; C1292-C1306 WeakPolarHBondContact CB-SG 2.94Å; C1292-C1306 WeakPolarHBondContact SG-CB 3.32Å; C1292-C1306 CovalentContact SG-SG 2.04Å; C1292-C1306 PolarHBondContact SG-SG 2.85Å; C1303-C1306 WeakPolarHBondContact SG-CB 3.49Å; C1303-C1306 PolarHBondContact SG-N 2.96Å; R1304-C1306 PolarHBondContact O-N 2.8Å
1307	R	48.4	Very low	38	Very low	168 Å²	168	111 Å²	111	63%	0.634	55%	0.549	S	S	*	.	H	α-helix	trans	-100.8	-27.4	175.4	-64.6	170.6	-170.9	-151.7	0.9	112.6	C1303 R1304 A1305	C1303-R1307 WeakPolarHBondContact O-CG 3.49Å; R1304-R1307 WeakPolarHBondContact O-CB 3.49Å; R1304-R1307 PolarHBondContact O-N 2.85Å; A1305-R1307 PolarHBondContact O-N 2.9Å
1308	Q	42.4	Very low	36.7	Very low	85 Å²	85	113.4 Å²	113.4	40%	0.397	57%	0.57	S	S	.	*	H	α-helix	trans	-74.3	-30.9	177.5	-72.5	163.7	-75	0	0	111.4	R1304 A1305 K1310	R1304-Q1308 PolarHBondContact O-N 3.02Å; A1305-Q1308 PolarHBondContact O-N 3.49Å; Q1308-K1310 PolarHBondContact O-N 3.35Å
1309	T	41.7	Very low	35.9	Very low	77 Å²	77	111.8 Å²	111.8	47%	0.472	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.1	19.3	174.8	55.4	0	0	0	0	114.8	A1305 G1532 V1533	A1305-T1309 PolarHBondContact O-N 2.83Å; T1309-G1532 WeakPolarHBondContact CG2-O 3.46Å; T1309-V1533 HydrophobicContact CG2-CG2 3.76Å
1310	K	35	Very low	35	Very low	181 Å²	181	108.6 Å²	108.6	79%	0.787	56%	0.558	S	S	*	*			trans	-109.9	71.3	168.6	-101.6	-172.4	154.6	-70.1	0	109.4	Q1308	Q1308-K1310 PolarHBondContact O-N 3.35Å
1311	F	29.9	Very low	34.3	Very low	190 Å²	190	112 Å²	112	83%	0.833	58%	0.579	S	S	*	*			trans	-71.5	164	164.8	-96.6	-91.7	0	0	0	111.6
1312	S	27.6	Very low	33.7	Very low	90 Å²	90	114.5 Å²	114.5	63%	0.629	59%	0.588	S	S	*	*			trans	-66.2	141.8	-161.9	-61.7	0	0	0	0	114.6
1313	Y	23.4	Very low	32.8	Very low	212 Å²	212	112.3 Å²	112.3	83%	0.831	60%	0.597	S	S	*	*			trans	-147.3	88.8	149.5	-108	-89.1	0	0	0	107.1
1314	H	25.5	Very low	31.8	Very low	161 Å²	161	120 Å²	120	75%	0.745	63%	0.632	S	S	*	*			trans	61.9	160.2	167.1	-68	-77	0	0	0	118.4
1315	N	25.7	Very low	30.9	Very low	110 Å²	110	122.6 Å²	122.6	59%	0.588	65%	0.65	S	S	*	*			cis	-145	164.2	-0.2	-136.4	-3.9	0	0	0	113.7
1316	S	22.5	Very low	30.3	Very low	103 Å²	103	129.4 Å²	129.4	72%	0.72	69%	0.685	S	S	*	*			trans	-74.2	153.9	167.2	-64.7	0	0	0	0	112.3
1317	P	25.5	Very low	29.2	Very low	134 Å²	134	131.8 Å²	131.8	87%	0.87	70%	0.702	S	S	*	*			trans	-97	122	176.6	34.7	-29.8	0	0	0	112.5
1318	S	24.6	Very low	28.3	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	71%	0.707	S	S	*	*			trans	-138.9	113.2	169.2	54.9	0	0	0	0	111.6
1319	I	26.3	Very low	27.7	Very low	151 Å²	151	132.1 Å²	132.1	77%	0.774	72%	0.719	S	S	*	*			trans	35.6	99.7	147.4	-50.9	176	0	0	0	116	T1321	I1319-T1321 HydrophobicContact CG2-CG2 4.09Å; I1319-T1321 PolarHBondContact O-N 3.26Å
1320	N	25.1	Very low	27.1	Very low	125 Å²	125	132.1 Å²	132.1	67%	0.668	72%	0.722	S	S	*	*			trans	-65.7	120.8	149.5	-93.8	23.6	0	0	0	108.4
1321	T	26.1	Very low	27	Very low	121 Å²	121	128.9 Å²	128.9	74%	0.742	71%	0.713	S	S	*	*			trans	-98.1	104.8	150.2	44.8	0	0	0	0	108.1	I1319	I1319-T1321 HydrophobicContact CG2-CG2 4.09Å; I1319-T1321 PolarHBondContact O-N 3.26Å
1322	N	26	Very low	27.3	Very low	144 Å²	144	124.8 Å²	124.8	77%	0.77	70%	0.7	S	S	*	*			trans	-123.8	81.8	166	-89.1	20.1	0	0	0	108.6
1323	G	26.2	Very low	27.7	Very low	66 Å²	66	126.7 Å²	126.7	68%	0.68	70%	0.703	S	S	*	*			trans	-82.6	141.2	131.6	0	0	0	0	0	106.6
1324	Q	26.9	Very low	28.1	Very low	166 Å²	166	123.8 Å²	123.8	78%	0.776	70%	0.702	S	S	*	*			cis	-138.3	154	1.1	-110.1	164.7	-98.9	0	0	108.5
1325	M	26.2	Very low	28.4	Very low	149 Å²	149	119.2 Å²	119.2	73%	0.734	70%	0.698	S	S	*	*				41.8	125.9	105.3	-58.2	170.5	169.3	0	0	113.2
1326	D	30.3	Very low	28.8	Very low	156 Å²	156	121.5 Å²	121.5	83%	0.834	71%	0.711	S	S	*	*			cis	-113	133.2	24.6	-66.5	-55.7	0	0	0	115
1327	S	27.4	Very low	29.2	Very low	74 Å²	74	123.7 Å²	123.7	52%	0.517	71%	0.714	S	S	.	*			trans	-69.3	159.3	144.2	50.6	0	0	0	0	108.7
1328	D	30.8	Very low	29.5	Very low	138 Å²	138	124.5 Å²	124.5	74%	0.738	71%	0.711	S	S	*	*				-171.5	131	110.6	-88.9	-4.7	0	0	0	108.6
1329	N	29	Very low	29.9	Very low	122 Å²	122	126.4 Å²	126.4	65%	0.652	71%	0.714	S	S	*	*				72.7	131.7	60.2	-66.4	-30.8	0	0	0	110.2
1330	S	29.5	Very low	30.1	Very low	77 Å²	77	126.2 Å²	126.2	54%	0.538	71%	0.714	S	S	.	*			cis	-178.5	-164.7	3	37.3	0	0	0	0	111.5
1331	D	33.3	Very low	30.5	Very low	113 Å²	113	127.2 Å²	127.2	60%	0.604	72%	0.719	S	S	*	*				89.1	157	120.7	-81.9	-7.6	0	0	0	125.2	K1071	K1071-D1331 VanDerWaalsContact CE-O 3.32Å; K1071-D1331 WeakPolarHBondContact CE-O 3.29Å
1332	D	35.1	Very low	30.6	Very low	104 Å²	104	128.8 Å²	128.8	56%	0.556	72%	0.723	S	S	*	*			trans	81.4	129.7	150.1	-62.8	-17.6	0	0	0	122.5	K1071	K1071-D1332 WeakPolarHBondContact CE-O 3.44Å; K1071-D1332 PolarHBondContact NZ-O 3.17Å
1333	D	35.8	Very low	30.9	Very low	129 Å²	129	127.4 Å²	127.4	69%	0.69	72%	0.72	S	S	*	*			cis	-167.6	-157.4	-19.6	-148.8	-10.8	0	0	0	110.6
1334	D	33.4	Very low	31.2	Very low	151 Å²	151	130.7 Å²	130.7	81%	0.807	72%	0.722	S	S	*	*			trans	79	142.5	155.8	-42.9	-60.2	0	0	0	116.3
1335	G	31.8	Very low	31.3	Very low	65 Å²	65	131 Å²	131	67%	0.67	72%	0.723	S	S	*	*			cis	136.9	162	-5.6	0	0	0	0	0	112.2
1336	D	32.5	Very low	31.4	Very low	158 Å²	158	130.3 Å²	130.3	85%	0.845	72%	0.718	S	S	*	*			cis	-169.3	-149.8	-36	-106.4	-43.2	0	0	0	107.6
1337	D	32.8	Very low	31.2	Very low	149 Å²	149	127.7 Å²	127.7	80%	0.797	70%	0.704	S	S	*	*			trans	65.4	106.8	169	-58.2	-18.9	0	0	0	120.7
1338	D	31.8	Very low	31.4	Very low	151 Å²	151	127.5 Å²	127.5	81%	0.807	70%	0.701	S	S	*	*				57.5	172.3	119.6	-67.6	-6.8	0	0	0	125.8
1339	D	32.4	Very low	31.3	Very low	146 Å²	146	129.8 Å²	129.8	78%	0.781	70%	0.704	S	S	*	*			trans	82	118.6	169.7	-62.6	-19.8	0	0	0	123
1340	D	29.8	Very low	31	Very low	146 Å²	146	130.7 Å²	130.7	78%	0.781	71%	0.708	S	S	*	*			trans	69.1	161.8	139.8	-70.5	-22.1	0	0	0	125.8
1341	D	34.2	Very low	30.8	Very low	146 Å²	146	133.2 Å²	133.2	78%	0.781	72%	0.715	S	S	*	*			trans	67.3	87.6	163.6	-68	-12.5	0	0	0	122.8
1342	D	28.2	Very low	30.5	Very low	154 Å²	154	135.1 Å²	135.1	82%	0.824	72%	0.723	S	S	*	*				58.9	175.8	112.9	-118.2	-28	0	0	0	124.7
1343	V	32	Very low	30	Very low	116 Å²	116	134.3 Å²	134.3	70%	0.703	73%	0.726	S	S	*	*			trans	74.8	136.9	164.9	-85.1	0	0	0	0	124.6
1344	D	31.5	Very low	29.4	Very low	134 Å²	134	134.5 Å²	134.5	72%	0.717	73%	0.727	S	S	*	*			trans	68.1	111.4	155.6	-58.4	-11.1	0	0	0	120
1345	E	29.1	Very low	28.9	Very low	172 Å²	172	134.4 Å²	134.4	80%	0.804	73%	0.725	S	S	*	*				74.2	143	79.1	-73.9	-160.8	156.1	0	0	114.6
1346	E	29.7	Very low	28.7	Very low	135 Å²	135	136.9 Å²	136.9	63%	0.631	73%	0.729	S	S	*	*			cis	-149.4	161.3	7	-143.4	-155.1	157.9	0	0	111.2	P1348	E1346-P1348 WeakPolarHBondContact OE1-CD 3.43Å
1347	N	25	Very low	28.2	Very low	102 Å²	102	134.4 Å²	134.4	55%	0.545	72%	0.724	S	S	.	*			trans	-165.6	100.1	154.9	176.5	16.4	0	0	0	112.1	S1020 S1021	S1020-N1347 PolarHBondContact O-ND2 2.93Å; S1021-N1347 PolarHBondContact O-ND2 3.36Å
1348	P	31	Very low	28.1	Very low	70 Å²	70	132.3 Å²	132.3	46%	0.455	72%	0.718	S	S	.	*			trans	-143	142.1	149.9	35.6	-18.9	0	0	0	116.2	E1346	E1346-P1348 WeakPolarHBondContact OE1-CD 3.43Å
1349	K	28.8	Very low	27.7	Very low	185 Å²	185	130.7 Å²	130.7	80%	0.804	71%	0.714	S	S	*	*				33.2	148.5	120	-51.4	166	-172.8	163.5	0	120.7
1350	L	23.7	Very low	27.2	Very low	141 Å²	141	130.6 Å²	130.6	74%	0.738	71%	0.714	S	S	*	*			cis	-176.8	165.3	-14.5	-105.7	176.3	0	0	0	108
1351	I	25.8	Very low	27	Very low	130 Å²	130	128.8 Å²	128.8	67%	0.667	71%	0.712	S	S	*	*			trans	76.7	116.8	143.1	-80.9	164.9	0	0	0	121.3
1352	I	26.2	Very low	26.6	Very low	153 Å²	153	129.1 Å²	129.1	79%	0.785	71%	0.709	S	S	*	*			trans	65.6	132.4	142.9	-66.5	179.3	0	0	0	118.9
1353	S	23.5	Very low	26.4	Very low	87 Å²	87	126.9 Å²	126.9	61%	0.608	70%	0.697	S	S	*	*			cis	-160	177.8	-10.9	53.3	0	0	0	0	112.5
1354	D	24.8	Very low	26.1	Very low	133 Å²	133	129.8 Å²	129.8	71%	0.711	70%	0.701	S	S	*	*			trans	77.1	112.5	159.6	-56.6	-58.2	0	0	0	122
1355	I	22.8	Very low	25.8	Very low	150 Å²	150	127.4 Å²	127.4	77%	0.769	70%	0.695	S	S	*	*				14.4	135.4	129.4	-53	175.7	0	0	0	117.5
1356	P	27.1	Very low	25.8	Very low	117 Å²	117	126.2 Å²	126.2	76%	0.76	69%	0.694	S	S	*	*			cis	-134.7	-170.2	-0.2	35.4	-13.4	0	0	0	115.3
1357	S	21.8	Very low	25.8	Very low	106 Å²	106	122.7 Å²	122.7	74%	0.741	69%	0.694	S	S	*	*			trans	-68.5	174.8	156.7	-32.7	0	0	0	0	112.1
1358	P	31.8	Very low	26	Very low	104 Å²	104	125.2 Å²	125.2	68%	0.675	71%	0.706	S	S	*	*			cis	-145.4	-164.5	9.1	42	-20.3	0	0	0	116.4
1359	T	22	Very low	25.9	Very low	117 Å²	117	128.1 Å²	128.1	72%	0.718	72%	0.718	S	S	*	*			trans	76.3	133.7	149.6	45	0	0	0	0	123.3
1360	N	22.9	Very low	26.1	Very low	145 Å²	145	127.1 Å²	127.1	78%	0.775	71%	0.714	S	S	*	*			trans	101	144.6	133.7	-86.4	-4.8	0	0	0	122.3
1361	S	25.9	Very low	26.4	Very low	107 Å²	107	124.4 Å²	124.4	75%	0.748	70%	0.7	S	S	*	*			trans	57.5	122.8	167.9	29.4	0	0	0	0	117.4
1362	Q	24.1	Very low	26.6	Very low	154 Å²	154	124.8 Å²	124.8	72%	0.72	70%	0.702	S	S	*	*			cis	80	104.7	38.2	-68.8	-151.9	-42.2	0	0	116.9
1363	N	24.9	Very low	26.6	Very low	107 Å²	107	122.9 Å²	122.9	57%	0.572	69%	0.69	S	S	*	*				82	163.4	122	-59.7	-2.7	0	0	0	120.7
1364	F	25.2	Very low	26.8	Very low	176 Å²	176	125.6 Å²	125.6	77%	0.772	69%	0.691	S	S	*	*			trans	99.7	137.2	150.7	-59.8	-55.8	0	0	0	116.7
1365	S	24.8	Very low	26.9	Very low	84 Å²	84	126.6 Å²	126.6	59%	0.587	69%	0.689	S	S	*	*			cis	-168.8	173.7	-3.8	43.5	0	0	0	0	115.3
1366	N	30.3	Very low	27.1	Very low	148 Å²	148	128.6 Å²	128.6	79%	0.791	69%	0.692	S	S	*	*			trans	87.7	146.3	156.7	-51.8	-40.6	0	0	0	117.6
1367	G	29.5	Very low	27.4	Very low	61 Å²	61	128.7 Å²	128.7	63%	0.629	69%	0.692	S	S	*	*			cis	-123.6	145.9	-4.5	0	0	0	0	0	112.2
1368	L	28.3	Very low	28.1	Very low	154 Å²	154	129.8 Å²	129.8	81%	0.806	70%	0.697	S	S	*	*				89.1	125.8	85.1	-76.3	168.8	0	0	0	112.4
1369	N	29.9	Very low	27.9	Very low	131 Å²	131	128.6 Å²	128.6	70%	0.701	70%	0.704	S	S	*	*			cis	-158.3	167.3	-0.5	-161.2	-4	0	0	0	111.1
1370	K	31.9	Very low	28.1	Very low	165 Å²	165	133.8 Å²	133.8	72%	0.717	71%	0.71	S	S	*	*			trans	65.7	163.7	168.2	-70.9	-157.6	167.2	-60.1	0	116.3
1371	D	30.5	Very low	28.2	Very low	84 Å²	84	136.7 Å²	136.7	45%	0.449	71%	0.71	S	S	.	*			cis	-159.4	176.2	-36.2	-112.9	-33.3	0	0	0	106.3	Q1373	D1371-Q1373 PolarHBondContact OD1-NE2 2.79Å
1372	I	29.5	Very low	28.1	Very low	137 Å²	137	136.9 Å²	136.9	70%	0.703	71%	0.707	S	S	*	*			cis	-139.8	125.2	4.6	-143.1	143.2	0	0	0	106.5
1373	Q	27.6	Very low	28.2	Very low	113 Å²	113	135.6 Å²	135.6	53%	0.528	71%	0.71	S	S	.	*				48.8	130.5	97.8	-53.4	-177.7	42.7	0	0	114.5	D1371	D1371-Q1373 PolarHBondContact OD1-NE2 2.79Å
1374	F	26.9	Very low	28.2	Very low	144 Å²	144	139.2 Å²	139.2	63%	0.632	73%	0.728	S	S	*	*			cis	-159.8	154.2	18.2	-107.2	-28	0	0	0	114.6
1375	K	27.5	Very low	28.3	Very low	155 Å²	155	134.6 Å²	134.6	67%	0.674	73%	0.73	S	S	*	*			trans	43.2	158.2	134.1	-66.5	163.5	-178.4	159.4	0	122.1
1376	K	26.3	Very low	28.5	Very low	191 Å²	191	139.8 Å²	139.8	83%	0.83	74%	0.742	S	S	*	*			cis	-171	150.8	-30.1	-113.3	-171.6	177	-173.9	0	109.5
1377	P	34.8	Very low	28.3	Very low	119 Å²	119	139.6 Å²	139.6	77%	0.773	74%	0.741	S	S	*	*			trans	-120.1	-160.8	171.4	45.1	-34.6	0	0	0	112.4
1378	P	35.6	Very low	28.3	Very low	130 Å²	130	142.7 Å²	142.7	84%	0.844	75%	0.748	S	S	*	*			cis	-137.9	-177.4	-8.9	43.7	-26.1	0	0	0	116.9
1379	G	28.4	Very low	28.1	Very low	78 Å²	78	145.8 Å²	145.8	80%	0.804	75%	0.749	S	S	*	*			trans	168.3	163.3	162.9	0	0	0	0	0	114.5
1380	R	26	Very low	28	Very low	227 Å²	227	145.8 Å²	145.8	86%	0.857	74%	0.742	S	S	*	*			cis	-163.4	137.1	-11.1	-164.2	-169.5	-146.8	-155.5	9.3	112.1
1381	R	24.4	Very low	27.6	Very low	205 Å²	205	144.1 Å²	144.1	77%	0.774	74%	0.737	S	S	*	*			trans	62.4	135.8	154.9	-91	-169.6	-179.6	-169.6	1.1	124.5
1382	T	23.2	Very low	27.3	Very low	112 Å²	112	145.8 Å²	145.8	69%	0.687	75%	0.746	S	S	*	*			trans	76.9	138.3	138.3	47.6	0	0	0	0	125.6
1383	T	25.9	Very low	27.3	Very low	127 Å²	127	145.3 Å²	145.3	78%	0.779	74%	0.744	S	S	*	*			trans	71.1	123.7	147.7	41.6	0	0	0	0	123.1
1384	L	25.1	Very low	27.2	Very low	183 Å²	183	145.9 Å²	145.9	96%	0.958	75%	0.75	S	S	*	*			trans	55.8	123.8	136	-146.2	79.6	0	0	0	120.1
1385	G	28.2	Very low	27.2	Very low	78 Å²	78	144.1 Å²	144.1	80%	0.804	75%	0.748	S	S	*	*			trans	165.9	138.7	166.2	0	0	0	0	0	114
1386	K	28.9	Very low	27.1	Very low	194 Å²	194	144.5 Å²	144.5	84%	0.843	75%	0.749	S	S	*	*			trans	-94.5	154.2	-177.8	-65.7	174.3	-179.6	169.5	0	112.5
1387	N	25.1	Very low	27.3	Very low	144 Å²	144	140.9 Å²	140.9	77%	0.77	75%	0.748	S	S	*	*			trans	84.4	144.3	143.9	-71.6	-5.6	0	0	0	122.9
1388	T	29.8	Very low	26.9	Very low	125 Å²	125	143.6 Å²	143.6	77%	0.767	75%	0.748	S	S	*	*			trans	72	89.5	147.2	42	0	0	0	0	122.3
1389	R	25.4	Very low	26.4	Very low	219 Å²	219	145.4 Å²	145.4	83%	0.826	75%	0.75	S	S	*	*				89	130.5	105	-169.5	174.6	-163	-162.5	6.3	119.8
1390	K	26.7	Very low	26.5	Very low	131 Å²	131	150.9 Å²	150.9	57%	0.57	75%	0.752	S	S	*	*			trans	83.7	110.6	157.1	-91.2	-176.2	167.4	-70.5	0	119.9
1391	E	24.3	Very low	26.6	Very low	131 Å²	131	149.5 Å²	149.5	61%	0.612	75%	0.747	S	S	*	*				65.3	137.8	126.1	-72.4	157.6	-148.9	0	0	119.1
1392	N	24.5	Very low	26.6	Very low	119 Å²	119	146.8 Å²	146.8	64%	0.636	75%	0.747	S	S	*	*			cis	-166.3	166.9	19.8	-133.5	-16.6	0	0	0	115
1393	I	28.6	Very low	26.8	Very low	127 Å²	127	145.6 Å²	145.6	65%	0.651	74%	0.744	S	S	*	*			trans	83.1	107.5	143.6	-76.7	162.9	0	0	0	121.3
1394	N	25.8	Very low	26.9	Very low	125 Å²	125	145.7 Å²	145.7	67%	0.668	74%	0.744	S	S	*	*			trans	78.3	146.7	132.5	-70	41.3	0	0	0	121.6
1395	D	26.7	Very low	27.2	Very low	107 Å²	107	143.3 Å²	143.3	57%	0.572	73%	0.728	S	S	*	*			cis	-156.5	170	6.3	-137	-25.7	0	0	0	117.3
1396	K	25.6	Very low	27.5	Very low	162 Å²	162	144.9 Å²	144.9	70%	0.704	72%	0.724	S	S	*	*			trans	66.5	94.1	151.2	-70.9	149.6	-165.6	154.3	0	120.9
1397	S	29.5	Very low	27.8	Very low	115 Å²	115	141.1 Å²	141.1	80%	0.804	72%	0.722	S	S	*	*				-148.5	104.6	104.4	58.4	0	0	0	0	109.8
1398	K	26.3	Very low	28.5	Very low	177 Å²	177	136.4 Å²	136.4	77%	0.77	70%	0.696	S	S	*	*				47.7	81.1	91.6	-74.5	-171.4	177.1	178	0	114
1399	N	26.9	Very low	29.1	Very low	167 Å²	167	131.5 Å²	131.5	89%	0.893	67%	0.667	S	S	*	*			trans	-146.5	95.1	142.6	-128.5	-21.6	0	0	0	110.2
1400	K	29.6	Very low	30.4	Very low	193 Å²	193	122 Å²	122	84%	0.839	63%	0.633	S	S	*	*			trans	-95.5	109.1	-172.2	-167	178.1	-175.2	-178.1	0	108.6	N1402	K1400-N1402 PolarHBondContact O-N 2.79Å
1401	R	27.9	Very low	31.4	Very low	199 Å²	199	119.3 Å²	119.3	75%	0.751	62%	0.621	S	S	*	*			trans	-61	119.7	177.1	-73.7	179.5	172.5	170.4	-5.3	110.1	S1403	R1401-S1403 PolarHBondContact O-N 3.3Å
1402	N	25.4	Very low	33	Very low	147 Å²	147	114.1 Å²	114.1	79%	0.786	60%	0.6	S	S	*	*			trans	-77.2	98.9	167.4	-78.7	-14.4	0	0	0	109	K1400 T1404	K1400-N1402 PolarHBondContact O-N 2.79Å; N1402-T1404 PolarHBondContact O-N 3.2Å
1403	S	27.2	Very low	34.9	Very low	87 Å²	87	110.2 Å²	110.2	61%	0.608	58%	0.576	S	S	*	*			trans	-75.8	103.8	155	-179.8	0	0	0	0	107.7	R1401 H1405	R1401-S1403 PolarHBondContact O-N 3.3Å; S1403-H1405 PolarHBondContact O-N 2.9Å; S1403-H1405 PolarHBondContact OG-CD2 3.09Å; S1403-H1405 PolarHBondContact OG-NE2 3.16Å
1404	T	27	Very low	36.7	Very low	130 Å²	130	105.8 Å²	105.8	80%	0.798	55%	0.552	S	S	*	*			trans	-78.1	73.4	168	41.9	0	0	0	0	109.8	N1402	N1402-T1404 PolarHBondContact O-N 3.2Å
1405	H	32.2	Very low	38.5	Very low	132 Å²	132	102.5 Å²	102.5	61%	0.611	53%	0.53	S	S	*	.			trans	-55.5	132.4	155.2	-72.2	-84.9	0	0	0	107.9	S1403 S1407	S1403-H1405 PolarHBondContact O-N 2.9Å; S1403-H1405 PolarHBondContact OG-CD2 3.09Å; S1403-H1405 PolarHBondContact OG-NE2 3.16Å; H1405-S1407 PolarHBondContact O-N 3.2Å
1406	P	33.7	Very low	40.3	Very low	112 Å²	112	98.4 Å²	98.4	73%	0.727	51%	0.513	S	S	*	.			trans	-61.6	115.6	170.6	26.1	-32.3	0	0	0	107.5	M1408	P1406-M1408 PolarHBondContact O-N 2.93Å
1407	S	35.8	Very low	42.4	Very low	114 Å²	114	90.9 Å²	90.9	80%	0.797	48%	0.48	S	S	*	.			trans	-71.5	86	178.4	59.3	0	0	0	0	108.7	H1405 S1409	H1405-S1407 PolarHBondContact O-N 3.2Å; S1407-S1409 PolarHBondContact O-N 2.99Å; S1407-S1409 VanDerWaalsContact O-N 3.14Å
1408	M	38.7	Very low	44.4	Very low	45 Å²	45	87.2 Å²	87.2	22%	0.222	45%	0.449	C	S	.	.			trans	-53.8	123.7	175.7	-72	-174.4	65.2	0	0	108.7	R1304 P1406 V1410 D1538	R1304-M1408 HydrophobicContact CB-CE 4.23Å; P1406-M1408 PolarHBondContact O-N 2.93Å; M1408-V1410 HydrophobicContact CB-CG2 3.79Å; M1408-V1410 WeakPolarHBondContact O-CG2 3.4Å; M1408-V1410 PolarHBondContact O-N 3.39Å; M1408-D1538 WeakPolarHBondContact CE-OD1 3.25Å
1409	S	43.7	Very low	46.8	Very low	22 Å²	22	79.6 Å²	79.6	15%	0.154	42%	0.416	C	S	.	.			trans	-77.2	67.3	179.3	28.7	0	0	0	0	109.5	K1302 C1303 S1407 F1411	K1302-S1409 WeakPolarHBondContact O-CB 3.28Å; K1302-S1409 PolarHBondContact O-OG 3.14Å; C1303-S1409 WeakPolarHBondContact CA-O 3.35Å; C1303-S1409 VanDerWaalsContact CA-OG 3.32Å; C1303-S1409 WeakPolarHBondContact CA-OG 3.39Å; C1303-S1409 WeakPolarHBondContact CB-O 3.37Å; S1407-S1409 PolarHBondContact O-N 2.99Å; S1407-S1409 VanDerWaalsContact O-N 3.14Å; S1409-F1411 PolarHBondContact O-N 2.8Å
1410	V	52.1	Low	49.2	Very low	19 Å²	19	71.6 Å²	71.6	12%	0.115	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	0.1	-169.1	161.9	0	0	0	0	114.4	M1408 C1412 R1413 F1414 C1554 T1613	M1408-V1410 HydrophobicContact CB-CG2 3.79Å; M1408-V1410 WeakPolarHBondContact O-CG2 3.4Å; M1408-V1410 PolarHBondContact O-N 3.39Å; V1410-C1412 PolarHBondContact O-N 3.41Å; V1410-R1413 PolarHBondContact O-N 3.3Å; V1410-F1414 PolarHBondContact O-N 3.43Å; V1410-C1554 VanDerWaalsContact CG1-C 3.49Å; V1410-C1554 HydrophobicContact CG1-CB 3.6Å; V1410-C1554 WeakPolarHBondContact CG1-O 3.42Å; V1410-T1613 HydrophobicContact CB-CG2 4.27Å; V1410-T1613 HydrophobicContact CG2-CG2 4.09Å
1411	F	47.8	Very low	51.3	Low	75 Å²	75	63.8 Å²	63.8	33%	0.329	34%	0.342	S	S	.	.	H	α-helix	trans	-63.3	-42.5	-169.4	-148.5	-96.5	0	0	0	115.4	V1300 S1409 F1414 W1415	V1300-F1411 HydrophobicContact CB-CD1 4.23Å; V1300-F1411 HydrophobicContact CB-CE1 4.11Å; V1300-F1411 HydrophobicContact CB-CZ 4.45Å; V1300-F1411 HydrophobicContact CG1-CB 4.13Å; V1300-F1411 HydrophobicContact CG1-CD1 3.45Å; V1300-F1411 VanDerWaalsContact CG1-CD1 3.45Å; V1300-F1411 HydrophobicContact CG1-CD2 3.61Å; V1300-F1411 HydrophobicContact CG1-CE1 3.55Å; V1300-F1411 HydrophobicContact CG1-CE2 3.73Å; V1300-F1411 HydrophobicContact CG1-CG 3.46Å; V1300-F1411 VanDerWaalsContact CG1-CG 3.46Å; V1300-F1411 HydrophobicContact CG1-CZ 3.68Å; V1300-F1411 HydrophobicContact CG2-CE1 3.9Å; V1300-F1411 HydrophobicContact CG2-CZ 4.03Å; S1409-F1411 PolarHBondContact O-N 2.8Å; F1411-F1414 WeakPolarHBondContact O-CB 3.49Å; F1411-F1414 PolarHBondContact O-N 2.97Å; F1411-W1415 AromaticContact CD1-CD1 3.35Å; F1411-W1415 AromaticContact CD1-NE1 3.51Å; F1411-W1415 AromaticContact CE1-CD1 3.23Å; F1411-W1415 HydrophobicContact CE1-CG 4.38Å; F1411-W1415 AromaticContact CE1-NE1 2.95Å; F1411-W1415 AromaticContact CE2-NE1 3.6Å; F1411-W1415 AromaticContact CZ-CD1 3.8Å; F1411-W1415 AromaticContact CZ-CE2 3.95Å; F1411-W1415 HydrophobicContact CZ-CZ2 4.38Å; F1411-W1415 AromaticContact CZ-NE1 3.02Å; F1411-W1415 VanDerWaalsContact O-CD1 3.27Å; F1411-W1415 PolarHBondContact O-N 3.49Å; F1411-W1415 VanDerWaalsContact O-N 3.16Å
1412	C	58.8	Low	53.4	Low	23 Å²	23	56.2 Å²	56.2	16%	0.155	31%	0.314	C	S	.	.	H	α-helix	trans	-69	-38.6	179.4	126.1	0	0	0	0	111.9	C1292 C1303 V1410 F1414 W1415 G1416	C1292-C1412 HydrophobicContact CB-CB 3.8Å; C1303-C1412 HydrophobicContact CB-CB 3.97Å; C1303-C1412 PolarHBondContact SG-SG 3.17Å; V1410-C1412 PolarHBondContact O-N 3.41Å; C1412-F1414 VanDerWaalsContact C-N 3.27Å; C1412-F1414 PolarHBondContact O-N 3.37Å; C1412-W1415 PolarHBondContact O-N 3.14Å; C1412-G1416 WeakPolarHBondContact O-CA 3.4Å; C1412-G1416 PolarHBondContact O-N 2.67Å
1413	R	64.4	Low	55.9	Low	36 Å²	36	51.8 Å²	51.8	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-65.4	-30.2	172.5	-78.7	-169.4	177.1	151.9	-2.7	112.2	V1410 F1417 D1538 G1555	V1410-R1413 PolarHBondContact O-N 3.3Å; R1413-F1417 VanDerWaalsContact O-CB 3.28Å; R1413-F1417 WeakPolarHBondContact O-CB 3.5Å; R1413-F1417 PolarHBondContact O-N 3.04Å; R1413-D1538 IonicContact CZ-OD1 2.62Å; R1413-D1538 IonicContact CZ-OD2 2.86Å; R1413-D1538 IonicContact NH1-OD1 2.74Å; R1413-D1538 PolarHBondContact NH1-OD1 3.14Å; R1413-D1538 IonicContact NH1-OD2 3.11Å; R1413-D1538 PolarHBondContact NH1-OD2 3.46Å; R1413-G1555 WeakPolarHBondContact CB-O 3.46Å; R1413-G1555 WeakPolarHBondContact CD-O 3.44Å
1414	F	66.7	Low	58.2	Low	35 Å²	35	56.1 Å²	56.1	15%	0.154	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-56.8	172.9	-173	-124.6	0	0	0	112.1	V1410 F1411 C1412 F1417 R1418 I1430 K1553 C1554	V1410-F1414 PolarHBondContact O-N 3.43Å; F1411-F1414 WeakPolarHBondContact O-CB 3.49Å; F1411-F1414 PolarHBondContact O-N 2.97Å; C1412-F1414 VanDerWaalsContact C-N 3.27Å; C1412-F1414 PolarHBondContact O-N 3.37Å; F1414-F1417 PolarHBondContact O-N 3.4Å; F1414-R1418 HydrophobicContact CE2-CG 4.37Å; F1414-R1418 HydrophobicContact CZ-CG 4.49Å; F1414-R1418 WeakPolarHBondContact O-CG 3.48Å; F1414-I1430 HydrophobicContact CE1-CD1 3.93Å; F1414-I1430 HydrophobicContact CZ-CD1 3.8Å; F1414-K1553 VanDerWaalsContact CE2-C 3.49Å; F1414-K1553 WeakPolarHBondContact CE2-O 3.4Å; F1414-C1554 VanDerWaalsContact CA-O 3.25Å; F1414-C1554 WeakPolarHBondContact CA-O 3.5Å; F1414-C1554 WeakPolarHBondContact CB-O 3.42Å; F1414-C1554 PolarHBondContact N-O 3.17Å
1415	W	63.7	Low	60.4	Low	56 Å²	56	60.7 Å²	60.7	21%	0.212	31%	0.309	C	S	.	.	H	α-helix	trans	-81.3	-30	-172.9	-64.5	96	0	0	0	113.5	L1289 F1411 C1412 F1417 R1418 L1420 I1430	L1289-W1415 HydrophobicContact CB-CB 3.89Å; L1289-W1415 HydrophobicContact CD1-CB 3.68Å; L1289-W1415 HydrophobicContact CD1-CD2 4.5Å; L1289-W1415 HydrophobicContact CD1-CG 4.16Å; L1289-W1415 HydrophobicContact CG-CB 4.43Å; F1411-W1415 AromaticContact CD1-CD1 3.35Å; F1411-W1415 AromaticContact CD1-NE1 3.51Å; F1411-W1415 AromaticContact CE1-CD1 3.23Å; F1411-W1415 HydrophobicContact CE1-CG 4.38Å; F1411-W1415 AromaticContact CE1-NE1 2.95Å; F1411-W1415 AromaticContact CE2-NE1 3.6Å; F1411-W1415 AromaticContact CZ-CD1 3.8Å; F1411-W1415 AromaticContact CZ-CE2 3.95Å; F1411-W1415 HydrophobicContact CZ-CZ2 4.38Å; F1411-W1415 AromaticContact CZ-NE1 3.02Å; F1411-W1415 VanDerWaalsContact O-CD1 3.27Å; F1411-W1415 PolarHBondContact O-N 3.49Å; F1411-W1415 VanDerWaalsContact O-N 3.16Å; C1412-W1415 PolarHBondContact O-N 3.14Å; W1415-F1417 PolarHBondContact O-N 2.8Å; W1415-R1418 PolarHBondContact O-N 2.9Å; W1415-R1418 VanDerWaalsContact O-N 3.14Å; W1415-L1420 HydrophobicContact CE3-CD1 3.75Å; W1415-L1420 HydrophobicContact CE3-CD2 3.61Å; W1415-L1420 HydrophobicContact CE3-CG 4.34Å; W1415-L1420 HydrophobicContact CZ3-CD1 4.3Å; W1415-L1420 HydrophobicContact CZ3-CD2 3.72Å; W1415-I1430 HydrophobicContact CE3-CG1 4.42Å; W1415-I1430 HydrophobicContact CH2-CD1 4.03Å; W1415-I1430 HydrophobicContact CH2-CG1 3.99Å; W1415-I1430 HydrophobicContact CZ3-CD1 4.05Å; W1415-I1430 HydrophobicContact CZ3-CG1 3.62Å
1416	G	63.6	Low	62.2	Low	20 Å²	20	55.2 Å²	55.2	21%	0.206	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-7.5	170.8	0	0	0	0	0	114.1	Q1288 L1289 C1412	Q1288-G1416 PolarHBondContact NE2-O 2.99Å; L1289-G1416 WeakPolarHBondContact O-CA 3.39Å; L1289-G1416 PolarHBondContact O-N 3.49Å; C1412-G1416 WeakPolarHBondContact O-CA 3.4Å; C1412-G1416 PolarHBondContact O-N 2.67Å
1417	F	69.7	Low	64	Low	4 Å²	4	54 Å²	54	2%	0.018	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	2.2	172.4	-173.1	-127.4	0	0	0	113.4	R1413 F1414 W1415 F1433 A1525 K1527 V1550 L1625 T1627	R1413-F1417 VanDerWaalsContact O-CB 3.28Å; R1413-F1417 WeakPolarHBondContact O-CB 3.5Å; R1413-F1417 PolarHBondContact O-N 3.04Å; F1414-F1417 PolarHBondContact O-N 3.4Å; W1415-F1417 PolarHBondContact O-N 2.8Å; F1417-F1433 AromaticContact CD1-CD1 3.79Å; F1417-F1433 HydrophobicContact CD1-CD1 3.79Å; F1417-F1433 AromaticContact CD1-CE1 3.73Å; F1417-F1433 HydrophobicContact CD1-CE1 3.73Å; F1417-F1433 AromaticContact CE1-CD1 3.51Å; F1417-F1433 HydrophobicContact CE1-CD1 3.51Å; F1417-F1433 AromaticContact CE1-CE1 3.52Å; F1417-F1433 HydrophobicContact CE1-CE1 3.52Å; F1417-F1433 HydrophobicContact CE2-CD1 4.45Å; F1417-F1433 HydrophobicContact CG-CD1 4.4Å; F1417-F1433 AromaticContact CZ-CD1 3.88Å; F1417-F1433 HydrophobicContact CZ-CD1 3.88Å; F1417-F1433 HydrophobicContact CZ-CE1 4.33Å; F1417-F1433 WeakPolarHBondContact O-CD1 3.42Å; F1417-A1525 HydrophobicContact CE2-CB 3.93Å; F1417-A1525 HydrophobicContact CZ-CB 3.57Å; F1417-K1527 HydrophobicContact CD2-CB 3.85Å; F1417-K1527 HydrophobicContact CD2-CD 4.21Å; F1417-K1527 HydrophobicContact CD2-CG 4.04Å; F1417-K1527 HydrophobicContact CE2-CB 3.95Å; F1417-V1550 HydrophobicContact CD1-CB 4.18Å; F1417-V1550 HydrophobicContact CD1-CG1 3.5Å; F1417-V1550 HydrophobicContact CE1-CB 3.62Å; F1417-V1550 HydrophobicContact CE1-CG1 3.47Å; F1417-V1550 VanDerWaalsContact CE1-CG1 3.47Å; F1417-V1550 HydrophobicContact CE1-CG2 4.27Å; F1417-V1550 HydrophobicContact CG-CG1 4.33Å; F1417-V1550 HydrophobicContact CZ-CB 4.05Å; F1417-V1550 HydrophobicContact CZ-CG1 4.28Å; F1417-V1550 HydrophobicContact CZ-CG2 4.3Å; F1417-L1625 HydrophobicContact CE1-CD2 4.23Å; F1417-L1625 HydrophobicContact CZ-CD2 4.22Å; F1417-T1627 HydrophobicContact CD2-CG2 4.44Å; F1417-T1627 HydrophobicContact CE2-CG2 3.43Å; F1417-T1627 VanDerWaalsContact CE2-CG2 3.43Å; F1417-T1627 HydrophobicContact CZ-CG2 3.69Å; F1417-T1627 WeakPolarHBondContact CZ-OG1 3.41Å
1418	R	71.9	Confident	65.5	Low	39 Å²	39	50.9 Å²	50.9	15%	0.147	25%	0.253	C	S	.	.	S	Bend	trans	-106.9	138.4	-179.2	-76.6	-59.8	-161.3	157.2	-3.7	112.3	F1414 W1415 L1420 I1430 D1432 G1552	F1414-R1418 HydrophobicContact CE2-CG 4.37Å; F1414-R1418 HydrophobicContact CZ-CG 4.49Å; F1414-R1418 WeakPolarHBondContact O-CG 3.48Å; W1415-R1418 PolarHBondContact O-N 2.9Å; W1415-R1418 VanDerWaalsContact O-N 3.14Å; R1418-L1420 HydrophobicContact CB-CD2 3.68Å; R1418-I1430 HydrophobicContact CG-CG2 4.28Å; R1418-D1432 WeakPolarHBondContact CD-O 3.37Å; R1418-D1432 PolarHBondContact NH1-O 2.81Å; R1418-G1552 PolarHBondContact NH2-O 3.48Å
1419	K	76.8	Confident	67.2	Low	16 Å²	16	54.9 Å²	54.9	7%	0.07	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	115.6	170.2	-171	173.6	180	176.4	0	108	F1286 A1431 D1432 F1433 E1438	F1286-K1419 HydrophobicContact CB-CG 3.79Å; F1286-K1419 HydrophobicContact CD1-CD 4.03Å; F1286-K1419 VanDerWaalsContact CD1-CE 3.46Å; F1286-K1419 HydrophobicContact CD1-CG 3.58Å; F1286-K1419 HydrophobicContact CD2-CD 4.45Å; F1286-K1419 HydrophobicContact CE1-CD 4.36Å; F1286-K1419 HydrophobicContact CE1-CG 4.32Å; F1286-K1419 HydrophobicContact CG-CD 4.06Å; F1286-K1419 HydrophobicContact CG-CG 3.7Å; K1419-A1431 WeakPolarHBondContact O-CB 3.19Å; K1419-A1431 PolarHBondContact O-N 3.47Å; K1419-D1432 WeakPolarHBondContact CB-O 3.31Å; K1419-D1432 HydrophobicContact CD-CB 4.49Å; K1419-D1432 PolarHBondContact N-O 2.95Å; K1419-D1432 PolarHBondContact O-N 2.96Å; K1419-F1433 VanDerWaalsContact CD-O 3.3Å; K1419-F1433 WeakPolarHBondContact CD-O 3.37Å; K1419-E1438 WeakPolarHBondContact CE-OE2 3.34Å; K1419-E1438 IonicContact NZ-OE1 3.33Å; K1419-E1438 PolarHBondContact NZ-OE1 2.79Å; K1419-E1438 IonicContact NZ-OE2 2.72Å; K1419-E1438 PolarHBondContact NZ-OE2 3.15Å
1420	L	76.3	Confident	68.6	Low	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.8	-172.7	-46.2	177.7	0	0	0	109.9	F1286 V1287 L1289 W1415 R1418 L1428 K1429 I1430	F1286-L1420 CarbonylContact C-O 3.47Å; F1286-L1420 VanDerWaalsContact CA-O 3.24Å; F1286-L1420 WeakPolarHBondContact CA-O 3.5Å; V1287-L1420 PolarHBondContact N-O 3.36Å; V1287-L1420 WeakPolarHBondContact O-CA 3.41Å; V1287-L1420 VanDerWaalsContact O-CB 3.24Å; V1287-L1420 WeakPolarHBondContact O-CB 3.35Å; V1287-L1420 WeakPolarHBondContact O-CG 3.42Å; V1287-L1420 PolarHBondContact O-N 3.24Å; L1289-L1420 HydrophobicContact CD1-CD1 3.97Å; L1289-L1420 HydrophobicContact CG-CD1 4.45Å; W1415-L1420 HydrophobicContact CE3-CD1 3.75Å; W1415-L1420 HydrophobicContact CE3-CD2 3.61Å; W1415-L1420 HydrophobicContact CE3-CG 4.34Å; W1415-L1420 HydrophobicContact CZ3-CD1 4.3Å; W1415-L1420 HydrophobicContact CZ3-CD2 3.72Å; R1418-L1420 HydrophobicContact CB-CD2 3.68Å; L1420-L1428 HydrophobicContact CB-CD1 4.25Å; L1420-L1428 HydrophobicContact CB-CD2 4.16Å; L1420-L1428 HydrophobicContact CB-CG 4.06Å; L1420-L1428 HydrophobicContact CD1-CD2 3.76Å; L1420-K1429 CarbonylContact C-O 3.58Å; L1420-K1429 WeakPolarHBondContact CA-O 3.25Å; L1420-I1430 HydrophobicContact CD2-CB 4.45Å; L1420-I1430 HydrophobicContact CD2-CG1 3.98Å
1421	C	74.1	Confident	69.8	Low	29 Å²	29	57.4 Å²	57.4	20%	0.196	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	158.3	174.4	68.3	0	0	0	0	111	V1285 F1286 K1429 A1431	V1285-C1421 WeakPolarHBondContact O-CB 3.21Å; F1286-C1421 HydrophobicContact CD1-CB 4.03Å; F1286-C1421 HydrophobicContact CE1-CB 4.19Å; C1421-K1429 PolarHBondContact N-O 3.11Å; C1421-K1429 PolarHBondContact O-N 3Å; C1421-A1431 HydrophobicContact CB-CB 4.2Å
1422	Y	72.9	Confident	71.4	Confident	40 Å²	40	55.8 Å²	55.8	16%	0.157	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	130.2	163.3	-70.1	-74.4	0	0	0	109.5	L1276 K1280 G1426 L1428	L1276-Y1422 HydrophobicContact CD2-CE1 4.04Å; L1276-Y1422 WeakPolarHBondContact CG-OH 3.37Å; L1276-Y1422 PolarHBondContact O-OH 3.11Å; L1276-Y1422 VanDerWaalsContact O-OH 3.12Å; K1280-Y1422 HydrophobicContact CB-CD2 4.36Å; K1280-Y1422 HydrophobicContact CB-CE2 4.18Å; Y1422-G1426 WeakPolarHBondContact CD1-O 3.04Å; Y1422-L1428 HydrophobicContact CD1-CD1 4.03Å; Y1422-L1428 HydrophobicContact CD2-CD1 4.36Å; Y1422-L1428 HydrophobicContact CE1-CB 4.32Å; Y1422-L1428 HydrophobicContact CE1-CD1 3.66Å; Y1422-L1428 HydrophobicContact CE2-CD1 4.01Å; Y1422-L1428 HydrophobicContact CG-CD1 4.36Å
1423	N	77.6	Confident	72.5	Confident	54 Å²	54	56 Å²	56	29%	0.289	28%	0.279	S	S	.	.			trans	-75.1	170.2	164.9	70.9	22.7	0	0	0	110.7	R1425 G1426 V1427	N1423-R1425 PolarHBondContact O-N 2.97Å; N1423-R1425 WeakPolarHBondContact OD1-CA 3.38Å; N1423-R1425 WeakPolarHBondContact OD1-CB 3.35Å; N1423-R1425 PolarHBondContact OD1-N 3.31Å; N1423-G1426 PolarHBondContact O-N 3.22Å; N1423-G1426 PolarHBondContact OD1-N 3.22Å; N1423-V1427 VanDerWaalsContact CG-O 3.28Å; N1423-V1427 PolarHBondContact N-O 3.46Å; N1423-V1427 PolarHBondContact OD1-N 3.2Å; N1423-V1427 PolarHBondContact OD1-O 3.46Å
1424	N	75.8	Confident	73.1	Confident	178 Å²	178	54.5 Å²	54.5	95%	0.952	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-9.6	-179	-50.5	45.1	0	0	0	114.2
1425	R	72.8	Confident	73.7	Confident	226 Å²	226	58.5 Å²	58.5	85%	0.853	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	2.6	173.8	-56.8	-177.6	179.5	-177.3	-2.1	112.6	N1423 V1427	N1423-R1425 PolarHBondContact O-N 2.97Å; N1423-R1425 WeakPolarHBondContact OD1-CA 3.38Å; N1423-R1425 WeakPolarHBondContact OD1-CB 3.35Å; N1423-R1425 PolarHBondContact OD1-N 3.31Å; R1425-V1427 VanDerWaalsContact C-N 3.31Å; R1425-V1427 PolarHBondContact O-N 3.38Å
1426	G	69.7	Low	74.4	Confident	16 Å²	16	56.8 Å²	56.8	17%	0.165	29%	0.285	C	S	.	.	S	Bend	trans	74.1	15.9	-176.8	0	0	0	0	0	114.8	Y1422 N1423	Y1422-G1426 WeakPolarHBondContact CD1-O 3.04Å; N1423-G1426 PolarHBondContact O-N 3.22Å; N1423-G1426 PolarHBondContact OD1-N 3.22Å
1427	V	70.3	Confident	74.9	Confident	87 Å²	87	60.7 Å²	60.7	53%	0.527	31%	0.305	S	S	.	.			trans	-94.1	132.2	175.2	-178.1	0	0	0	0	109.1	N1423 R1425 K1429	N1423-V1427 VanDerWaalsContact CG-O 3.28Å; N1423-V1427 PolarHBondContact N-O 3.46Å; N1423-V1427 PolarHBondContact OD1-N 3.2Å; N1423-V1427 PolarHBondContact OD1-O 3.46Å; R1425-V1427 VanDerWaalsContact C-N 3.31Å; R1425-V1427 PolarHBondContact O-N 3.38Å; V1427-K1429 PolarHBondContact O-N 2.94Å
1428	L	68.7	Low	75.3	Confident	49 Å²	49	63.9 Å²	63.9	26%	0.257	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	126.9	177.7	-156.5	77.8	0	0	0	110.2	L1270 L1420 Y1422	L1270-L1428 HydrophobicContact CD1-CD2 3.83Å; L1420-L1428 HydrophobicContact CB-CD1 4.25Å; L1420-L1428 HydrophobicContact CB-CD2 4.16Å; L1420-L1428 HydrophobicContact CB-CG 4.06Å; L1420-L1428 HydrophobicContact CD1-CD2 3.76Å; Y1422-L1428 HydrophobicContact CD1-CD1 4.03Å; Y1422-L1428 HydrophobicContact CD2-CD1 4.36Å; Y1422-L1428 HydrophobicContact CE1-CB 4.32Å; Y1422-L1428 HydrophobicContact CE1-CD1 3.66Å; Y1422-L1428 HydrophobicContact CE2-CD1 4.01Å; Y1422-L1428 HydrophobicContact CG-CD1 4.36Å
1429	K	73.2	Confident	75.6	Confident	128 Å²	128	62.2 Å²	62.2	56%	0.557	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127	145	-178.3	-167.7	-156.1	168.9	-166.1	0	109.4	L1420 C1421 V1427 A1431	L1420-K1429 CarbonylContact C-O 3.58Å; L1420-K1429 WeakPolarHBondContact CA-O 3.25Å; C1421-K1429 PolarHBondContact N-O 3.11Å; C1421-K1429 PolarHBondContact O-N 3Å; V1427-K1429 PolarHBondContact O-N 2.94Å; K1429-A1431 PolarHBondContact O-N 3.19Å
1430	I	74.2	Confident	75.5	Confident	50 Å²	50	63.5 Å²	63.5	26%	0.256	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	122.6	164.2	-58.3	173.5	0	0	0	108.4	F1414 W1415 R1418 L1420	F1414-I1430 HydrophobicContact CE1-CD1 3.93Å; F1414-I1430 HydrophobicContact CZ-CD1 3.8Å; W1415-I1430 HydrophobicContact CE3-CG1 4.42Å; W1415-I1430 HydrophobicContact CH2-CD1 4.03Å; W1415-I1430 HydrophobicContact CH2-CG1 3.99Å; W1415-I1430 HydrophobicContact CZ3-CD1 4.05Å; W1415-I1430 HydrophobicContact CZ3-CG1 3.62Å; R1418-I1430 HydrophobicContact CG-CG2 4.28Å; L1420-I1430 HydrophobicContact CD2-CB 4.45Å; L1420-I1430 HydrophobicContact CD2-CG1 3.98Å
1431	A	77.8	Confident	75.2	Confident	45 Å²	45	66.4 Å²	66.4	37%	0.372	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-64.6	174.7	0	0	0	0	0	110.2	F1286 K1419 C1421 K1429	F1286-A1431 HydrophobicContact CD1-CB 4.22Å; F1286-A1431 HydrophobicContact CE1-CB 4.03Å; K1419-A1431 WeakPolarHBondContact O-CB 3.19Å; K1419-A1431 PolarHBondContact O-N 3.47Å; C1421-A1431 HydrophobicContact CB-CB 4.2Å; K1429-A1431 PolarHBondContact O-N 3.19Å
1432	D	79.8	Confident	75	Confident	41 Å²	41	66.6 Å²	66.6	22%	0.219	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	-151.3	-174.1	-159.3	-5.6	0	0	0	110.2	R1418 K1419	R1418-D1432 WeakPolarHBondContact CD-O 3.37Å; R1418-D1432 PolarHBondContact NH1-O 2.81Å; K1419-D1432 WeakPolarHBondContact CB-O 3.31Å; K1419-D1432 HydrophobicContact CD-CB 4.49Å; K1419-D1432 PolarHBondContact N-O 2.95Å; K1419-D1432 PolarHBondContact O-N 2.96Å
1433	F	82.1	Confident	75.1	Confident	26 Å²	26	65.4 Å²	65.4	11%	0.114	34%	0.341	C	S	.	.			trans	-104	162.6	158.8	-56.9	-88.8	0	0	0	110	F1417 K1419 A1525 L1625	F1417-F1433 AromaticContact CD1-CD1 3.79Å; F1417-F1433 HydrophobicContact CD1-CD1 3.79Å; F1417-F1433 AromaticContact CD1-CE1 3.73Å; F1417-F1433 HydrophobicContact CD1-CE1 3.73Å; F1417-F1433 AromaticContact CE1-CD1 3.51Å; F1417-F1433 HydrophobicContact CE1-CD1 3.51Å; F1417-F1433 AromaticContact CE1-CE1 3.52Å; F1417-F1433 HydrophobicContact CE1-CE1 3.52Å; F1417-F1433 HydrophobicContact CE2-CD1 4.45Å; F1417-F1433 HydrophobicContact CG-CD1 4.4Å; F1417-F1433 AromaticContact CZ-CD1 3.88Å; F1417-F1433 HydrophobicContact CZ-CD1 3.88Å; F1417-F1433 HydrophobicContact CZ-CE1 4.33Å; F1417-F1433 WeakPolarHBondContact O-CD1 3.42Å; K1419-F1433 VanDerWaalsContact CD-O 3.3Å; K1419-F1433 WeakPolarHBondContact CD-O 3.37Å; F1433-A1525 HydrophobicContact CB-CB 4.03Å; F1433-A1525 HydrophobicContact CG-CB 4.44Å; F1433-L1625 HydrophobicContact CD1-CD2 3.82Å; F1433-L1625 HydrophobicContact CD2-CD2 3.6Å; F1433-L1625 HydrophobicContact CE1-CD2 3.82Å; F1433-L1625 HydrophobicContact CE2-CD2 3.59Å; F1433-L1625 HydrophobicContact CG-CD2 3.71Å; F1433-L1625 HydrophobicContact CZ-CD2 3.7Å
1434	C	77.9	Confident	75.1	Confident	6 Å²	6	67 Å²	67	4%	0.041	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	147	172.6	-58.2	0	0	0	0	109.8	Q1288 W1526	Q1288-C1434 PolarHBondContact OE1-SG 3.45Å; C1434-W1526 HydrophobicContact CB-CE3 4.35Å; C1434-W1526 PolarHBondContact O-N 3.24Å
1435	R	79.6	Confident	75.1	Confident	119 Å²	119	58.7 Å²	58.7	45%	0.449	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	155	174.6	-58.6	178.6	-178.5	-171.4	0.4	110.4	T1437 E1438	R1435-T1437 VanDerWaalsContact C-N 3.26Å; R1435-T1437 PolarHBondContact O-N 3.02Å; R1435-E1438 HydrophobicContact CB-CG 3.97Å; R1435-E1438 PolarHBondContact N-OE2 3.01Å; R1435-E1438 VanDerWaalsContact O-CB 3.32Å; R1435-E1438 WeakPolarHBondContact O-CB 3.43Å; R1435-E1438 PolarHBondContact O-N 3.37Å
1436	S	76.9	Confident	75.3	Confident	20 Å²	20	48.5 Å²	48.5	14%	0.14	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-66.4	-27.4	-176	58.3	0	0	0	0	113.6	E1438 S1439 S1632	S1436-E1438 PolarHBondContact O-N 3.26Å; S1436-S1439 PolarHBondContact O-OG 3.04Å; S1436-S1632 WeakPolarHBondContact CB-OG 3.49Å; S1436-S1632 WeakPolarHBondContact OG-CB 3.43Å; S1436-S1632 PolarHBondContact OG-OG 2.97Å
1437	T	76	Confident	75.7	Confident	101 Å²	101	47.9 Å²	47.9	62%	0.62	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-72	-14	171.8	50.8	0	0	0	0	113.6	R1435 S1439	R1435-T1437 VanDerWaalsContact C-N 3.26Å; R1435-T1437 PolarHBondContact O-N 3.02Å; T1437-S1439 VanDerWaalsContact C-N 3.27Å; T1437-S1439 PolarHBondContact O-N 3.05Å
1438	E	76.8	Confident	76	Confident	71 Å²	71	44.7 Å²	44.7	33%	0.332	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-90.2	8.7	179.3	-56.9	169.5	172	0	0	112.4	K1419 R1435 S1436	K1419-E1438 WeakPolarHBondContact CE-OE2 3.34Å; K1419-E1438 IonicContact NZ-OE1 3.33Å; K1419-E1438 PolarHBondContact NZ-OE1 2.79Å; K1419-E1438 IonicContact NZ-OE2 2.72Å; K1419-E1438 PolarHBondContact NZ-OE2 3.15Å; R1435-E1438 HydrophobicContact CB-CG 3.97Å; R1435-E1438 PolarHBondContact N-OE2 3.01Å; R1435-E1438 VanDerWaalsContact O-CB 3.32Å; R1435-E1438 WeakPolarHBondContact O-CB 3.43Å; R1435-E1438 PolarHBondContact O-N 3.37Å; S1436-E1438 PolarHBondContact O-N 3.26Å
1439	S	78.2	Confident	75.9	Confident	4 Å²	4	43 Å²	43	3%	0.028	22%	0.223	C	C	.	.			trans	-76.3	133.2	169.2	58.5	0	0	0	0	110.5	S1436 T1437 R1444 P1631	S1436-S1439 PolarHBondContact O-OG 3.04Å; T1437-S1439 VanDerWaalsContact C-N 3.27Å; T1437-S1439 PolarHBondContact O-N 3.05Å; S1439-R1444 PolarHBondContact O-NE 2.88Å; S1439-R1444 PolarHBondContact O-NH2 3.47Å; S1439-P1631 WeakPolarHBondContact OG-CB 3.36Å
1440	D	74.2	Confident	75.3	Confident	44 Å²	44	40 Å²	40	24%	0.235	21%	0.209	C	C	.	.			trans	-88.2	169.2	173.3	65.1	73.3	0	0	0	112.6	K1268 L1442 E1443 R1444	K1268-D1440 VanDerWaalsContact CD-OD2 3.3Å; K1268-D1440 WeakPolarHBondContact CD-OD2 3.4Å; K1268-D1440 WeakPolarHBondContact CE-OD2 2.72Å; K1268-D1440 IonicContact NZ-OD1 3.63Å; K1268-D1440 PolarHBondContact NZ-OD1 3.34Å; K1268-D1440 IonicContact NZ-OD2 2.74Å; K1268-D1440 PolarHBondContact NZ-OD2 3.3Å; D1440-L1442 VanDerWaalsContact C-N 3.26Å; D1440-L1442 PolarHBondContact O-N 2.7Å; D1440-L1442 WeakPolarHBondContact OD1-CB 3.24Å; D1440-L1442 PolarHBondContact OD1-N 2.95Å; D1440-E1443 PolarHBondContact N-OE2 3.1Å; D1440-E1443 WeakPolarHBondContact O-CA 3.43Å; D1440-E1443 PolarHBondContact O-N 2.83Å; D1440-E1443 PolarHBondContact OD1-N 2.96Å; D1440-R1444 WeakPolarHBondContact O-CG 3.45Å; D1440-R1444 PolarHBondContact O-N 3.43Å
1441	A	71.5	Confident	74.5	Confident	61 Å²	61	41 Å²	41	50%	0.504	21%	0.213	S	C	.	.	H	α-helix	trans	-56	-36.7	-173.6	0	0	0	0	0	113.7	E1443 R1444 S1445	A1441-E1443 VanDerWaalsContact C-N 3.32Å; A1441-E1443 PolarHBondContact O-N 2.92Å; A1441-R1444 PolarHBondContact O-N 3.39Å; A1441-S1445 WeakPolarHBondContact O-CB 3.28Å; A1441-S1445 PolarHBondContact O-N 2.7Å; A1441-S1445 PolarHBondContact O-OG 2.94Å
1442	L	70	Confident	73.5	Confident	33 Å²	33	42 Å²	42	17%	0.173	22%	0.215	C	C	.	.	H	α-helix	trans	-69.4	-31.8	177.6	-165.8	78.5	0	0	0	111.9	P1260 R1264 T1265 D1440 S1445	P1260-L1442 HydrophobicContact CB-CD1 3.66Å; P1260-L1442 HydrophobicContact CB-CG 4.39Å; R1264-L1442 HydrophobicContact CB-CD2 4.12Å; R1264-L1442 HydrophobicContact CG-CD2 4.3Å; T1265-L1442 HydrophobicContact CG2-CD2 3.59Å; T1265-L1442 HydrophobicContact CG2-CG 3.71Å; D1440-L1442 VanDerWaalsContact C-N 3.26Å; D1440-L1442 PolarHBondContact O-N 2.7Å; D1440-L1442 WeakPolarHBondContact OD1-CB 3.24Å; D1440-L1442 PolarHBondContact OD1-N 2.95Å; L1442-S1445 PolarHBondContact O-OG 3.42Å; L1442-S1445 VanDerWaalsContact O-OG 3.04Å
1443	E	74.3	Confident	72.8	Confident	15 Å²	15	42.4 Å²	42.4	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-81.1	-24.5	177.9	-61.2	-179.6	145.2	0	0	112.3	D1440 A1441 W1526 R1528	D1440-E1443 PolarHBondContact N-OE2 3.1Å; D1440-E1443 WeakPolarHBondContact O-CA 3.43Å; D1440-E1443 PolarHBondContact O-N 2.83Å; D1440-E1443 PolarHBondContact OD1-N 2.96Å; A1441-E1443 VanDerWaalsContact C-N 3.32Å; A1441-E1443 PolarHBondContact O-N 2.92Å; E1443-W1526 HydrophobicContact CB-CH2 4.1Å; E1443-W1526 WeakPolarHBondContact OE2-CH2 3.35Å; E1443-R1528 VanDerWaalsContact CD-NE 3.27Å; E1443-R1528 VanDerWaalsContact CD-NH2 3.33Å; E1443-R1528 IonicContact OE1-CZ 2.97Å; E1443-R1528 VanDerWaalsContact OE1-CZ 3.25Å; E1443-R1528 IonicContact OE1-NE 2.67Å; E1443-R1528 PolarHBondContact OE1-NE 2.79Å; E1443-R1528 IonicContact OE1-NH2 2.78Å; E1443-R1528 PolarHBondContact OE1-NH2 3.26Å; E1443-R1528 VanDerWaalsContact OE1-NH2 3.11Å; E1443-R1528 IonicContact OE2-CZ 3.71Å; E1443-R1528 IonicContact OE2-NE 3.93Å; E1443-R1528 PolarHBondContact OE2-NE 2.85Å; E1443-R1528 IonicContact OE2-NH2 2.64Å; E1443-R1528 PolarHBondContact OE2-NH2 3.38Å
1444	R	78.4	Confident	72.6	Confident	87 Å²	87	42.3 Å²	42.3	33%	0.328	22%	0.222	S	C	.	.	H	α-helix	trans	-77.5	-41.4	170.1	-60.4	173	-155.6	169.4	4.7	111.8	S1439 D1440 A1441 L1446 W1447 E1448 P1631 I1634	S1439-R1444 PolarHBondContact O-NE 2.88Å; S1439-R1444 PolarHBondContact O-NH2 3.47Å; D1440-R1444 WeakPolarHBondContact O-CG 3.45Å; D1440-R1444 PolarHBondContact O-N 3.43Å; A1441-R1444 PolarHBondContact O-N 3.39Å; R1444-L1446 PolarHBondContact O-N 2.78Å; R1444-L1446 VanDerWaalsContact O-N 3.12Å; R1444-W1447 CarbonylContact O-C 3.45Å; R1444-W1447 WeakPolarHBondContact O-CA 3.4Å; R1444-W1447 WeakPolarHBondContact O-CB 3.49Å; R1444-W1447 PolarHBondContact O-N 2.63Å; R1444-E1448 HydrophobicContact CB-CG 4.32Å; R1444-E1448 WeakPolarHBondContact CB-OE2 3.3Å; R1444-E1448 PolarHBondContact O-N 2.99Å; R1444-P1631 HydrophobicContact CG-CB 4.33Å; R1444-P1631 HydrophobicContact CG-CG 4.24Å; R1444-I1634 HydrophobicContact CB-CD1 4.39Å
1445	S	75.2	Confident	72.8	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.028	24%	0.235	C	C	.	.	H	α-helix	trans	-61.9	-22.5	-174.4	63.7	0	0	0	0	115.1	P1260 A1441 L1442 W1447 E1448	P1260-S1445 WeakPolarHBondContact CB-OG 3.46Å; A1441-S1445 WeakPolarHBondContact O-CB 3.28Å; A1441-S1445 PolarHBondContact O-N 2.7Å; A1441-S1445 PolarHBondContact O-OG 2.94Å; L1442-S1445 PolarHBondContact O-OG 3.42Å; L1442-S1445 VanDerWaalsContact O-OG 3.04Å; S1445-W1447 PolarHBondContact O-N 3.48Å; S1445-E1448 VanDerWaalsContact O-O 3.04Å
1446	L	76.3	Confident	73.2	Confident	12 Å²	12	46 Å²	46	6%	0.063	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-40.7	167.3	-169.3	75.8	0	0	0	111.8	L1262 R1444 P1529 F1978 F1979 K2233	L1262-L1446 HydrophobicContact CD2-CD1 3.69Å; R1444-L1446 PolarHBondContact O-N 2.78Å; R1444-L1446 VanDerWaalsContact O-N 3.12Å; L1446-P1529 HydrophobicContact CD2-CG 3.8Å; L1446-F1978 HydrophobicContact CD1-CB 3.98Å; L1446-F1978 HydrophobicContact CD1-CD1 4.39Å; L1446-F1978 HydrophobicContact CD1-CD2 4.24Å; L1446-F1978 HydrophobicContact CD1-CG 3.94Å; L1446-F1978 HydrophobicContact CD2-CD1 4.08Å; L1446-F1978 HydrophobicContact CD2-CE1 4.19Å; L1446-F1978 HydrophobicContact CD2-CG 4.4Å; L1446-F1979 HydrophobicContact CD2-CE2 4.36Å; L1446-F1979 HydrophobicContact CD2-CZ 4.2Å; L1446-F1979 HydrophobicContact CG-CE2 4.49Å; L1446-K2233 PolarHBondContact O-NZ 3.42Å
1447	W	79.5	Confident	73.9	Confident	3 Å²	3	45.4 Å²	45.4	1%	0.011	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-22	-175.9	-53.4	104.9	0	0	0	113.6	R1444 S1445 P1529 L1629 L1630 I1634 F1979 F2229 K2233	R1444-W1447 CarbonylContact O-C 3.45Å; R1444-W1447 WeakPolarHBondContact O-CA 3.4Å; R1444-W1447 WeakPolarHBondContact O-CB 3.49Å; R1444-W1447 PolarHBondContact O-N 2.63Å; S1445-W1447 PolarHBondContact O-N 3.48Å; W1447-P1529 HydrophobicContact CZ2-CB 4.18Å; W1447-P1529 HydrophobicContact CZ2-CG 3.94Å; W1447-L1629 HydrophobicContact CZ2-CB 4.39Å; W1447-L1630 HydrophobicContact CB-CG 4.49Å; W1447-L1630 HydrophobicContact CD2-CD1 4.19Å; W1447-L1630 HydrophobicContact CD2-CG 3.81Å; W1447-L1630 HydrophobicContact CE3-CD1 3.73Å; W1447-L1630 HydrophobicContact CE3-CD2 4.33Å; W1447-L1630 HydrophobicContact CE3-CG 3.73Å; W1447-L1630 HydrophobicContact CG-CG 4.17Å; W1447-L1630 HydrophobicContact CH2-CD1 4.07Å; W1447-L1630 HydrophobicContact CZ2-CD1 4.49Å; W1447-L1630 HydrophobicContact CZ3-CD1 3.68Å; W1447-L1630 HydrophobicContact CZ3-CG 4.21Å; W1447-I1634 HydrophobicContact CB-CD1 3.83Å; W1447-I1634 HydrophobicContact CB-CG2 4.27Å; W1447-F1979 HydrophobicContact CH2-CE1 4.2Å; W1447-F1979 AromaticContact CH2-CZ 3.83Å; W1447-F1979 HydrophobicContact CH2-CZ 3.83Å; W1447-F1979 HydrophobicContact CZ2-CZ 4.35Å; W1447-F1979 HydrophobicContact CZ3-CZ 4.17Å; W1447-F2229 HydrophobicContact CB-CZ 4.35Å; W1447-F2229 HydrophobicContact CE3-CD1 4.33Å; W1447-F2229 AromaticContact CE3-CE1 3.7Å; W1447-F2229 HydrophobicContact CE3-CE1 3.7Å; W1447-F2229 AromaticContact CE3-CZ 3.97Å; W1447-F2229 HydrophobicContact CE3-CZ 3.97Å; W1447-F2229 HydrophobicContact CZ3-CE1 4.37Å; W1447-F2229 WeakPolarHBondContact O-CZ 3.44Å; W1447-K2233 WeakPolarHBondContact O-CD 3.39Å
1448	E	75.5	Confident	74.7	Confident	19 Å²	19	42.4 Å²	42.4	9%	0.089	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	167.5	176.1	-61.3	-173.1	135.1	0	0	111.7	R1444 S1445 Y1450 I1634 R1637 K2233	R1444-E1448 HydrophobicContact CB-CG 4.32Å; R1444-E1448 WeakPolarHBondContact CB-OE2 3.3Å; R1444-E1448 PolarHBondContact O-N 2.99Å; S1445-E1448 VanDerWaalsContact O-O 3.04Å; E1448-Y1450 VanDerWaalsContact C-N 3.27Å; E1448-Y1450 HydrophobicContact CB-CD2 3.71Å; E1448-Y1450 HydrophobicContact CB-CE2 3.58Å; E1448-Y1450 HydrophobicContact CG-CE2 4.5Å; E1448-Y1450 PolarHBondContact O-N 2.93Å; E1448-I1634 HydrophobicContact CG-CD1 3.73Å; E1448-I1634 HydrophobicContact CG-CG1 3.96Å; E1448-I1634 HydrophobicContact CG-CG2 4.33Å; E1448-R1637 IonicContact OE1-CZ 3.8Å; E1448-R1637 IonicContact OE1-NE 3.34Å; E1448-R1637 PolarHBondContact OE1-NE 2.8Å; E1448-R1637 IonicContact OE1-NH2 3.21Å; E1448-R1637 PolarHBondContact OE1-NH2 2.65Å; E1448-K2233 WeakPolarHBondContact O-CD 3.43Å; E1448-K2233 WeakPolarHBondContact O-CE 3.28Å; E1448-K2233 PolarHBondContact O-NZ 2.77Å
1449	M	66.3	Low	75.5	Confident	13 Å²	13	41.5 Å²	41.5	6%	0.064	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	51	-166.7	-59.2	159.9	55.2	0	0	112.5	L1638 R1641 I1645 K2233 L2236 L2240	M1449-L1638 HydrophobicContact CG-CD2 4.01Å; M1449-L1638 HydrophobicContact SD-CD2 3.85Å; M1449-R1641 HydrophobicContact SD-CB 4.39Å; M1449-R1641 WeakPolarHBondContact SD-CD 3.43Å; M1449-I1645 HydrophobicContact CE-CD1 4.36Å; M1449-K2233 HydrophobicContact CG-CG 3.9Å; M1449-L2236 VanDerWaalsContact CE-C 3.44Å; M1449-L2236 HydrophobicContact CE-CB 3.44Å; M1449-L2236 VanDerWaalsContact CE-CB 3.44Å; M1449-L2236 WeakPolarHBondContact CE-O 3.5Å; M1449-L2236 HydrophobicContact SD-CB 4.22Å; M1449-L2240 HydrophobicContact CE-CD1 3.48Å; M1449-L2240 VanDerWaalsContact CE-CD1 3.48Å; M1449-L2240 HydrophobicContact CE-CG 4.04Å
1450	Y	60.4	Low	76.3	Confident	65 Å²	65	43.7 Å²	43.7	26%	0.255	25%	0.246	S	C	.	.	S	Bend	trans	-106.6	93.1	-178.7	-59.5	-63.7	0	0	0	110.3	L1256 E1448	L1256-Y1450 HydrophobicContact CD2-CD1 4Å; L1256-Y1450 HydrophobicContact CD2-CE1 3.91Å; E1448-Y1450 VanDerWaalsContact C-N 3.27Å; E1448-Y1450 HydrophobicContact CB-CD2 3.71Å; E1448-Y1450 HydrophobicContact CB-CE2 3.58Å; E1448-Y1450 HydrophobicContact CG-CE2 4.5Å; E1448-Y1450 PolarHBondContact O-N 2.93Å
1451	H	57	Low	77.3	Confident	72 Å²	72	42.1 Å²	42.1	33%	0.333	24%	0.24	S	C	.	.	S	Bend	trans	67	140.3	-179.6	-48.1	-74.8	0	0	0	115.6	P1259 V1453	P1259-H1451 HydrophobicContact CB-CB 4.36Å; H1451-V1453 PolarHBondContact O-N 2.78Å
1452	P	58.7	Low	78.4	Confident	65 Å²	65	39.2 Å²	39.2	42%	0.422	22%	0.216	S	C	.	.			trans	-68.6	130.7	175.2	28.4	-33.5	0	0	0	110.3
1453	V	63.3	Low	79.6	Confident	51 Å²	51	41.6 Å²	41.6	31%	0.309	23%	0.225	S	C	.	.			trans	-105	9.1	178	-142.7	0	0	0	0	111.9	L1262 H1451	L1262-V1453 HydrophobicContact CD1-CG1 4.28Å; H1451-V1453 PolarHBondContact O-N 2.78Å
1454	S	77.8	Confident	80.7	Confident	23 Å²	23	42.2 Å²	42.2	16%	0.161	23%	0.226	C	C	.	.	S	Bend	trans	-114.4	173.7	-179.8	63.4	0	0	0	0	110.6	A1973 R1974 D2234	S1454-A1973 VanDerWaalsContact CB-O 3.3Å; S1454-A1973 WeakPolarHBondContact CB-O 3.31Å; S1454-R1974 PolarHBondContact OG-NH1 3.02Å; S1454-D2234 WeakPolarHBondContact CB-OD2 3.28Å; S1454-D2234 PolarHBondContact OG-OD2 2.93Å
1455	P	83.5	Confident	81.5	Confident	48 Å²	48	38.1 Å²	38.1	31%	0.312	21%	0.211	S	C	.	.	S	Bend	trans	-56.6	170.5	174.3	-26.8	37.7	0	0	0	113.2	D1966 A1973 R1974	P1455-D1966 HydrophobicContact CB-CB 4.09Å; P1455-D1966 HydrophobicContact CG-CB 3.82Å; P1455-A1973 WeakPolarHBondContact CD-O 3.26Å; P1455-A1973 HydrophobicContact CG-CB 4.31Å; P1455-R1974 PolarHBondContact O-NH1 2.83Å
1456	F	87.6	Confident	82.5	Confident	155 Å²	155	38 Å²	38	68%	0.68	21%	0.21	S	C	*	.			trans	-51.9	147.5	-178.5	177.9	-107.1	0	0	0	113.1	R1974	F1456-R1974 PolarHBondContact O-NH2 2.82Å
1457	L	91.7	Very high	83.3	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.042	23%	0.227	C	C	.	.			trans	-138.6	113	174.9	179.4	65.1	0	0	0	108.1	A1461 A1462 A2235 V2238	L1457-A1461 HydrophobicContact CD1-CB 3.58Å; L1457-A1462 HydrophobicContact CD2-CB 3.94Å; L1457-A1462 HydrophobicContact CG-CB 4.09Å; L1457-A2235 HydrophobicContact CD2-CB 3.99Å; L1457-V2238 HydrophobicContact CB-CG2 4.22Å; L1457-V2238 HydrophobicContact CD2-CG2 4.3Å
1458	S	93.2	Very high	84	Confident	37 Å²	37	43.5 Å²	43.5	26%	0.259	24%	0.239	S	C	.	.			trans	-67.1	149.7	174.3	60.3	0	0	0	0	111.3	G1460 A1461 A1462 Q1968	S1458-G1460 PolarHBondContact O-N 3.42Å; S1458-G1460 VanDerWaalsContact O-N 3.16Å; S1458-A1461 PolarHBondContact O-N 3.12Å; S1458-A1461 VanDerWaalsContact O-N 3.08Å; S1458-A1461 VanDerWaalsContact OG-CB 3.31Å; S1458-A1461 WeakPolarHBondContact OG-CB 3.32Å; S1458-A1461 PolarHBondContact OG-N 3.18Å; S1458-A1462 PolarHBondContact O-N 2.82Å; S1458-Q1968 VanDerWaalsContact CB-OE1 3.32Å; S1458-Q1968 PolarHBondContact OG-OE1 3.25Å
1459	T	93.9	Very high	85	Confident	53 Å²	53	42.6 Å²	42.6	33%	0.325	24%	0.235	S	C	.	.	H	α-helix	trans	-57.2	-30.8	176.1	-42	0	0	0	0	112.1	K1463 L2239 S2242	T1459-K1463 WeakPolarHBondContact O-CG 3.42Å; T1459-K1463 PolarHBondContact O-N 3.48Å; T1459-K1463 VanDerWaalsContact O-N 3.15Å; T1459-L2239 HydrophobicContact CG2-CD2 3.63Å; T1459-S2242 WeakPolarHBondContact CG2-OG 3.49Å; T1459-S2242 PolarHBondContact OG1-OG 3.26Å
1460	G	94.1	Very high	86.4	Confident	49 Å²	49	42 Å²	42	51%	0.505	23%	0.232	S	C	.	.	H	α-helix	trans	-66	-50.9	172.4	0	0	0	0	0	112.9	S1458 A1462 K1463 Y1464	S1458-G1460 PolarHBondContact O-N 3.42Å; S1458-G1460 VanDerWaalsContact O-N 3.16Å; G1460-A1462 VanDerWaalsContact C-N 3.3Å; G1460-A1462 PolarHBondContact O-N 2.96Å; G1460-K1463 PolarHBondContact O-N 2.77Å; G1460-Y1464 PolarHBondContact O-N 3.07Å
1461	A	94.5	Very high	88	Confident	12 Å²	12	39.6 Å²	39.6	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-63	-35	175.8	0	0	0	0	0	112.3	L1457 S1458 Y1464 L1465 Q1968 L1969	L1457-A1461 HydrophobicContact CD1-CB 3.58Å; S1458-A1461 PolarHBondContact O-N 3.12Å; S1458-A1461 VanDerWaalsContact O-N 3.08Å; S1458-A1461 VanDerWaalsContact OG-CB 3.31Å; S1458-A1461 WeakPolarHBondContact OG-CB 3.32Å; S1458-A1461 PolarHBondContact OG-N 3.18Å; A1461-Y1464 PolarHBondContact O-N 3.26Å; A1461-L1465 VanDerWaalsContact O-CB 3.31Å; A1461-L1465 WeakPolarHBondContact O-CB 3.42Å; A1461-L1465 PolarHBondContact O-N 3.04Å; A1461-Q1968 HydrophobicContact CB-CB 4.28Å; A1461-L1969 HydrophobicContact CB-CD2 3.95Å
1462	A	95.3	Very high	89.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-43.1	174.5	0	0	0	0	0	112.5	L1457 S1458 G1460 L1465 L1466 A2235 V2238 L2239	L1457-A1462 HydrophobicContact CD2-CB 3.94Å; L1457-A1462 HydrophobicContact CG-CB 4.09Å; S1458-A1462 PolarHBondContact O-N 2.82Å; G1460-A1462 VanDerWaalsContact C-N 3.3Å; G1460-A1462 PolarHBondContact O-N 2.96Å; A1462-L1465 PolarHBondContact O-N 3.17Å; A1462-L1466 PolarHBondContact O-N 3.04Å; A1462-L1466 VanDerWaalsContact O-N 3.14Å; A1462-A2235 HydrophobicContact CB-CB 4.05Å; A1462-V2238 HydrophobicContact CB-CB 4.44Å; A1462-V2238 HydrophobicContact CB-CG1 4.27Å; A1462-L2239 HydrophobicContact CB-CD1 3.92Å; A1462-L2239 HydrophobicContact CB-CD2 4.35Å; A1462-L2239 HydrophobicContact CB-CG 3.86Å
1463	K	95.9	Very high	91.6	Very high	83 Å²	83	34.2 Å²	34.2	36%	0.361	20%	0.197	S	C	.	.	H	α-helix	trans	-62.9	-45.6	173.8	-69.8	177.3	-178.4	-175.8	0	111.6	T1459 G1460 L1465 L1466 E1467 Y1649 I1651 L2239	T1459-K1463 WeakPolarHBondContact O-CG 3.42Å; T1459-K1463 PolarHBondContact O-N 3.48Å; T1459-K1463 VanDerWaalsContact O-N 3.15Å; G1460-K1463 PolarHBondContact O-N 2.77Å; K1463-L1465 VanDerWaalsContact C-N 3.34Å; K1463-L1465 PolarHBondContact O-N 2.77Å; K1463-L1466 PolarHBondContact O-N 3.01Å; K1463-E1467 PolarHBondContact O-N 3.12Å; K1463-Y1649 VanDerWaalsContact CE-CD1 3.41Å; K1463-I1651 HydrophobicContact CB-CD1 4.1Å; K1463-I1651 HydrophobicContact CG-CD1 4.11Å; K1463-L2239 HydrophobicContact CG-CD2 3.87Å
1464	Y	95.8	Very high	93.2	Very high	28 Å²	28	31.8 Å²	31.8	11%	0.11	18%	0.183	C	C	.	.	H	α-helix	trans	-59.8	-42.8	178.1	-167.7	-84.8	0	0	0	112.4	G1460 A1461 L1466 E1467 C1468 Q1854 R1858 L1969 P2195 E2196	G1460-Y1464 PolarHBondContact O-N 3.07Å; A1461-Y1464 PolarHBondContact O-N 3.26Å; Y1464-L1466 PolarHBondContact O-N 3.39Å; Y1464-E1467 WeakPolarHBondContact O-CB 3.27Å; Y1464-E1467 PolarHBondContact O-N 3.1Å; Y1464-C1468 VanDerWaalsContact CE1-SG 3.56Å; Y1464-C1468 PolarHBondContact O-N 3.19Å; Y1464-Q1854 HydrophobicContact CE2-CB 4.5Å; Y1464-Q1854 HydrophobicContact CE2-CG 4.18Å; Y1464-Q1854 VanDerWaalsContact CZ-CD 3.42Å; Y1464-Q1854 VanDerWaalsContact CZ-NE2 3.28Å; Y1464-Q1854 WeakPolarHBondContact OH-CB 3.43Å; Y1464-Q1854 VanDerWaalsContact OH-CG 3.31Å; Y1464-Q1854 WeakPolarHBondContact OH-CG 3.17Å; Y1464-R1858 VanDerWaalsContact CZ-NH2 3.27Å; Y1464-R1858 PolarHBondContact OH-NE 3.06Å; Y1464-R1858 PolarHBondContact OH-NH2 2.95Å; Y1464-L1969 HydrophobicContact CD1-CD1 4.19Å; Y1464-L1969 HydrophobicContact CD1-CD2 4.12Å; Y1464-L1969 HydrophobicContact CE1-CD1 4.43Å; Y1464-P2195 HydrophobicContact CE1-CG 4.46Å; Y1464-E2196 WeakPolarHBondContact CE1-OE1 3.43Å; Y1464-E2196 PolarHBondContact OH-OE1 2.88Å; Y1464-E2196 VanDerWaalsContact OH-OE1 3.06Å
1465	L	95.4	Very high	94	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-64.6	-39.1	178.1	-160.1	163.3	0	0	0	111.2	A1461 A1462 K1463 A1469 L1971 I2232 A2235	A1461-L1465 VanDerWaalsContact O-CB 3.31Å; A1461-L1465 WeakPolarHBondContact O-CB 3.42Å; A1461-L1465 PolarHBondContact O-N 3.04Å; A1462-L1465 PolarHBondContact O-N 3.17Å; K1463-L1465 VanDerWaalsContact C-N 3.34Å; K1463-L1465 PolarHBondContact O-N 2.77Å; L1465-A1469 WeakPolarHBondContact O-CB 3.31Å; L1465-A1469 PolarHBondContact O-N 3.29Å; L1465-L1971 HydrophobicContact CD1-CD2 3.81Å; L1465-L1971 HydrophobicContact CD2-CD2 4.42Å; L1465-L1971 HydrophobicContact CG-CD2 4.18Å; L1465-I2232 HydrophobicContact CD2-CD1 3.47Å; L1465-I2232 VanDerWaalsContact CD2-CD1 3.47Å; L1465-I2232 HydrophobicContact CD2-CG1 3.95Å; L1465-A2235 HydrophobicContact CB-CB 4.5Å; L1465-A2235 HydrophobicContact CD2-CB 4.34Å
1466	L	95.9	Very high	94.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-39.4	172	-71.3	-175.4	0	0	0	113.3	A1462 K1463 Y1464 G1470 L1642 I1645 I1651 I2232 L2236 L2239	A1462-L1466 PolarHBondContact O-N 3.04Å; A1462-L1466 VanDerWaalsContact O-N 3.14Å; K1463-L1466 PolarHBondContact O-N 3.01Å; Y1464-L1466 PolarHBondContact O-N 3.39Å; L1466-G1470 VanDerWaalsContact O-CA 3.23Å; L1466-G1470 WeakPolarHBondContact O-CA 3.48Å; L1466-G1470 PolarHBondContact O-N 2.96Å; L1466-L1642 HydrophobicContact CD2-CD1 3.86Å; L1466-I1645 HydrophobicContact CD1-CG2 4.21Å; L1466-I1651 HydrophobicContact CB-CD1 3.97Å; L1466-I1651 HydrophobicContact CB-CG2 4.26Å; L1466-I1651 HydrophobicContact CD1-CD1 3.91Å; L1466-I2232 HydrophobicContact CD2-CD1 3.83Å; L1466-I2232 HydrophobicContact CD2-CG2 3.92Å; L1466-L2236 HydrophobicContact CD1-CD2 3.9Å; L1466-L2236 HydrophobicContact CD2-CD2 3.79Å; L1466-L2236 HydrophobicContact CD2-CG 4.12Å; L1466-L2236 HydrophobicContact CG-CD2 4.49Å; L1466-L2239 HydrophobicContact CD1-CD1 3.37Å; L1466-L2239 HydrophobicContact CG-CD1 4.2Å
1467	E	94.9	Very high	94.7	Very high	92 Å²	92	29.2 Å²	29.2	43%	0.43	16%	0.159	S	C	.	.	H	α-helix	trans	-61.2	-50.1	177.1	-168.8	-158.9	156.6	0	0	111.1	K1463 Y1464 I1651 R1858	K1463-E1467 PolarHBondContact O-N 3.12Å; Y1464-E1467 WeakPolarHBondContact O-CB 3.27Å; Y1464-E1467 PolarHBondContact O-N 3.1Å; E1467-I1651 HydrophobicContact CB-CG2 4.11Å; E1467-R1858 IonicContact OE1-CZ 2.68Å; E1467-R1858 IonicContact OE1-NH1 2.99Å; E1467-R1858 PolarHBondContact OE1-NH1 3.19Å; E1467-R1858 IonicContact OE1-NH2 2.79Å; E1467-R1858 PolarHBondContact OE1-NH2 3.38Å; E1467-R1858 VanDerWaalsContact OE1-NH2 3.1Å; E1467-R1858 IonicContact OE2-CZ 2.74Å; E1467-R1858 IonicContact OE2-NH1 2.67Å; E1467-R1858 IonicContact OE2-NH2 3.74Å; E1467-R1858 PolarHBondContact OE2-NH2 3.41Å
1468	C	93.9	Very high	94.8	Very high	39 Å²	39	31.8 Å²	31.8	26%	0.264	17%	0.171	S	C	.	.	H	α-helix	trans	-74.7	-41.6	-177.8	-69.5	0	0	0	0	113.6	Y1464 R1858 P2195	Y1464-C1468 VanDerWaalsContact CE1-SG 3.56Å; Y1464-C1468 PolarHBondContact O-N 3.19Å; C1468-R1858 PolarHBondContact SG-NH2 3.43Å; C1468-P2195 HydrophobicContact CB-CB 3.93Å; C1468-P2195 HydrophobicContact CB-CG 4.35Å
1469	A	95.3	Very high	94.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-116.1	-7.8	-167.1	0	0	0	0	0	115.1	L1465 G1471 L1472 F1473 P2195 L2198 L2228 I2232	L1465-A1469 WeakPolarHBondContact O-CB 3.31Å; L1465-A1469 PolarHBondContact O-N 3.29Å; A1469-G1471 PolarHBondContact O-N 3Å; A1469-L1472 WeakPolarHBondContact O-CB 3.33Å; A1469-L1472 PolarHBondContact O-N 2.78Å; A1469-F1473 PolarHBondContact O-N 3.29Å; A1469-P2195 HydrophobicContact CB-CB 4.22Å; A1469-L2198 HydrophobicContact CB-CD1 3.66Å; A1469-L2228 HydrophobicContact CB-CD1 3.83Å; A1469-I2232 HydrophobicContact CB-CD1 4.1Å
1470	G	95.8	Very high	94.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-42.5	-174.7	0	0	0	0	0	114.5	L1466 L1472 F1473 C1474	L1466-G1470 VanDerWaalsContact O-CA 3.23Å; L1466-G1470 WeakPolarHBondContact O-CA 3.48Å; L1466-G1470 PolarHBondContact O-N 2.96Å; G1470-L1472 VanDerWaalsContact C-N 3.35Å; G1470-L1472 PolarHBondContact O-N 2.83Å; G1470-F1473 PolarHBondContact O-N 3.46Å; G1470-C1474 WeakPolarHBondContact O-CB 3.26Å; G1470-C1474 PolarHBondContact O-N 2.78Å
1471	G	95	Very high	94.4	Very high	16 Å²	16	32.3 Å²	32.3	17%	0.165	15%	0.154	C	C	.	.	H	α-helix	trans	-66.5	-34.5	175.8	0	0	0	0	0	113.9	A1469 R1475 L1653	A1469-G1471 PolarHBondContact O-N 3Å; G1471-R1475 WeakPolarHBondContact O-CB 3.39Å; G1471-R1475 PolarHBondContact O-N 3.35Å; G1471-L1653 WeakPolarHBondContact CA-O 3.38Å; G1471-L1653 PolarHBondContact N-O 3.2Å; G1471-L1653 VanDerWaalsContact N-O 3.17Å
1472	L	94.5	Very high	94	Very high	23 Å²	23	34.9 Å²	34.9	12%	0.12	17%	0.169	C	C	.	.	H	α-helix	trans	-68	-40.3	174.8	-179.4	61.6	0	0	0	111.1	A1469 G1470 R1475 L1476 L2198 F2202 L2228	A1469-L1472 WeakPolarHBondContact O-CB 3.33Å; A1469-L1472 PolarHBondContact O-N 2.78Å; G1470-L1472 VanDerWaalsContact C-N 3.35Å; G1470-L1472 PolarHBondContact O-N 2.83Å; L1472-R1475 VanDerWaalsContact CD1-NH2 3.34Å; L1472-R1475 PolarHBondContact O-N 3.3Å; L1472-L1476 PolarHBondContact O-N 3.1Å; L1472-L2198 HydrophobicContact CD2-CB 3.51Å; L1472-L2198 HydrophobicContact CD2-CD1 4.07Å; L1472-L2198 HydrophobicContact CD2-CG 4.43Å; L1472-F2202 HydrophobicContact CD1-CD2 4.18Å; L1472-F2202 HydrophobicContact CD1-CE2 4.16Å; L1472-F2202 HydrophobicContact CD2-CD2 3.9Å; L1472-F2202 HydrophobicContact CD2-CE2 3.8Å; L1472-F2202 HydrophobicContact CG-CD2 4.42Å; L1472-F2202 HydrophobicContact CG-CE2 4.1Å; L1472-L2228 HydrophobicContact CB-CD2 4.48Å; L1472-L2228 HydrophobicContact CD2-CD2 4.12Å; L1472-L2228 HydrophobicContact CG-CD2 3.81Å
1473	F	96	Very high	93.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.9	-44.8	173.3	-178.4	-117.1	0	0	0	112.8	A1469 G1470 R1475 L1476 L1477 L1638 L1642 L2228 F2229 I2232	A1469-F1473 PolarHBondContact O-N 3.29Å; G1470-F1473 PolarHBondContact O-N 3.46Å; F1473-R1475 VanDerWaalsContact C-N 3.33Å; F1473-R1475 PolarHBondContact O-N 2.77Å; F1473-L1476 WeakPolarHBondContact O-CB 3.46Å; F1473-L1476 PolarHBondContact O-N 3.41Å; F1473-L1476 VanDerWaalsContact O-N 3.14Å; F1473-L1477 HydrophobicContact CD1-CD1 4.15Å; F1473-L1477 HydrophobicContact CD1-CG 4.47Å; F1473-L1477 HydrophobicContact CD2-CG 4.36Å; F1473-L1477 HydrophobicContact CE1-CD1 3.55Å; F1473-L1477 HydrophobicContact CE1-CG 4.16Å; F1473-L1477 HydrophobicContact CE2-CD1 4.2Å; F1473-L1477 HydrophobicContact CE2-CD2 3.95Å; F1473-L1477 HydrophobicContact CE2-CG 3.99Å; F1473-L1477 HydrophobicContact CZ-CD1 3.6Å; F1473-L1477 HydrophobicContact CZ-CD2 4.03Å; F1473-L1477 HydrophobicContact CZ-CG 3.92Å; F1473-L1477 PolarHBondContact O-N 3.36Å; F1473-L1638 HydrophobicContact CZ-CD1 4.49Å; F1473-L1642 HydrophobicContact CD1-CD1 4.35Å; F1473-L1642 HydrophobicContact CD1-CD2 3.92Å; F1473-L2228 HydrophobicContact CB-CD1 4.05Å; F1473-L2228 HydrophobicContact CB-CD2 4.41Å; F1473-L2228 HydrophobicContact CB-CG 4.22Å; F1473-L2228 HydrophobicContact CD2-CG 4.15Å; F1473-F2229 HydrophobicContact CE2-CB 4.15Å; F1473-F2229 AromaticContact CE2-CD2 3.65Å; F1473-F2229 HydrophobicContact CE2-CD2 3.65Å; F1473-F2229 HydrophobicContact CE2-CE2 4.43Å; F1473-F2229 HydrophobicContact CE2-CG 4.22Å; F1473-F2229 HydrophobicContact CZ-CD2 4Å; F1473-F2229 HydrophobicContact CZ-CE2 4.36Å; F1473-I2232 HydrophobicContact CB-CD1 4.38Å; F1473-I2232 HydrophobicContact CB-CG1 3.91Å; F1473-I2232 HydrophobicContact CB-CG2 4.5Å; F1473-I2232 HydrophobicContact CD1-CB 3.94Å; F1473-I2232 HydrophobicContact CD1-CG1 4.25Å; F1473-I2232 HydrophobicContact CD1-CG2 3.33Å; F1473-I2232 HydrophobicContact CD2-CB 4.32Å; F1473-I2232 HydrophobicContact CD2-CG1 4.37Å; F1473-I2232 HydrophobicContact CE1-CB 4.12Å; F1473-I2232 HydrophobicContact CE1-CG2 3.48Å; F1473-I2232 VanDerWaalsContact CE1-CG2 3.48Å; F1473-I2232 HydrophobicContact CG-CB 4.01Å; F1473-I2232 HydrophobicContact CG-CG1 3.93Å; F1473-I2232 HydrophobicContact CG-CG2 3.91Å; F1473-I2232 HydrophobicContact CZ-CB 4.39Å; F1473-I2232 HydrophobicContact CZ-CG2 4.19Å
1474	C	96.5	Very high	93	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-52.3	-51.9	172.8	-177.3	0	0	0	0	110.8	G1470 L1476 L1477 H1478 L1642 H1643 C1655 C1657	G1470-C1474 WeakPolarHBondContact O-CB 3.26Å; G1470-C1474 PolarHBondContact O-N 2.78Å; C1474-L1476 PolarHBondContact O-N 2.82Å; C1474-L1477 PolarHBondContact O-N 3.48Å; C1474-H1478 PolarHBondContact O-CD2 2.84Å; C1474-H1478 PolarHBondContact O-N 2.88Å; C1474-H1478 VanDerWaalsContact SG-CD2 3.57Å; C1474-L1642 HydrophobicContact CB-CD2 3.73Å; C1474-H1643 PolarHBondContact SG-CE1 2.99Å; C1474-H1643 PolarHBondContact SG-NE2 3.4Å; C1474-C1655 HydrophobicContact CB-CB 4.19Å; C1474-C1657 VanDerWaalsContact SG-SG 3.65Å
1475	R	94.9	Very high	92.3	Very high	164 Å²	164	36.4 Å²	36.4	62%	0.619	18%	0.184	S	C	*	.	H	α-helix	trans	-58.3	-42.1	176	174.5	162.9	52.6	129.7	-10.5	113.2	G1471 L1472 F1473 Q1479	G1471-R1475 WeakPolarHBondContact O-CB 3.39Å; G1471-R1475 PolarHBondContact O-N 3.35Å; L1472-R1475 VanDerWaalsContact CD1-NH2 3.34Å; L1472-R1475 PolarHBondContact O-N 3.3Å; F1473-R1475 VanDerWaalsContact C-N 3.33Å; F1473-R1475 PolarHBondContact O-N 2.77Å; R1475-Q1479 WeakPolarHBondContact O-CB 3.39Å; R1475-Q1479 PolarHBondContact O-N 2.91Å
1476	L	93.8	Very high	90.9	Very high	7 Å²	7	40.2 Å²	40.2	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-47.4	175.7	176.8	62.1	0	0	0	111.6	L1472 F1473 C1474 H1478 Q1479 E1480 F1545 K2225 L2228	L1472-L1476 PolarHBondContact O-N 3.1Å; F1473-L1476 WeakPolarHBondContact O-CB 3.46Å; F1473-L1476 PolarHBondContact O-N 3.41Å; F1473-L1476 VanDerWaalsContact O-N 3.14Å; C1474-L1476 PolarHBondContact O-N 2.82Å; L1476-H1478 PolarHBondContact O-N 3.38Å; L1476-Q1479 PolarHBondContact O-N 3.04Å; L1476-E1480 HydrophobicContact CD1-CG 4.46Å; L1476-E1480 WeakPolarHBondContact O-CG 3.27Å; L1476-E1480 PolarHBondContact O-N 2.91Å; L1476-E1480 VanDerWaalsContact O-N 3.1Å; L1476-F1545 HydrophobicContact CD1-CD1 4.22Å; L1476-F1545 HydrophobicContact CD2-CD1 4.41Å; L1476-F1545 HydrophobicContact CD2-CE1 4.22Å; L1476-F1545 HydrophobicContact CD2-CZ 4.47Å; L1476-F1545 HydrophobicContact CG-CD1 4.45Å; L1476-F1545 HydrophobicContact CG-CE1 4.26Å; L1476-K2225 HydrophobicContact CD1-CD 4.01Å; L1476-K2225 HydrophobicContact CD1-CG 4.19Å; L1476-K2225 HydrophobicContact CD2-CB 4.24Å; L1476-K2225 HydrophobicContact CD2-CG 4.31Å; L1476-L2228 HydrophobicContact CD2-CD2 4.15Å
1477	L	93.4	Very high	89.1	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-41.2	178.9	-67.8	-169.5	0	0	0	112.3	F1473 C1474 Q1479 E1480 L1481 I1635 L1638 I1639 F2229	F1473-L1477 HydrophobicContact CD1-CD1 4.15Å; F1473-L1477 HydrophobicContact CD1-CG 4.47Å; F1473-L1477 HydrophobicContact CD2-CG 4.36Å; F1473-L1477 HydrophobicContact CE1-CD1 3.55Å; F1473-L1477 HydrophobicContact CE1-CG 4.16Å; F1473-L1477 HydrophobicContact CE2-CD1 4.2Å; F1473-L1477 HydrophobicContact CE2-CD2 3.95Å; F1473-L1477 HydrophobicContact CE2-CG 3.99Å; F1473-L1477 HydrophobicContact CZ-CD1 3.6Å; F1473-L1477 HydrophobicContact CZ-CD2 4.03Å; F1473-L1477 HydrophobicContact CZ-CG 3.92Å; F1473-L1477 PolarHBondContact O-N 3.36Å; C1474-L1477 PolarHBondContact O-N 3.48Å; L1477-Q1479 PolarHBondContact O-N 2.9Å; L1477-E1480 PolarHBondContact O-N 3.12Å; L1477-L1481 WeakPolarHBondContact O-CB 3.39Å; L1477-L1481 PolarHBondContact O-N 2.78Å; L1477-I1635 HydrophobicContact CB-CG2 4.04Å; L1477-I1635 HydrophobicContact CD2-CG2 4.33Å; L1477-L1638 HydrophobicContact CD1-CB 3.7Å; L1477-I1639 HydrophobicContact CB-CD1 3.87Å; L1477-I1639 HydrophobicContact CB-CG1 3.65Å; L1477-I1639 HydrophobicContact CD1-CG1 3.74Å; L1477-I1639 HydrophobicContact CG-CG1 4.38Å; L1477-F2229 HydrophobicContact CD2-CD2 4.49Å
1478	H	93.2	Very high	86.6	Confident	62 Å²	62	44.1 Å²	44.1	29%	0.287	22%	0.224	S	C	.	.	H	α-helix	trans	-65.5	-35.1	174.6	-79.4	-76.5	0	0	0	112.8	C1474 L1476 T1482 C1657	C1474-H1478 PolarHBondContact O-CD2 2.84Å; C1474-H1478 PolarHBondContact O-N 2.88Å; C1474-H1478 VanDerWaalsContact SG-CD2 3.57Å; L1476-H1478 PolarHBondContact O-N 3.38Å; H1478-T1482 VanDerWaalsContact O-CB 3.24Å; H1478-T1482 WeakPolarHBondContact O-CB 3.34Å; H1478-T1482 PolarHBondContact O-N 2.86Å; H1478-T1482 PolarHBondContact O-OG1 2.92Å; H1478-C1657 PolarHBondContact NE2-SG 2.8Å; H1478-C1657 VanDerWaalsContact NE2-SG 3.36Å
1479	Q	90.1	Very high	83.6	Confident	90 Å²	90	45.1 Å²	45.1	42%	0.421	24%	0.235	S	C	.	.	H	α-helix	trans	-64.2	-43.3	174.6	-176.9	178.7	3.9	0	0	111.9	R1475 L1476 L1477 S1483	R1475-Q1479 WeakPolarHBondContact O-CB 3.39Å; R1475-Q1479 PolarHBondContact O-N 2.91Å; L1476-Q1479 PolarHBondContact O-N 3.04Å; L1477-Q1479 PolarHBondContact O-N 2.9Å; Q1479-S1483 WeakPolarHBondContact O-CB 3.43Å; Q1479-S1483 PolarHBondContact O-N 2.96Å; Q1479-S1483 PolarHBondContact O-OG 3.41Å
1480	E	91.6	Very high	80.9	Confident	10 Å²	10	53.1 Å²	53.1	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-43.2	177.5	-67.1	-71	159.9	0	0	111.7	L1476 L1477 T1482 S1483 L1484 F1545 N1546 T1547 I1635	L1476-E1480 HydrophobicContact CD1-CG 4.46Å; L1476-E1480 WeakPolarHBondContact O-CG 3.27Å; L1476-E1480 PolarHBondContact O-N 2.91Å; L1476-E1480 VanDerWaalsContact O-N 3.1Å; L1477-E1480 PolarHBondContact O-N 3.12Å; E1480-T1482 PolarHBondContact O-N 3.43Å; E1480-S1483 WeakPolarHBondContact O-CB 3.46Å; E1480-S1483 PolarHBondContact O-N 3Å; E1480-S1483 VanDerWaalsContact O-N 3.17Å; E1480-L1484 PolarHBondContact O-N 3.35Å; E1480-F1545 HydrophobicContact CG-CD1 3.91Å; E1480-F1545 HydrophobicContact CG-CE1 3.95Å; E1480-N1546 HydrophobicContact CG-CB 4.48Å; E1480-N1546 WeakPolarHBondContact OE2-CB 3.15Å; E1480-N1546 PolarHBondContact OE2-ND2 2.77Å; E1480-T1547 VanDerWaalsContact OE2-CB 3.23Å; E1480-T1547 WeakPolarHBondContact OE2-CB 3.37Å; E1480-T1547 VanDerWaalsContact OE2-CG2 3.28Å; E1480-T1547 WeakPolarHBondContact OE2-CG2 3.48Å; E1480-T1547 PolarHBondContact OE2-N 2.87Å; E1480-T1547 PolarHBondContact OE2-OG1 3.18Å; E1480-I1635 HydrophobicContact CB-CD1 4.14Å
1481	L	90	Very high	77.9	Confident	50 Å²	50	56.7 Å²	56.7	26%	0.262	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-43.7	174.4	-176.8	60.2	0	0	0	112.1	L1477 S1483 L1484 N1485 I1635 I1639	L1477-L1481 WeakPolarHBondContact O-CB 3.39Å; L1477-L1481 PolarHBondContact O-N 2.78Å; L1481-S1483 VanDerWaalsContact C-N 3.28Å; L1481-S1483 PolarHBondContact O-N 2.87Å; L1481-L1484 PolarHBondContact O-N 2.8Å; L1481-N1485 WeakPolarHBondContact O-CB 3.4Å; L1481-N1485 PolarHBondContact O-N 3.28Å; L1481-I1635 HydrophobicContact CB-CG2 4.07Å; L1481-I1639 HydrophobicContact CD2-CD1 4.11Å
1482	T	87.4	Confident	75.1	Confident	67 Å²	67	59.5 Å²	59.5	41%	0.411	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-37.7	175.3	-60.1	0	0	0	0	111.5	H1478 E1480 N1485 N1486	H1478-T1482 VanDerWaalsContact O-CB 3.24Å; H1478-T1482 WeakPolarHBondContact O-CB 3.34Å; H1478-T1482 PolarHBondContact O-N 2.86Å; H1478-T1482 PolarHBondContact O-OG1 2.92Å; E1480-T1482 PolarHBondContact O-N 3.43Å; T1482-N1485 PolarHBondContact O-N 3.27Å; T1482-N1486 VanDerWaalsContact CG2-ND2 3.31Å; T1482-N1486 WeakPolarHBondContact CG2-ND2 3.5Å; T1482-N1486 VanDerWaalsContact O-CB 3.31Å; T1482-N1486 WeakPolarHBondContact O-CB 3.34Å; T1482-N1486 VanDerWaalsContact O-CG 3.29Å; T1482-N1486 PolarHBondContact O-N 3.15Å
1483	S	85.1	Confident	72.1	Confident	23 Å²	23	64.3 Å²	64.3	16%	0.161	32%	0.322	C	S	.	.	H	α-helix	trans	-69.2	-31.7	178	-60.1	0	0	0	0	112.8	Q1479 E1480 L1481 N1487	Q1479-S1483 WeakPolarHBondContact O-CB 3.43Å; Q1479-S1483 PolarHBondContact O-N 2.96Å; Q1479-S1483 PolarHBondContact O-OG 3.41Å; E1480-S1483 WeakPolarHBondContact O-CB 3.46Å; E1480-S1483 PolarHBondContact O-N 3Å; E1480-S1483 VanDerWaalsContact O-N 3.17Å; L1481-S1483 VanDerWaalsContact C-N 3.28Å; L1481-S1483 PolarHBondContact O-N 2.87Å; S1483-N1487 PolarHBondContact O-ND2 2.87Å
1484	L	84.5	Confident	69.2	Low	30 Å²	30	68.8 Å²	68.8	16%	0.157	35%	0.346	C	S	.	.	H	α-helix	trans	-70.2	-53.7	169.5	-66.4	169.6	0	0	0	111.1	E1480 L1481 V1524 T1547 I1635	E1480-L1484 PolarHBondContact O-N 3.35Å; L1481-L1484 PolarHBondContact O-N 2.8Å; L1484-V1524 HydrophobicContact CD2-CG1 3.9Å; L1484-V1524 HydrophobicContact CD2-CG2 4.07Å; L1484-T1547 HydrophobicContact CD2-CG2 3.67Å; L1484-T1547 HydrophobicContact CG-CG2 3.74Å; L1484-I1635 HydrophobicContact CD1-CD1 3.99Å
1485	N	81.5	Confident	66.4	Low	90 Å²	90	75.7 Å²	75.7	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-67.8	-41.1	-170.4	-69.5	-3.7	0	0	0	113.8	L1481 T1482 N1487 H1488	L1481-N1485 WeakPolarHBondContact O-CB 3.4Å; L1481-N1485 PolarHBondContact O-N 3.28Å; T1482-N1485 PolarHBondContact O-N 3.27Å; N1485-N1487 PolarHBondContact O-N 2.79Å; N1485-H1488 PolarHBondContact O-N 2.92Å
1486	N	66.6	Low	63.5	Low	80 Å²	80	74 Å²	74	43%	0.428	38%	0.375	S	S	.	.	H	α-helix	trans	-61.5	-20.3	-173.9	-79.5	-10.8	0	0	0	114.1	T1482 H1488 A1489 Y1490	T1482-N1486 VanDerWaalsContact CG2-ND2 3.31Å; T1482-N1486 WeakPolarHBondContact CG2-ND2 3.5Å; T1482-N1486 VanDerWaalsContact O-CB 3.31Å; T1482-N1486 WeakPolarHBondContact O-CB 3.34Å; T1482-N1486 VanDerWaalsContact O-CG 3.29Å; T1482-N1486 PolarHBondContact O-N 3.15Å; N1486-H1488 VanDerWaalsContact C-N 3.27Å; N1486-H1488 PolarHBondContact O-N 3.35Å; N1486-A1489 PolarHBondContact O-N 3.47Å; N1486-Y1490 PolarHBondContact O-N 2.92Å
1487	N	57.9	Low	60.9	Low	47 Å²	47	79.1 Å²	79.1	25%	0.251	40%	0.402	S	S	.	.	H	α-helix	trans	-74.6	-15.2	178	-71.9	-78.7	0	0	0	113.5	S1483 N1485 W1549 L1626	S1483-N1487 PolarHBondContact O-ND2 2.87Å; N1485-N1487 PolarHBondContact O-N 2.79Å; N1487-W1549 VanDerWaalsContact OD1-CH2 3.3Å; N1487-W1549 WeakPolarHBondContact OD1-CH2 3.25Å; N1487-W1549 VanDerWaalsContact OD1-CZ2 3.28Å; N1487-W1549 WeakPolarHBondContact OD1-CZ2 3.39Å; N1487-L1626 HydrophobicContact CB-CD2 3.84Å
1488	H	42.6	Very low	58.1	Low	128 Å²	128	85.6 Å²	85.6	59%	0.593	44%	0.437	S	S	*	.	H	α-helix	trans	-75.4	-38.1	165	-75.8	-97.3	0	0	0	112	N1485 N1486	N1485-H1488 PolarHBondContact O-N 2.92Å; N1486-H1488 VanDerWaalsContact C-N 3.27Å; N1486-H1488 PolarHBondContact O-N 3.35Å
1489	A	30.9	Very low	55.2	Low	60 Å²	60	87.4 Å²	87.4	50%	0.496	46%	0.456	S	S	.	.	H	α-helix	trans	-71.6	-35	-176.6	0	0	0	0	0	113.7	N1486 Q1491 S1492	N1486-A1489 PolarHBondContact O-N 3.47Å; A1489-Q1491 PolarHBondContact O-N 3.25Å; A1489-S1492 PolarHBondContact O-N 3.45Å
1490	Y	36.9	Very low	52.2	Low	168 Å²	168	90.1 Å²	90.1	66%	0.659	47%	0.472	S	S	*	.	H	α-helix	trans	-63.7	-12	-174	-104.4	-83.7	0	0	0	115.7	N1486 N1494	N1486-Y1490 PolarHBondContact O-N 2.92Å; Y1490-N1494 PolarHBondContact O-ND2 2.94Å
1491	Q	34.1	Very low	49.4	Very low	75 Å²	75	95.8 Å²	95.8	35%	0.35	51%	0.508	S	S	.	.	H	α-helix	trans	-86	-38.3	173.4	-77.6	-180	-4.6	0	0	113.3	A1489 Q1493 N1494 E1495 N1522	A1489-Q1491 PolarHBondContact O-N 3.25Å; Q1491-Q1493 VanDerWaalsContact C-N 3.28Å; Q1491-Q1493 PolarHBondContact O-N 2.84Å; Q1491-N1494 WeakPolarHBondContact O-CA 3.43Å; Q1491-N1494 PolarHBondContact O-N 2.99Å; Q1491-E1495 PolarHBondContact O-N 3.02Å; Q1491-N1522 PolarHBondContact NE2-OD1 3.3Å; Q1491-N1522 PolarHBondContact OE1-ND2 3.41Å; Q1491-N1522 PolarHBondContact OE1-OD1 2.7Å
1492	S	34.8	Very low	46.6	Very low	75 Å²	75	96.7 Å²	96.7	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-57.5	-38.6	-175.3	-177.9	0	0	0	0	113	A1489 E1495 K1496	A1489-S1492 PolarHBondContact O-N 3.45Å; S1492-E1495 PolarHBondContact O-N 3.02Å; S1492-K1496 PolarHBondContact O-N 3.23Å
1493	Q	32.5	Very low	43.8	Very low	123 Å²	123	103.3 Å²	103.3	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-71.8	-33.9	174.6	-67.7	-169.1	-8.5	0	0	113.4	Q1491 E1495 K1496 I1497	Q1491-Q1493 VanDerWaalsContact C-N 3.28Å; Q1491-Q1493 PolarHBondContact O-N 2.84Å; Q1493-E1495 VanDerWaalsContact C-N 3.33Å; Q1493-K1496 PolarHBondContact O-N 3.26Å; Q1493-I1497 WeakPolarHBondContact O-CB 3.34Å; Q1493-I1497 VanDerWaalsContact O-CG1 3.27Å; Q1493-I1497 WeakPolarHBondContact O-CG1 3.43Å; Q1493-I1497 PolarHBondContact O-N 3.19Å
1494	N	35.4	Very low	41.3	Very low	94 Å²	94	107.2 Å²	107.2	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-70.7	-28.8	175.9	-82.8	-68.5	0	0	0	112.3	Y1490 Q1491 N1498	Y1490-N1494 PolarHBondContact O-ND2 2.94Å; Q1491-N1494 WeakPolarHBondContact O-CA 3.43Å; Q1491-N1494 PolarHBondContact O-N 2.99Å; N1494-N1498 PolarHBondContact O-N 3.42Å; N1494-N1498 PolarHBondContact O-ND2 2.84Å
1495	E	37.2	Very low	38.6	Very low	147 Å²	147	113.7 Å²	113.7	69%	0.687	59%	0.594	S	S	*	*	H	α-helix	trans	-76.1	-43.2	171.8	-64	-165.8	145.2	0	0	112	Q1491 S1492 Q1493 I1497 N1498 S1499	Q1491-E1495 PolarHBondContact O-N 3.02Å; S1492-E1495 PolarHBondContact O-N 3.02Å; Q1493-E1495 VanDerWaalsContact C-N 3.33Å; E1495-I1497 PolarHBondContact O-N 3.25Å; E1495-N1498 PolarHBondContact O-N 3.38Å; E1495-S1499 PolarHBondContact O-N 3.17Å
1496	K	34.5	Very low	36.2	Very low	127 Å²	127	112.6 Å²	112.6	55%	0.552	59%	0.587	S	S	*	*	H	α-helix	trans	-58.5	-43.4	173	-88.9	-171.9	173.8	-177.2	0	112.2	S1492 Q1493 N1498 S1499 E1689	S1492-K1496 PolarHBondContact O-N 3.23Å; Q1493-K1496 PolarHBondContact O-N 3.26Å; K1496-N1498 PolarHBondContact O-N 3.24Å; K1496-S1499 WeakPolarHBondContact O-CB 3.29Å; K1496-S1499 PolarHBondContact O-N 3.37Å; K1496-S1499 VanDerWaalsContact O-N 3.14Å; K1496-E1689 IonicContact NZ-OE2 2.93Å; K1496-E1689 PolarHBondContact NZ-OE2 3.05Å; K1496-E1689 VanDerWaalsContact NZ-OE2 3.12Å
1497	I	39.2	Very low	34.2	Very low	115 Å²	115	112.6 Å²	112.6	59%	0.59	59%	0.594	S	S	*	*	H	α-helix	trans	-67.2	-34.7	-178.5	-70.6	168.6	0	0	0	112.4	Q1493 E1495 S1499	Q1493-I1497 WeakPolarHBondContact O-CB 3.34Å; Q1493-I1497 VanDerWaalsContact O-CG1 3.27Å; Q1493-I1497 WeakPolarHBondContact O-CG1 3.43Å; Q1493-I1497 PolarHBondContact O-N 3.19Å; E1495-I1497 PolarHBondContact O-N 3.25Å; I1497-S1499 PolarHBondContact O-N 3.17Å
1498	N	33.5	Very low	32.7	Very low	137 Å²	137	112.2 Å²	112.2	73%	0.733	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-3.6	175.1	-78.2	-73.6	0	0	0	114.1	N1494 E1495 K1496	N1494-N1498 PolarHBondContact O-N 3.42Å; N1494-N1498 PolarHBondContact O-ND2 2.84Å; E1495-N1498 PolarHBondContact O-N 3.38Å; K1496-N1498 PolarHBondContact O-N 3.24Å
1499	S	32.9	Very low	32	Very low	99 Å²	99	111 Å²	111	69%	0.692	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-12.4	178.1	-162.6	0	0	0	0	114	E1495 K1496 I1497	E1495-S1499 PolarHBondContact O-N 3.17Å; K1496-S1499 WeakPolarHBondContact O-CB 3.29Å; K1496-S1499 PolarHBondContact O-N 3.37Å; K1496-S1499 VanDerWaalsContact O-N 3.14Å; I1497-S1499 PolarHBondContact O-N 3.17Å
1500	L	27.5	Very low	31.8	Very low	147 Å²	147	110.9 Å²	110.9	77%	0.77	59%	0.588	S	S	*	*	S	Bend	trans	-118.8	24.8	-163.3	-84.9	164.3	0	0	0	116.4
1501	T	32.2	Very low	31.4	Very low	130 Å²	130	111.2 Å²	111.2	80%	0.798	60%	0.598	S	S	*	*	S	Bend	trans	-138.3	140.4	165.4	50	0	0	0	0	114
1502	G	31.4	Very low	30.9	Very low	69 Å²	69	111.4 Å²	111.4	71%	0.711	60%	0.599	S	S	*	*			trans	88.1	48.1	148.9	0	0	0	0	0	120.5	N1504	G1502-N1504 PolarHBondContact O-N 3.33Å
1503	K	28.5	Very low	30.5	Very low	205 Å²	205	112.2 Å²	112.2	89%	0.891	61%	0.605	S	S	*	*			trans	-63.4	104.2	158.9	-76.6	177	-179.9	168.4	0	110.3
1504	N	32.2	Very low	30.4	Very low	105 Å²	105	113.6 Å²	113.6	56%	0.561	62%	0.616	S	S	*	*			trans	178.2	80.4	138.2	-91.3	-31.2	0	0	0	117.5	T1170 G1502	T1170-N1504 WeakPolarHBondContact CA-O 3.33Å; T1170-N1504 WeakPolarHBondContact CG2-O 3.46Å; G1502-N1504 PolarHBondContact O-N 3.33Å
1505	R	27.8	Very low	29.9	Very low	167 Å²	167	112.9 Å²	112.9	63%	0.63	61%	0.612	S	S	*	*	B	Isolated β-bridge	trans	32	130.2	132	-73.6	-175.7	167.5	-136	2.1	124.3	T1169 T1170 T1171	T1169-R1505 VanDerWaalsContact CA-C 3.46Å; T1170-R1505 CarbonylContact C-O 2.96Å; T1170-R1505 VanDerWaalsContact CA-C 3.41Å; T1170-R1505 WeakPolarHBondContact CA-O 3.44Å; T1170-R1505 PolarHBondContact N-O 2.84Å; T1171-R1505 VanDerWaalsContact CA-O 3.23Å; T1171-R1505 WeakPolarHBondContact CA-O 3.46Å; T1171-R1505 PolarHBondContact N-O 3.47Å
1506	I	31.2	Very low	29.5	Very low	66 Å²	66	114.2 Å²	114.2	34%	0.338	62%	0.615	S	S	.	*	B	Isolated β-bridge	trans	113.6	81.6	147.3	-67.2	150	0	0	0	117.7	L1168 T1169 T1170 T1171 K1172	L1168-I1506 PolarHBondContact O-N 2.82Å; T1169-I1506 CarbonylContact C-O 3.39Å; T1169-I1506 CarbonylContact O-C 3.47Å; T1170-I1506 CarbonylContact C-O 3.37Å; T1170-I1506 PolarHBondContact N-O 3.21Å; T1171-I1506 WeakPolarHBondContact O-CB 3.09Å; T1171-I1506 WeakPolarHBondContact O-CD1 3.07Å; K1172-I1506 HydrophobicContact CB-CD1 4.45Å; K1172-I1506 HydrophobicContact CG-CD1 4.41Å
1507	S	26.1	Very low	29.2	Very low	80 Å²	80	113.8 Å²	113.8	56%	0.559	62%	0.619	S	S	*	*				131.8	135.5	100.6	-149.5	0	0	0	0	111.7	R1138 T1169	R1138-S1507 PolarHBondContact NH1-OG 2.72Å; R1138-S1507 VanDerWaalsContact NH1-OG 3.14Å; T1169-S1507 PolarHBondContact O-N 2.98Å
1508	G	25.7	Very low	28.8	Very low	39 Å²	39	113 Å²	113	40%	0.402	62%	0.616	S	S	.	*			cis	-177.7	-170.6	-1.4	0	0	0	0	0	114.6
1509	H	28.2	Very low	28.7	Very low	104 Å²	104	110.1 Å²	110.1	48%	0.481	62%	0.619	S	S	.	*			trans	76.5	160.4	178.7	-52.9	-28.8	0	0	0	117.9	P1136 S1167	P1136-H1509 WeakPolarHBondContact CB-ND1 3.49Å; P1136-H1509 WeakPolarHBondContact CG-CE1 3.41Å; S1167-H1509 PolarHBondContact OG-O 2.8Å
1510	T	25.7	Very low	29.1	Very low	57 Å²	57	109.2 Å²	109.2	35%	0.35	61%	0.606	S	S	.	*			trans	-129.7	158.4	-170.6	-8	0	0	0	0	110.2	K1137 E1512	K1137-T1510 WeakPolarHBondContact CD-OG1 3.48Å; K1137-T1510 WeakPolarHBondContact CE-OG1 3.44Å; K1137-T1510 WeakPolarHBondContact CG-OG1 3.33Å; K1137-T1510 VanDerWaalsContact NZ-CG2 3.3Å; K1137-T1510 PolarHBondContact NZ-OG1 2.93Å; T1510-E1512 HydrophobicContact CG2-CG 3.88Å
1511	M	28.3	Very low	29.8	Very low	175 Å²	175	107.7 Å²	107.7	86%	0.862	60%	0.597	S	S	*	*				-146.4	125.6	114.8	-97.3	-58.6	164.5	0	0	108.7
1512	E	24.2	Very low	30.7	Very low	79 Å²	79	104.9 Å²	104.9	37%	0.369	58%	0.577	S	S	.	*			trans	-91.9	132.3	169.9	-54.8	-172.4	117.7	0	0	108.2	S1163 S1164 V1165 T1510	S1163-E1512 VanDerWaalsContact C-CD 3.41Å; S1163-E1512 WeakPolarHBondContact O-CB 3.37Å; S1164-E1512 WeakPolarHBondContact CA-OE1 3.48Å; S1164-E1512 PolarHBondContact N-OE1 3.01Å; S1164-E1512 WeakPolarHBondContact O-CB 3.28Å; S1164-E1512 WeakPolarHBondContact O-CG 3.5Å; V1165-E1512 PolarHBondContact N-OE1 2.71Å; V1165-E1512 WeakPolarHBondContact O-CG 3.18Å; T1510-E1512 HydrophobicContact CG2-CG 3.88Å
1513	S	26.1	Very low	32.5	Very low	92 Å²	92	103.8 Å²	103.8	64%	0.643	56%	0.559	S	S	*	*			trans	-166.2	119.3	169.4	-75.6	0	0	0	0	111.7
1514	N	29.9	Very low	35.1	Very low	151 Å²	151	95.8 Å²	95.8	81%	0.807	53%	0.527	S	S	*	.			trans	76.8	35.2	161.7	-55.8	-31.3	0	0	0	120	K1516	N1514-K1516 PolarHBondContact O-N 3.36Å
1515	N	25.9	Very low	37.8	Very low	79 Å²	79	90.9 Å²	90.9	42%	0.422	50%	0.501	S	S	.	.			trans	-79.4	100.7	149.3	-64.9	42.2	0	0	0	109.4	S1164 D1518	S1164-N1515 PolarHBondContact OG-N 3Å; N1515-D1518 WeakPolarHBondContact CB-OD2 3.45Å; N1515-D1518 PolarHBondContact ND2-OD2 3.44Å
1516	K	29.2	Very low	40.5	Very low	175 Å²	175	83 Å²	83	76%	0.761	47%	0.471	S	S	*	.			trans	-128.4	9.2	161.2	-91.3	-164.3	172.5	-170.4	0	113	N1514	N1514-K1516 PolarHBondContact O-N 3.36Å
1517	N	27.9	Very low	43	Very low	119 Å²	119	80.3 Å²	80.3	64%	0.636	46%	0.457	S	S	*	.			trans	-116.3	-5.9	-168.1	-70.4	10.2	0	0	0	114.5	G1519 I1520	N1517-G1519 PolarHBondContact O-N 3.01Å; N1517-I1520 PolarHBondContact O-N 3.23Å
1518	D	29.8	Very low	45.4	Very low	97 Å²	97	79 Å²	79	52%	0.519	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-74.8	-11.1	-173.7	-54.2	-42.5	0	0	0	113.3	N1515 I1520	N1515-D1518 WeakPolarHBondContact CB-OD2 3.45Å; N1515-D1518 PolarHBondContact ND2-OD2 3.44Å; D1518-I1520 VanDerWaalsContact C-N 3.27Å; D1518-I1520 PolarHBondContact O-N 2.91Å
1519	G	31.7	Very low	47.7	Very low	77 Å²	77	78.2 Å²	78.2	79%	0.794	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-79.8	5.8	173.7	0	0	0	0	0	115.6	N1517	N1517-G1519 PolarHBondContact O-N 3.01Å
1520	I	41.2	Very low	49.9	Very low	80 Å²	80	74.9 Å²	74.9	41%	0.41	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-114.3	11.8	-174.2	-45.7	179.2	0	0	0	111.6	N1517 D1518	N1517-I1520 PolarHBondContact O-N 3.23Å; D1518-I1520 VanDerWaalsContact C-N 3.27Å; D1518-I1520 PolarHBondContact O-N 2.91Å
1521	I	43.5	Very low	52.1	Low	116 Å²	116	76 Å²	76	60%	0.595	42%	0.415	S	S	*	.	S	Bend	trans	-86.7	-17.6	179.1	-62.2	179	0	0	0	111.9
1522	N	50.1	Low	54.3	Low	70 Å²	70	69.1 Å²	69.1	37%	0.374	39%	0.388	S	S	.	.	S	Bend	trans	-100.3	-9	-168.9	-62.7	19.6	0	0	0	114.6	Q1491	Q1491-N1522 PolarHBondContact NE2-OD1 3.3Å; Q1491-N1522 PolarHBondContact OE1-ND2 3.41Å; Q1491-N1522 PolarHBondContact OE1-OD1 2.7Å
1523	S	68.6	Low	56.8	Low	46 Å²	46	67.1 Å²	67.1	32%	0.322	38%	0.381	S	S	.	.	S	Bend	trans	-85.4	120	-179.5	57	0	0	0	0	111.3	A1525	S1523-A1525 PolarHBondContact O-N 3.23Å
1524	V	84.9	Confident	59.4	Low	37 Å²	37	64.6 Å²	64.6	22%	0.224	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-57.1	118.6	167.6	-178.5	0	0	0	0	109	L1484 L1626	L1484-V1524 HydrophobicContact CD2-CG1 3.9Å; L1484-V1524 HydrophobicContact CD2-CG2 4.07Å; V1524-L1626 HydrophobicContact CG2-CD2 3.92Å; V1524-L1626 HydrophobicContact CG2-CG 4.31Å
1525	A	87.1	Confident	62	Low	3 Å²	3	58.3 Å²	58.3	3%	0.025	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	145.2	172.1	0	0	0	0	0	110	F1417 F1433 S1523 L1625 L1626 T1627 S1628	F1417-A1525 HydrophobicContact CE2-CB 3.93Å; F1417-A1525 HydrophobicContact CZ-CB 3.57Å; F1433-A1525 HydrophobicContact CB-CB 4.03Å; F1433-A1525 HydrophobicContact CG-CB 4.44Å; S1523-A1525 PolarHBondContact O-N 3.23Å; A1525-L1625 HydrophobicContact CB-CD2 3.66Å; A1525-L1625 HydrophobicContact CB-CG 4.07Å; A1525-L1626 PolarHBondContact N-O 2.75Å; A1525-T1627 CarbonylContact O-C 3.6Å; A1525-T1627 VanDerWaalsContact O-CA 3.24Å; A1525-T1627 WeakPolarHBondContact O-CA 3.49Å; A1525-S1628 PolarHBondContact O-N 2.81Å
1526	W	86	Confident	64.8	Low	1 Å²	1	55.1 Å²	55.1	0%	0.004	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.8	173.7	179.2	55.7	0	0	0	110.9	C1434 E1443 R1528 L1629 P1631	C1434-W1526 HydrophobicContact CB-CE3 4.35Å; C1434-W1526 PolarHBondContact O-N 3.24Å; E1443-W1526 HydrophobicContact CB-CH2 4.1Å; E1443-W1526 WeakPolarHBondContact OE2-CH2 3.35Å; W1526-R1528 HydrophobicContact CE3-CG 4.36Å; W1526-R1528 HydrophobicContact CH2-CG 3.4Å; W1526-R1528 HydrophobicContact CZ2-CG 3.8Å; W1526-R1528 HydrophobicContact CZ3-CG 3.71Å; W1526-L1629 PolarHBondContact NE1-O 2.66Å; W1526-P1631 HydrophobicContact CZ2-CG 4.12Å
1527	K	83.5	Confident	67.7	Low	9 Å²	9	46.9 Å²	46.9	4%	0.039	27%	0.271	C	S	.	.			trans	-117.4	119.1	176.8	-178.8	176.5	173.5	-173.4	0	109.1	F1417 E1535 T1627 S1628 L1629	F1417-K1527 HydrophobicContact CD2-CB 3.85Å; F1417-K1527 HydrophobicContact CD2-CD 4.21Å; F1417-K1527 HydrophobicContact CD2-CG 4.04Å; F1417-K1527 HydrophobicContact CE2-CB 3.95Å; K1527-E1535 WeakPolarHBondContact CE-OE1 3.26Å; K1527-E1535 IonicContact NZ-OE1 3.77Å; K1527-E1535 PolarHBondContact NZ-OE1 3.37Å; K1527-E1535 IonicContact NZ-OE2 2.61Å; K1527-E1535 PolarHBondContact NZ-OE2 3.4Å; K1527-T1627 HydrophobicContact CB-CG2 3.78Å; K1527-S1628 PolarHBondContact N-O 2.97Å; K1527-L1629 HydrophobicContact CB-CD2 4.07Å; K1527-L1629 HydrophobicContact CD-CD2 4.22Å; K1527-L1629 HydrophobicContact CG-CD2 4.14Å
1528	R	77	Confident	70.6	Confident	52 Å²	52	42.1 Å²	42.1	20%	0.196	25%	0.245	C	C	.	.			trans	-61.5	131.9	172.5	-76.3	174.8	165.9	125.8	-3.3	110	E1443 W1526	E1443-R1528 VanDerWaalsContact CD-NE 3.27Å; E1443-R1528 VanDerWaalsContact CD-NH2 3.33Å; E1443-R1528 IonicContact OE1-CZ 2.97Å; E1443-R1528 VanDerWaalsContact OE1-CZ 3.25Å; E1443-R1528 IonicContact OE1-NE 2.67Å; E1443-R1528 PolarHBondContact OE1-NE 2.79Å; E1443-R1528 IonicContact OE1-NH2 2.78Å; E1443-R1528 PolarHBondContact OE1-NH2 3.26Å; E1443-R1528 VanDerWaalsContact OE1-NH2 3.11Å; E1443-R1528 IonicContact OE2-CZ 3.71Å; E1443-R1528 IonicContact OE2-NE 3.93Å; E1443-R1528 PolarHBondContact OE2-NE 2.85Å; E1443-R1528 IonicContact OE2-NH2 2.64Å; E1443-R1528 PolarHBondContact OE2-NH2 3.38Å; W1526-R1528 HydrophobicContact CE3-CG 4.36Å; W1526-R1528 HydrophobicContact CH2-CG 3.4Å; W1526-R1528 HydrophobicContact CZ2-CG 3.8Å; W1526-R1528 HydrophobicContact CZ3-CG 3.71Å
1529	P	72.8	Confident	73.4	Confident	24 Å²	24	38.9 Å²	38.9	16%	0.156	23%	0.229	C	C	.	.			trans	-68.8	153.8	172.1	33.9	-37.7	0	0	0	109.7	L1446 W1447 F1978	L1446-P1529 HydrophobicContact CD2-CG 3.8Å; W1447-P1529 HydrophobicContact CZ2-CB 4.18Å; W1447-P1529 HydrophobicContact CZ2-CG 3.94Å; P1529-F1978 HydrophobicContact CB-CE1 3.92Å; P1529-F1978 HydrophobicContact CG-CE1 4.02Å; P1529-F1978 HydrophobicContact CG-CZ 4.38Å
1530	V	73.9	Confident	76	Confident	34 Å²	34	35.5 Å²	35.5	21%	0.206	19%	0.193	C	C	.	.			trans	-119.6	124.1	-174.5	177.2	0	0	0	0	109.7	I1290 G1532 V1533	I1290-V1530 HydrophobicContact CG2-CG1 4.29Å; V1530-G1532 PolarHBondContact O-N 3.18Å; V1530-V1533 HydrophobicContact CB-CB 4.01Å; V1530-V1533 HydrophobicContact CB-CG2 4.36Å; V1530-V1533 HydrophobicContact CG1-CB 3.95Å; V1530-V1533 HydrophobicContact CG1-CG2 3.74Å; V1530-V1533 PolarHBondContact O-N 3.19Å
1531	K	73	Confident	78.1	Confident	81 Å²	81	34.2 Å²	34.2	35%	0.352	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	129.1	-176.6	-176.4	164.6	-177.2	169.6	0	111.6	L1262 N1263 V1533 F1978	L1262-K1531 WeakPolarHBondContact O-CD 3.43Å; L1262-K1531 PolarHBondContact O-NZ 3.36Å; N1263-K1531 PolarHBondContact OD1-NZ 3.37Å; K1531-V1533 PolarHBondContact O-N 3.43Å; K1531-F1978 WeakPolarHBondContact CA-O 3.35Å; K1531-F1978 HydrophobicContact CB-CD2 4.01Å; K1531-F1978 HydrophobicContact CB-CE1 4.38Å; K1531-F1978 HydrophobicContact CB-CE2 3.75Å; K1531-F1978 HydrophobicContact CB-CG 4.46Å; K1531-F1978 HydrophobicContact CB-CZ 3.95Å; K1531-F1978 HydrophobicContact CD-CD2 4.26Å; K1531-F1978 HydrophobicContact CG-CD2 4.19Å; K1531-F1978 HydrophobicContact CG-CE2 4.4Å
1532	G	75	Confident	80	Confident	29 Å²	29	29.2 Å²	29.2	30%	0.299	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	13.1	-179	0	0	0	0	0	115	T1309 V1530 F1978 V1980	T1309-G1532 WeakPolarHBondContact CG2-O 3.46Å; V1530-G1532 PolarHBondContact O-N 3.18Å; G1532-F1978 PolarHBondContact N-O 2.8Å; G1532-V1980 VanDerWaalsContact C-CG2 3.49Å; G1532-V1980 VanDerWaalsContact O-CG2 3.29Å; G1532-V1980 WeakPolarHBondContact O-CG2 3.41Å
1533	V	76.4	Confident	81.7	Confident	37 Å²	37	26.8 Å²	26.8	22%	0.224	15%	0.148	C	C	.	.			trans	-119.4	114.8	177.4	175.9	0	0	0	0	110.2	A1305 T1309 V1530 K1531	A1305-V1533 HydrophobicContact CB-CG1 4Å; T1309-V1533 HydrophobicContact CG2-CG2 3.76Å; V1530-V1533 HydrophobicContact CB-CB 4.01Å; V1530-V1533 HydrophobicContact CB-CG2 4.36Å; V1530-V1533 HydrophobicContact CG1-CB 3.95Å; V1530-V1533 HydrophobicContact CG1-CG2 3.74Å; V1530-V1533 PolarHBondContact O-N 3.19Å; K1531-V1533 PolarHBondContact O-N 3.43Å
1534	R	80.2	Confident	82.7	Confident	39 Å²	39	24.9 Å²	24.9	15%	0.147	13%	0.134	C	C	.	.			trans	-68.2	130.9	171.9	-168.2	-174.3	-171.4	173.5	18.7	110.8	M1536 T1543 E2219 D2220	R1534-M1536 HydrophobicContact CB-CG 4.26Å; R1534-M1536 HydrophobicContact CB-SD 4.41Å; R1534-M1536 HydrophobicContact CG-CG 3.79Å; R1534-M1536 HydrophobicContact CG-SD 4.33Å; R1534-T1543 HydrophobicContact CG-CG2 4.24Å; R1534-T1543 VanDerWaalsContact CZ-OG1 3.3Å; R1534-T1543 PolarHBondContact NE-OG1 3.31Å; R1534-T1543 PolarHBondContact NH2-OG1 3.32Å; R1534-E2219 IonicContact NH1-OE1 2.74Å; R1534-E2219 PolarHBondContact NH1-OE1 2.71Å; R1534-D2220 PolarHBondContact NH1-O 2.73Å; R1534-D2220 VanDerWaalsContact NH2-C 3.31Å; R1534-D2220 PolarHBondContact NH2-O 3.26Å; R1534-D2220 IonicContact NH2-OD1 3.13Å; R1534-D2220 PolarHBondContact NH2-OD1 3.38Å; R1534-D2220 VanDerWaalsContact NH2-OD1 3.14Å; R1534-D2220 IonicContact NH2-OD2 3.13Å; R1534-D2220 PolarHBondContact NH2-OD2 2.89Å
1535	E	83.5	Confident	82.8	Confident	19 Å²	19	23.5 Å²	23.5	9%	0.089	13%	0.125	C	C	.	.			trans	-88.3	123.6	171.6	-76.2	-62.6	169.6	0	0	110.5	K1527 T1543 M1544 L1629	K1527-E1535 WeakPolarHBondContact CE-OE1 3.26Å; K1527-E1535 IonicContact NZ-OE1 3.77Å; K1527-E1535 PolarHBondContact NZ-OE1 3.37Å; K1527-E1535 IonicContact NZ-OE2 2.61Å; K1527-E1535 PolarHBondContact NZ-OE2 3.4Å; E1535-T1543 CarbonylContact O-C 2.87Å; E1535-T1543 WeakPolarHBondContact O-CA 3.44Å; E1535-T1543 WeakPolarHBondContact O-CG2 3.49Å; E1535-M1544 HydrophobicContact CB-CE 4.02Å; E1535-M1544 PolarHBondContact O-N 3.01Å; E1535-L1629 HydrophobicContact CB-CD1 4.26Å; E1535-L1629 HydrophobicContact CG-CD1 4.47Å; E1535-L1629 HydrophobicContact CG-CD2 4.37Å
1536	M	85.7	Confident	83	Confident	13 Å²	13	23.4 Å²	23.4	6%	0.064	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-136.6	146.2	-166.7	-59.5	167.8	75.3	0	0	111.1	R1534 E1541 T1542 E2219	R1534-M1536 HydrophobicContact CB-CG 4.26Å; R1534-M1536 HydrophobicContact CB-SD 4.41Å; R1534-M1536 HydrophobicContact CG-CG 3.79Å; R1534-M1536 HydrophobicContact CG-SD 4.33Å; M1536-E1541 HydrophobicContact CE-CB 4.3Å; M1536-E1541 WeakPolarHBondContact CE-O 3.49Å; M1536-T1542 WeakPolarHBondContact CA-O 3.49Å; M1536-E2219 HydrophobicContact CE-CG 3.86Å; M1536-E2219 WeakPolarHBondContact CE-OE1 3.26Å
1537	C	90.9	Very high	83.2	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.007	13%	0.126	C	C	.	.			trans	-69.8	127.3	174.7	-177.8	0	0	0	0	111.7	V1539 E1541 T1542 M1544 C1559	C1537-V1539 PolarHBondContact O-N 3.2Å; C1537-V1539 VanDerWaalsContact O-N 3.15Å; C1537-V1539 PolarHBondContact SG-N 3.39Å; C1537-E1541 WeakPolarHBondContact O-CA 3.4Å; C1537-E1541 PolarHBondContact O-N 3.06Å; C1537-T1542 PolarHBondContact N-O 3.01Å; C1537-M1544 HydrophobicContact CB-CG 4.49Å; C1537-C1559 HydrophobicContact CB-CB 4.16Å; C1537-C1559 PolarHBondContact SG-N 2.91Å; C1537-C1559 VanDerWaalsContact SG-N 3.35Å
1538	D	88.8	Confident	83.6	Confident	20 Å²	20	23.2 Å²	23.2	11%	0.107	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	15.7	176.2	-68.1	-47.6	0	0	0	113.8	M1408 R1413 Y1556 S1557	M1408-D1538 WeakPolarHBondContact CE-OD1 3.25Å; R1413-D1538 IonicContact CZ-OD1 2.62Å; R1413-D1538 IonicContact CZ-OD2 2.86Å; R1413-D1538 IonicContact NH1-OD1 2.74Å; R1413-D1538 PolarHBondContact NH1-OD1 3.14Å; R1413-D1538 IonicContact NH1-OD2 3.11Å; R1413-D1538 PolarHBondContact NH1-OD2 3.46Å; D1538-Y1556 HydrophobicContact CB-CD2 3.48Å; D1538-Y1556 VanDerWaalsContact CB-CD2 3.48Å; D1538-Y1556 HydrophobicContact CB-CE1 4.44Å; D1538-Y1556 HydrophobicContact CB-CE2 3.21Å; D1538-Y1556 HydrophobicContact CB-CG 4.2Å; D1538-Y1556 WeakPolarHBondContact O-CE2 3.23Å; D1538-Y1556 PolarHBondContact O-OH 3.08Å; D1538-Y1556 WeakPolarHBondContact OD2-CA 3.28Å; D1538-S1557 WeakPolarHBondContact CB-O 3.08Å; D1538-S1557 PolarHBondContact N-O 3.13Å; D1538-S1557 PolarHBondContact OD2-N 3.09Å
1539	V	87.7	Confident	84.4	Confident	29 Å²	29	22 Å²	22	18%	0.176	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-49.8	174.6	-179.6	0	0	0	0	111.7	C1537 Y1556 V1558 C1562 W1609	C1537-V1539 PolarHBondContact O-N 3.2Å; C1537-V1539 VanDerWaalsContact O-N 3.15Å; C1537-V1539 PolarHBondContact SG-N 3.39Å; V1539-Y1556 HydrophobicContact CG2-CE1 4.29Å; V1539-Y1556 VanDerWaalsContact CG2-OH 3.28Å; V1539-Y1556 WeakPolarHBondContact CG2-OH 3.43Å; V1539-V1558 HydrophobicContact CG2-CG1 3.86Å; V1539-V1558 HydrophobicContact CG2-CG2 4.09Å; V1539-C1562 HydrophobicContact CB-CB 4.07Å; V1539-C1562 HydrophobicContact CG1-CB 3.99Å; V1539-W1609 HydrophobicContact CG2-CD2 4.36Å; V1539-W1609 HydrophobicContact CG2-CG 4.35Å; V1539-W1609 HydrophobicContact CG2-CZ2 4.43Å
1540	C	86.4	Confident	85.2	Confident	6 Å²	6	21 Å²	21	4%	0.041	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	5.9	-176.8	63.3	0	0	0	0	114.2	T1542 R2209 H2218	C1540-T1542 PolarHBondContact O-N 2.81Å; C1540-T1542 PolarHBondContact SG-OG1 2.97Å; C1540-R2209 HydrophobicContact CB-CG 4.26Å; C1540-H2218 PolarHBondContact O-CE1 2.97Å; C1540-H2218 VanDerWaalsContact O-CE1 3.24Å
1541	E	84.9	Confident	86	Confident	52 Å²	52	19.7 Å²	19.7	24%	0.243	11%	0.105	C	C	.	.			trans	58.6	6	175.1	-45.7	-154.2	136.7	0	0	116.3	R1304 M1536 C1537 E2219	R1304-E1541 IonicContact CZ-OE1 3.25Å; R1304-E1541 IonicContact NH1-OE1 2.67Å; R1304-E1541 PolarHBondContact NH1-OE1 3.05Å; R1304-E1541 IonicContact NH2-OE1 3.46Å; R1304-E1541 PolarHBondContact NH2-OE1 2.86Å; R1304-E1541 IonicContact NH2-OE2 2.7Å; R1304-E1541 PolarHBondContact NH2-OE2 2.88Å; M1536-E1541 HydrophobicContact CE-CB 4.3Å; M1536-E1541 WeakPolarHBondContact CE-O 3.49Å; C1537-E1541 WeakPolarHBondContact O-CA 3.4Å; C1537-E1541 PolarHBondContact O-N 3.06Å; E1541-E2219 HydrophobicContact CB-CG 4.38Å
1542	T	84.2	Confident	86.6	Confident	12 Å²	12	16.5 Å²	16.5	7%	0.074	10%	0.095	C	C	.	.			trans	-76.2	158.8	174.2	61.2	0	0	0	0	113.7	M1536 C1537 C1540 R2209 D2220	M1536-T1542 WeakPolarHBondContact CA-O 3.49Å; C1537-T1542 PolarHBondContact N-O 3.01Å; C1540-T1542 PolarHBondContact O-N 2.81Å; C1540-T1542 PolarHBondContact SG-OG1 2.97Å; T1542-R2209 HydrophobicContact CG2-CB 4.16Å; T1542-R2209 HydrophobicContact CG2-CG 4.03Å; T1542-D2220 HydrophobicContact CG2-CB 3.96Å
1543	T	86.2	Confident	87	Confident	19 Å²	19	20.8 Å²	20.8	12%	0.117	11%	0.105	C	C	.	.	B	Isolated β-bridge	trans	-66.8	136.8	-179.4	-44.6	0	0	0	0	111.8	R1534 E1535 D2220 Q2223	R1534-T1543 HydrophobicContact CG-CG2 4.24Å; R1534-T1543 VanDerWaalsContact CZ-OG1 3.3Å; R1534-T1543 PolarHBondContact NE-OG1 3.31Å; R1534-T1543 PolarHBondContact NH2-OG1 3.32Å; E1535-T1543 CarbonylContact O-C 2.87Å; E1535-T1543 WeakPolarHBondContact O-CA 3.44Å; E1535-T1543 WeakPolarHBondContact O-CG2 3.49Å; T1543-D2220 WeakPolarHBondContact CB-OD2 3.22Å; T1543-D2220 PolarHBondContact N-OD2 3.4Å; T1543-D2220 VanDerWaalsContact N-OD2 3.08Å; T1543-D2220 PolarHBondContact OG1-OD2 3.31Å; T1543-Q2223 HydrophobicContact CG2-CB 4.3Å; T1543-Q2223 HydrophobicContact CG2-CG 4.16Å; T1543-Q2223 WeakPolarHBondContact OG1-CG 3.48Å
1544	M	88.2	Confident	87.4	Confident	6 Å²	6	19.1 Å²	19.1	3%	0.03	10%	0.095	C	C	.	.			trans	-91.9	110.3	168.4	-55.3	-174.1	-48.2	0	0	108.5	E1535 C1537 H1548 L1629	E1535-M1544 HydrophobicContact CB-CE 4.02Å; E1535-M1544 PolarHBondContact O-N 3.01Å; C1537-M1544 HydrophobicContact CB-CG 4.49Å; M1544-H1548 HydrophobicContact CB-CB 4.37Å; M1544-H1548 HydrophobicContact CE-CB 4.17Å; M1544-H1548 WeakPolarHBondContact CE-CD2 3.49Å; M1544-H1548 HydrophobicContact CG-CB 4.31Å; M1544-H1548 HydrophobicContact SD-CB 3.48Å; M1544-H1548 WeakPolarHBondContact SD-CB 3.01Å; M1544-L1629 WeakPolarHBondContact O-CD1 3.39Å
1545	F	87.6	Confident	87.6	Confident	7 Å²	7	17.4 Å²	17.4	3%	0.031	9%	0.089	C	C	.	.			trans	-68.5	-53.5	177.6	169.1	-114.1	0	0	0	112	L1476 E1480 L1629 L1630 K2225 N2226 F2229	L1476-F1545 HydrophobicContact CD1-CD1 4.22Å; L1476-F1545 HydrophobicContact CD2-CD1 4.41Å; L1476-F1545 HydrophobicContact CD2-CE1 4.22Å; L1476-F1545 HydrophobicContact CD2-CZ 4.47Å; L1476-F1545 HydrophobicContact CG-CD1 4.45Å; L1476-F1545 HydrophobicContact CG-CE1 4.26Å; E1480-F1545 HydrophobicContact CG-CD1 3.91Å; E1480-F1545 HydrophobicContact CG-CE1 3.95Å; F1545-L1629 WeakPolarHBondContact O-CD1 3.47Å; F1545-L1630 HydrophobicContact CZ-CD1 4.29Å; F1545-K2225 HydrophobicContact CB-CB 3.66Å; F1545-K2225 HydrophobicContact CB-CD 3.68Å; F1545-K2225 HydrophobicContact CB-CG 4.29Å; F1545-K2225 HydrophobicContact CD2-CB 3.86Å; F1545-K2225 HydrophobicContact CG-CB 3.76Å; F1545-K2225 HydrophobicContact CG-CD 4.3Å; F1545-N2226 WeakPolarHBondContact CD2-OD1 3.31Å; F1545-F2229 HydrophobicContact CE2-CB 3.62Å; F1545-F2229 AromaticContact CE2-CD2 3.96Å; F1545-F2229 HydrophobicContact CE2-CD2 3.96Å; F1545-F2229 AromaticContact CE2-CG 3.85Å; F1545-F2229 HydrophobicContact CE2-CG 3.85Å; F1545-F2229 HydrophobicContact CZ-CB 3.98Å; F1545-F2229 AromaticContact CZ-CD2 3.55Å; F1545-F2229 HydrophobicContact CZ-CD2 3.55Å; F1545-F2229 HydrophobicContact CZ-CE2 4.33Å; F1545-F2229 AromaticContact CZ-CG 3.94Å; F1545-F2229 HydrophobicContact CZ-CG 3.94Å
1546	N	90.5	Very high	87.9	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.005	9%	0.086	C	C	.	.	S	Bend	trans	-148.1	-78.7	-178.1	177.8	51.8	0	0	0	113.6	E1480 H1548 S1628 L1629 L1630	E1480-N1546 HydrophobicContact CG-CB 4.48Å; E1480-N1546 WeakPolarHBondContact OE2-CB 3.15Å; E1480-N1546 PolarHBondContact OE2-ND2 2.77Å; N1546-H1548 PolarHBondContact O-N 2.69Å; N1546-H1548 PolarHBondContact O-ND1 3.43Å; N1546-S1628 PolarHBondContact OD1-OG 3.15Å; N1546-L1629 PolarHBondContact OD1-N 3.39Å; N1546-L1630 HydrophobicContact CB-CD1 3.78Å; N1546-L1630 WeakPolarHBondContact OD1-CD1 3.23Å; N1546-L1630 PolarHBondContact OD1-N 2.89Å
1547	T	91.2	Very high	88.1	Confident	7 Å²	7	16 Å²	16	4%	0.043	8%	0.083	C	C	.	.			trans	-71	128.2	-177.8	52.9	0	0	0	0	111.2	E1480 L1484 T1627	E1480-T1547 VanDerWaalsContact OE2-CB 3.23Å; E1480-T1547 WeakPolarHBondContact OE2-CB 3.37Å; E1480-T1547 VanDerWaalsContact OE2-CG2 3.28Å; E1480-T1547 WeakPolarHBondContact OE2-CG2 3.48Å; E1480-T1547 PolarHBondContact OE2-N 2.87Å; E1480-T1547 PolarHBondContact OE2-OG1 3.18Å; L1484-T1547 HydrophobicContact CD2-CG2 3.67Å; L1484-T1547 HydrophobicContact CG-CG2 3.74Å; T1547-T1627 WeakPolarHBondContact CA-O 3.41Å
1548	H	92.4	Very high	88.2	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	171.4	178.9	64.1	-75	0	0	0	110.8	M1544 N1546 V1550 T1627	M1544-H1548 HydrophobicContact CB-CB 4.37Å; M1544-H1548 HydrophobicContact CE-CB 4.17Å; M1544-H1548 WeakPolarHBondContact CE-CD2 3.49Å; M1544-H1548 HydrophobicContact CG-CB 4.31Å; M1544-H1548 HydrophobicContact SD-CB 3.48Å; M1544-H1548 WeakPolarHBondContact SD-CB 3.01Å; N1546-H1548 PolarHBondContact O-N 2.69Å; N1546-H1548 PolarHBondContact O-ND1 3.43Å; H1548-V1550 WeakPolarHBondContact CD2-CG2 3.27Å; H1548-T1627 VanDerWaalsContact CE1-CG2 3.43Å; H1548-T1627 WeakPolarHBondContact CE1-CG2 3.33Å; H1548-T1627 PolarHBondContact N-O 2.86Å; H1548-T1627 PolarHBondContact ND1-O 2.94Å; H1548-T1627 WeakPolarHBondContact NE2-CG2 3.48Å; H1548-T1627 WeakPolarHBondContact O-CA 3.39Å; H1548-T1627 WeakPolarHBondContact O-CB 3.32Å; H1548-T1627 PolarHBondContact O-N 3.48Å; H1548-T1627 VanDerWaalsContact O-O 3.13Å
1549	W	92.6	Very high	88.4	Confident	27 Å²	27	15.4 Å²	15.4	10%	0.102	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.5	-173.1	-72.8	79	0	0	0	110.8	N1487 S1557 V1558 L1563 L1624 L1625 L1626	N1487-W1549 VanDerWaalsContact OD1-CH2 3.3Å; N1487-W1549 WeakPolarHBondContact OD1-CH2 3.25Å; N1487-W1549 VanDerWaalsContact OD1-CZ2 3.28Å; N1487-W1549 WeakPolarHBondContact OD1-CZ2 3.39Å; W1549-S1557 CarbonylContact O-C 3.57Å; W1549-S1557 WeakPolarHBondContact O-CA 3.36Å; W1549-V1558 PolarHBondContact N-O 3.3Å; W1549-V1558 PolarHBondContact O-N 3.28Å; W1549-L1563 HydrophobicContact CB-CD2 4.46Å; W1549-L1563 HydrophobicContact CD2-CD2 3.54Å; W1549-L1563 VanDerWaalsContact CE2-CD2 3.42Å; W1549-L1563 HydrophobicContact CE3-CD2 4.23Å; W1549-L1563 HydrophobicContact CG-CD2 3.63Å; W1549-L1563 HydrophobicContact CZ2-CD2 4.01Å; W1549-L1624 HydrophobicContact CB-CB 4.02Å; W1549-L1624 HydrophobicContact CB-CD1 4.08Å; W1549-L1624 HydrophobicContact CE3-CB 3.95Å; W1549-L1624 WeakPolarHBondContact CZ3-O 3.49Å; W1549-L1625 WeakPolarHBondContact CA-O 3.42Å; W1549-L1626 HydrophobicContact CD2-CB 4.37Å; W1549-L1626 HydrophobicContact CD2-CD1 4.43Å; W1549-L1626 HydrophobicContact CE3-CB 4.28Å; W1549-L1626 HydrophobicContact CH2-CB 3.91Å; W1549-L1626 HydrophobicContact CZ2-CB 3.98Å; W1549-L1626 HydrophobicContact CZ2-CD1 3.92Å; W1549-L1626 HydrophobicContact CZ2-CG 4.36Å; W1549-L1626 HydrophobicContact CZ3-CB 4.07Å
1550	V	91.1	Very high	88.4	Confident	1 Å²	1	15 Å²	15	1%	0.006	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.2	-170	-175.5	0	0	0	0	111.1	F1417 H1548 G1552 Y1556 L1625 T1627	F1417-V1550 HydrophobicContact CD1-CB 4.18Å; F1417-V1550 HydrophobicContact CD1-CG1 3.5Å; F1417-V1550 HydrophobicContact CE1-CB 3.62Å; F1417-V1550 HydrophobicContact CE1-CG1 3.47Å; F1417-V1550 VanDerWaalsContact CE1-CG1 3.47Å; F1417-V1550 HydrophobicContact CE1-CG2 4.27Å; F1417-V1550 HydrophobicContact CG-CG1 4.33Å; F1417-V1550 HydrophobicContact CZ-CB 4.05Å; F1417-V1550 HydrophobicContact CZ-CG1 4.28Å; F1417-V1550 HydrophobicContact CZ-CG2 4.3Å; H1548-V1550 WeakPolarHBondContact CD2-CG2 3.27Å; V1550-G1552 PolarHBondContact O-N 3.11Å; V1550-Y1556 CarbonylContact C-O 3.2Å; V1550-Y1556 WeakPolarHBondContact CA-O 3.39Å; V1550-L1625 PolarHBondContact N-O 3.03Å; V1550-L1625 WeakPolarHBondContact O-CB 3.37Å; V1550-L1625 PolarHBondContact O-N 2.92Å; V1550-T1627 HydrophobicContact CG2-CG2 4.12Å; V1550-T1627 WeakPolarHBondContact CG2-OG1 3.19Å
1551	C	90.6	Very high	88.5	Confident	8 Å²	8	17.4 Å²	17.4	5%	0.054	9%	0.09	C	C	.	.			trans	-70.6	103.2	172.4	-179.9	0	0	0	0	110.3	K1553 C1554 G1555 Y1556 H1619 L1624	C1551-K1553 PolarHBondContact O-N 2.9Å; C1551-C1554 PolarHBondContact O-N 3.38Å; C1551-G1555 PolarHBondContact O-N 2.71Å; C1551-Y1556 PolarHBondContact N-O 2.52Å; C1551-H1619 VanDerWaalsContact CB-CD2 3.49Å; C1551-H1619 WeakPolarHBondContact CB-CD2 3.47Å; C1551-H1619 WeakPolarHBondContact CB-NE2 3.33Å; C1551-H1619 PolarHBondContact SG-CD2 3.3Å; C1551-H1619 PolarHBondContact SG-NE2 3.16Å; C1551-L1624 HydrophobicContact CB-CD2 3.69Å
1552	G	84.2	Confident	88.8	Confident	13 Å²	13	15 Å²	15	13%	0.134	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-6.9	179	0	0	0	0	0	116.5	R1418 V1550	R1418-G1552 PolarHBondContact NH2-O 3.48Å; V1550-G1552 PolarHBondContact O-N 3.11Å
1553	K	84.7	Confident	89.2	Confident	120 Å²	120	14.5 Å²	14.5	52%	0.522	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-12.5	174	-62.6	-176.7	-177.8	177.3	0	114.4	F1414 C1551 T1614 T1615	F1414-K1553 VanDerWaalsContact CE2-C 3.49Å; F1414-K1553 WeakPolarHBondContact CE2-O 3.4Å; C1551-K1553 PolarHBondContact O-N 2.9Å; K1553-T1614 WeakPolarHBondContact O-CB 3.35Å; K1553-T1614 PolarHBondContact O-OG1 3.28Å; K1553-T1615 HydrophobicContact CD-CG2 3.67Å
1554	C	84.6	Confident	89.3	Confident	2 Å²	2	17.5 Å²	17.5	1%	0.014	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-151.2	-27.2	-179.2	73.4	0	0	0	0	115.6	V1410 F1414 C1551 H1619	V1410-C1554 VanDerWaalsContact CG1-C 3.49Å; V1410-C1554 HydrophobicContact CG1-CB 3.6Å; V1410-C1554 WeakPolarHBondContact CG1-O 3.42Å; F1414-C1554 VanDerWaalsContact CA-O 3.25Å; F1414-C1554 WeakPolarHBondContact CA-O 3.5Å; F1414-C1554 WeakPolarHBondContact CB-O 3.42Å; F1414-C1554 PolarHBondContact N-O 3.17Å; C1551-C1554 PolarHBondContact O-N 3.38Å; C1554-H1619 PolarHBondContact SG-NE2 2.7Å; C1554-H1619 VanDerWaalsContact SG-NE2 3.4Å
1555	G	84.5	Confident	89.2	Confident	2 Å²	2	21.4 Å²	21.4	2%	0.021	11%	0.109	C	C	.	.			trans	91.4	18.3	-176.9	0	0	0	0	0	114.7	R1413 C1551 S1557	R1413-G1555 WeakPolarHBondContact CB-O 3.46Å; R1413-G1555 WeakPolarHBondContact CD-O 3.44Å; C1551-G1555 PolarHBondContact O-N 2.71Å; G1555-S1557 PolarHBondContact O-N 2.94Å
1556	Y	89.5	Confident	89.1	Confident	4 Å²	4	21.8 Å²	21.8	2%	0.016	11%	0.113	C	C	.	.			trans	-62.9	124.9	161.6	-175.7	-102	0	0	0	109	D1538 V1539 V1550 C1551 V1558 G1608 A1610 H1619	D1538-Y1556 HydrophobicContact CB-CD2 3.48Å; D1538-Y1556 VanDerWaalsContact CB-CD2 3.48Å; D1538-Y1556 HydrophobicContact CB-CE1 4.44Å; D1538-Y1556 HydrophobicContact CB-CE2 3.21Å; D1538-Y1556 HydrophobicContact CB-CG 4.2Å; D1538-Y1556 WeakPolarHBondContact O-CE2 3.23Å; D1538-Y1556 PolarHBondContact O-OH 3.08Å; D1538-Y1556 WeakPolarHBondContact OD2-CA 3.28Å; V1539-Y1556 HydrophobicContact CG2-CE1 4.29Å; V1539-Y1556 VanDerWaalsContact CG2-OH 3.28Å; V1539-Y1556 WeakPolarHBondContact CG2-OH 3.43Å; V1550-Y1556 CarbonylContact C-O 3.2Å; V1550-Y1556 WeakPolarHBondContact CA-O 3.39Å; C1551-Y1556 PolarHBondContact N-O 2.52Å; Y1556-V1558 HydrophobicContact CD1-CG2 3.86Å; Y1556-V1558 HydrophobicContact CE1-CG2 3.62Å; Y1556-G1608 PolarHBondContact OH-O 3Å; Y1556-G1608 VanDerWaalsContact OH-O 3.12Å; Y1556-A1610 HydrophobicContact CD2-CB 4.32Å; Y1556-A1610 HydrophobicContact CE2-CB 3.6Å; Y1556-A1610 PolarHBondContact OH-N 3.1Å; Y1556-H1619 WeakPolarHBondContact CB-CE1 3.17Å; Y1556-H1619 AromaticContact CD1-CE1 3.4Å; Y1556-H1619 VanDerWaalsContact CD1-CE1 3.4Å; Y1556-H1619 WeakPolarHBondContact CD1-CE1 3.4Å; Y1556-H1619 AromaticContact CD1-CG 3.82Å; Y1556-H1619 AromaticContact CD1-ND1 3.25Å; Y1556-H1619 WeakPolarHBondContact CD1-ND1 3.39Å; Y1556-H1619 AromaticContact CD2-CE1 3.88Å; Y1556-H1619 AromaticContact CE1-ND1 3.56Å; Y1556-H1619 AromaticContact CG-CE1 3.27Å; Y1556-H1619 AromaticContact CG-ND1 3.63Å; Y1556-H1619 AromaticContact CG-NE2 3.97Å
1557	S	90.4	Very high	88.7	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	138.1	-171.5	-61.5	0	0	0	0	111.7	D1538 W1549 G1555	D1538-S1557 WeakPolarHBondContact CB-O 3.08Å; D1538-S1557 PolarHBondContact N-O 3.13Å; D1538-S1557 PolarHBondContact OD2-N 3.09Å; W1549-S1557 CarbonylContact O-C 3.57Å; W1549-S1557 WeakPolarHBondContact O-CA 3.36Å; G1555-S1557 PolarHBondContact O-N 2.94Å
1558	V	92.3	Very high	88.1	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.5	-177.8	-168	0	0	0	0	109.9	V1539 W1549 Y1556 C1562 W1609 L1624	V1539-V1558 HydrophobicContact CG2-CG1 3.86Å; V1539-V1558 HydrophobicContact CG2-CG2 4.09Å; W1549-V1558 PolarHBondContact N-O 3.3Å; W1549-V1558 PolarHBondContact O-N 3.28Å; Y1556-V1558 HydrophobicContact CD1-CG2 3.86Å; Y1556-V1558 HydrophobicContact CE1-CG2 3.62Å; V1558-C1562 HydrophobicContact CG1-CB 3.75Å; V1558-W1609 HydrophobicContact CG1-CH2 4.23Å; V1558-W1609 HydrophobicContact CG1-CZ2 3.87Å; V1558-W1609 HydrophobicContact CG2-CH2 4.21Å; V1558-W1609 HydrophobicContact CG2-CZ2 4.45Å; V1558-L1624 HydrophobicContact CB-CD1 4.43Å; V1558-L1624 HydrophobicContact CG2-CD1 4Å
1559	C	91.7	Very high	87	Confident	7 Å²	7	31.3 Å²	31.3	5%	0.047	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	161.2	172.1	64.3	0	0	0	0	111.8	C1537 D1561 L1563	C1537-C1559 HydrophobicContact CB-CB 4.16Å; C1537-C1559 PolarHBondContact SG-N 2.91Å; C1537-C1559 VanDerWaalsContact SG-N 3.35Å; C1559-D1561 PolarHBondContact O-N 2.93Å; C1559-L1563 PolarHBondContact O-N 3.04Å; C1559-L1563 VanDerWaalsContact O-N 3.17Å
1560	T	89.6	Confident	85.2	Confident	22 Å²	22	35.1 Å²	35.1	14%	0.135	19%	0.193	C	C	.	.	H	α-helix	trans	-55.8	-37.1	178.6	-62.4	0	0	0	0	112.5	L1563 N1564	T1560-L1563 WeakPolarHBondContact O-CB 3.45Å; T1560-L1563 PolarHBondContact O-N 2.92Å; T1560-N1564 PolarHBondContact O-N 3.14Å; T1560-N1564 PolarHBondContact O-ND2 2.63Å
1561	D	88.3	Confident	83.4	Confident	55 Å²	55	39.7 Å²	39.7	29%	0.294	23%	0.226	S	C	.	.	H	α-helix	trans	-71.4	-50.3	-174.6	-46.2	-68.3	0	0	0	112.1	C1559 L1563 N1564 E1565	C1559-D1561 PolarHBondContact O-N 2.93Å; D1561-L1563 PolarHBondContact O-N 3.41Å; D1561-N1564 WeakPolarHBondContact O-CB 3.43Å; D1561-N1564 PolarHBondContact O-N 3.4Å; D1561-E1565 WeakPolarHBondContact O-CG 3.47Å; D1561-E1565 PolarHBondContact O-N 3.24Å
1562	C	91.2	Very high	81.3	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-24.8	174	-77.6	0	0	0	0	113.5	V1539 V1558 E1565 S1566 W1609 R2209	V1539-C1562 HydrophobicContact CB-CB 4.07Å; V1539-C1562 HydrophobicContact CG1-CB 3.99Å; V1558-C1562 HydrophobicContact CG1-CB 3.75Å; C1562-E1565 PolarHBondContact SG-OE2 3.17Å; C1562-S1566 WeakPolarHBondContact O-CB 3.23Å; C1562-S1566 PolarHBondContact O-N 2.92Å; C1562-S1566 VanDerWaalsContact O-N 3.17Å; C1562-W1609 WeakPolarHBondContact O-CZ2 3.46Å; C1562-R2209 PolarHBondContact SG-NH2 3.48Å
1563	L	90.9	Very high	78.9	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-67.7	-44.5	169	-174.4	75	0	0	0	111.3	W1549 C1559 T1560 D1561 S1566 K1567 W1609 P1621 L1624	W1549-L1563 HydrophobicContact CB-CD2 4.46Å; W1549-L1563 HydrophobicContact CD2-CD2 3.54Å; W1549-L1563 VanDerWaalsContact CE2-CD2 3.42Å; W1549-L1563 HydrophobicContact CE3-CD2 4.23Å; W1549-L1563 HydrophobicContact CG-CD2 3.63Å; W1549-L1563 HydrophobicContact CZ2-CD2 4.01Å; C1559-L1563 PolarHBondContact O-N 3.04Å; C1559-L1563 VanDerWaalsContact O-N 3.17Å; T1560-L1563 WeakPolarHBondContact O-CB 3.45Å; T1560-L1563 PolarHBondContact O-N 2.92Å; D1561-L1563 PolarHBondContact O-N 3.41Å; L1563-S1566 PolarHBondContact O-N 3.22Å; L1563-K1567 HydrophobicContact CD2-CD 4.4Å; L1563-K1567 HydrophobicContact CG-CD 4.15Å; L1563-K1567 HydrophobicContact CG-CG 4.46Å; L1563-K1567 WeakPolarHBondContact O-CG 3.31Å; L1563-K1567 PolarHBondContact O-N 3.41Å; L1563-W1609 HydrophobicContact CD1-CH2 4.07Å; L1563-P1621 HydrophobicContact CD1-CB 3.8Å; L1563-L1624 HydrophobicContact CD1-CD1 4Å
1564	N	88.4	Confident	76.1	Confident	83 Å²	83	43.8 Å²	43.8	44%	0.444	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-41	-178.5	-68.2	-24	0	0	0	111.7	T1560 D1561 S1566 K1567 S1568	T1560-N1564 PolarHBondContact O-N 3.14Å; T1560-N1564 PolarHBondContact O-ND2 2.63Å; D1561-N1564 WeakPolarHBondContact O-CB 3.43Å; D1561-N1564 PolarHBondContact O-N 3.4Å; N1564-S1566 VanDerWaalsContact C-N 3.33Å; N1564-S1566 PolarHBondContact O-N 2.78Å; N1564-K1567 PolarHBondContact O-N 3.02Å; N1564-S1568 WeakPolarHBondContact O-CB 3.31Å; N1564-S1568 PolarHBondContact O-N 3.45Å; N1564-S1568 PolarHBondContact O-OG 2.88Å
1565	E	86.5	Confident	73.4	Confident	87 Å²	87	48.2 Å²	48.2	41%	0.407	32%	0.319	S	S	.	.	H	α-helix	trans	-57.5	-43	169.5	-71.1	156.3	-157.4	0	0	112.4	D1561 C1562 S1568 S1569 R2209	D1561-E1565 WeakPolarHBondContact O-CG 3.47Å; D1561-E1565 PolarHBondContact O-N 3.24Å; C1562-E1565 PolarHBondContact SG-OE2 3.17Å; E1565-S1568 WeakPolarHBondContact CA-OG 3.24Å; E1565-S1568 PolarHBondContact O-OG 3.28Å; E1565-S1569 VanDerWaalsContact O-CB 3.26Å; E1565-S1569 WeakPolarHBondContact O-CB 3.16Å; E1565-S1569 PolarHBondContact O-N 2.9Å; E1565-S1569 PolarHBondContact O-OG 2.79Å; E1565-R2209 IonicContact OE1-CZ 3.4Å; E1565-R2209 IonicContact OE1-NH1 3.81Å; E1565-R2209 IonicContact OE1-NH2 2.7Å; E1565-R2209 PolarHBondContact OE1-NH2 2.59Å; E1565-R2209 IonicContact OE2-NH2 3.19Å
1566	S	85.6	Confident	70.8	Confident	16 Å²	16	54.6 Å²	54.6	11%	0.112	35%	0.353	C	S	.	.	H	α-helix	trans	-70.7	-37	178	-168	0	0	0	0	112.5	C1562 L1563 N1564 N1570 W1609 P1621	C1562-S1566 WeakPolarHBondContact O-CB 3.23Å; C1562-S1566 PolarHBondContact O-N 2.92Å; C1562-S1566 VanDerWaalsContact O-N 3.17Å; L1563-S1566 PolarHBondContact O-N 3.22Å; N1564-S1566 VanDerWaalsContact C-N 3.33Å; N1564-S1566 PolarHBondContact O-N 2.78Å; S1566-N1570 PolarHBondContact O-N 2.99Å; S1566-N1570 PolarHBondContact O-ND2 2.9Å; S1566-W1609 WeakPolarHBondContact OG-CZ2 3.28Å; S1566-P1621 VanDerWaalsContact OG-CG 3.26Å; S1566-P1621 WeakPolarHBondContact OG-CG 3.42Å
1567	K	82.4	Confident	67.9	Low	69 Å²	69	61.2 Å²	61.2	30%	0.3	39%	0.388	S	S	.	.	H	α-helix	trans	-65.6	-51.6	174.8	-77	176.3	175.3	176.4	0	111.5	L1563 N1564 S1569 N1570 S1571 P1621	L1563-K1567 HydrophobicContact CD2-CD 4.4Å; L1563-K1567 HydrophobicContact CG-CD 4.15Å; L1563-K1567 HydrophobicContact CG-CG 4.46Å; L1563-K1567 WeakPolarHBondContact O-CG 3.31Å; L1563-K1567 PolarHBondContact O-N 3.41Å; N1564-K1567 PolarHBondContact O-N 3.02Å; K1567-S1569 VanDerWaalsContact C-N 3.29Å; K1567-S1569 PolarHBondContact O-N 2.68Å; K1567-N1570 PolarHBondContact O-N 2.83Å; K1567-S1571 PolarHBondContact O-N 2.7Å; K1567-S1571 PolarHBondContact O-OG 2.91Å; K1567-P1621 HydrophobicContact CG-CB 4.16Å
1568	S	78.3	Confident	65.1	Low	53 Å²	53	67.5 Å²	67.5	37%	0.371	42%	0.422	S	S	.	.	H	α-helix	trans	-60.5	-35.1	176.7	52.2	0	0	0	0	113.2	N1564 E1565 N1570 S1571 V1572	N1564-S1568 WeakPolarHBondContact O-CB 3.31Å; N1564-S1568 PolarHBondContact O-N 3.45Å; N1564-S1568 PolarHBondContact O-OG 2.88Å; E1565-S1568 WeakPolarHBondContact CA-OG 3.24Å; E1565-S1568 PolarHBondContact O-OG 3.28Å; S1568-N1570 VanDerWaalsContact C-N 3.27Å; S1568-N1570 PolarHBondContact O-N 3.36Å; S1568-S1571 WeakPolarHBondContact CA-OG 3.49Å; S1568-S1571 PolarHBondContact O-OG 2.85Å; S1568-V1572 WeakPolarHBondContact O-CG2 3.37Å
1569	S	69.5	Low	62.3	Low	86 Å²	86	72.3 Å²	72.3	60%	0.601	45%	0.451	S	S	*	.	H	α-helix	trans	-66.2	-25.1	172.9	-63.3	0	0	0	0	113.9	E1565 K1567	E1565-S1569 VanDerWaalsContact O-CB 3.26Å; E1565-S1569 WeakPolarHBondContact O-CB 3.16Å; E1565-S1569 PolarHBondContact O-N 2.9Å; E1565-S1569 PolarHBondContact O-OG 2.79Å; K1567-S1569 VanDerWaalsContact C-N 3.29Å; K1567-S1569 PolarHBondContact O-N 2.68Å
1570	N	55.6	Low	59.4	Low	106 Å²	106	81 Å²	81	57%	0.567	48%	0.483	S	S	*	.	H	α-helix	trans	-91.3	-27.1	-177.4	-80.2	-58.3	0	0	0	113.5	S1566 K1567 S1568 V1572	S1566-N1570 PolarHBondContact O-N 2.99Å; S1566-N1570 PolarHBondContact O-ND2 2.9Å; K1567-N1570 PolarHBondContact O-N 2.83Å; S1568-N1570 VanDerWaalsContact C-N 3.27Å; S1568-N1570 PolarHBondContact O-N 3.36Å; N1570-V1572 PolarHBondContact O-N 3.2Å; N1570-V1572 VanDerWaalsContact O-N 3.1Å
1571	S	51.8	Low	56.6	Low	98 Å²	98	84.8 Å²	84.8	69%	0.685	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-8.7	174.6	36.3	0	0	0	0	114.7	K1567 S1568	K1567-S1571 PolarHBondContact O-N 2.7Å; K1567-S1571 PolarHBondContact O-OG 2.91Å; S1568-S1571 WeakPolarHBondContact CA-OG 3.49Å; S1568-S1571 PolarHBondContact O-OG 2.85Å
1572	V	47.5	Very low	53.8	Low	74 Å²	74	90.1 Å²	90.1	45%	0.448	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-15	-171.7	157.4	0	0	0	0	114.4	S1568 N1570	S1568-V1572 WeakPolarHBondContact O-CG2 3.37Å; N1570-V1572 PolarHBondContact O-N 3.2Å; N1570-V1572 VanDerWaalsContact O-N 3.1Å
1573	G	32.7	Very low	50.8	Low	76 Å²	76	95.6 Å²	95.6	78%	0.784	56%	0.558	S	S	*	*	S	Bend	trans	-120	51.7	-164.9	0	0	0	0	0	116.2
1574	G	27.2	Very low	47.8	Very low	77 Å²	77	103.2 Å²	103.2	79%	0.794	59%	0.591	S	S	*	*			trans	-150.2	13.4	-162.8	0	0	0	0	0	121.9
1575	S	28.2	Very low	44.8	Very low	95 Å²	95	106 Å²	106	66%	0.664	60%	0.6	S	S	*	*	S	Bend	trans	-152.1	145.8	173.1	54.2	0	0	0	0	115.7
1576	N	28.9	Very low	42	Very low	135 Å²	135	105.2 Å²	105.2	72%	0.722	60%	0.598	S	S	*	*			trans	50.2	106	168.1	-65.5	-8	0	0	0	119.9
1577	L	29.3	Very low	39.4	Very low	143 Å²	143	108.8 Å²	108.8	75%	0.749	61%	0.613	S	S	*	*			trans	-152.6	84.8	155.5	-173.2	100.2	0	0	0	111
1578	D	31.1	Very low	37.1	Very low	133 Å²	133	109.5 Å²	109.5	71%	0.711	62%	0.62	S	S	*	*			trans	-172.3	88.6	146.8	-116.4	-20.6	0	0	0	112.9
1579	T	34.2	Very low	34.8	Very low	101 Å²	101	109.6 Å²	109.6	62%	0.62	63%	0.629	S	S	*	*			trans	-145.9	104.9	145.9	15.5	0	0	0	0	110.5	V110	V110-T1579 VanDerWaalsContact CG2-O 3.31Å; V110-T1579 WeakPolarHBondContact CG2-O 3.18Å
1580	R	31	Very low	33	Very low	189 Å²	189	109.5 Å²	109.5	71%	0.713	63%	0.634	S	S	*	*			trans	-57.2	167.2	158.9	-71	-172	167.9	84.6	2.6	111.2
1581	D	29.5	Very low	31.8	Very low	101 Å²	101	110.3 Å²	110.3	54%	0.54	64%	0.643	S	S	.	*			cis	-172.3	148.6	-20.3	-97.1	-37.4	0	0	0	103
1582	H	30.3	Very low	30.8	Very low	167 Å²	167	114.7 Å²	114.7	77%	0.773	65%	0.652	S	S	*	*			trans	-170.5	155.3	140	-105.2	-69.5	0	0	0	111.4
1583	V	28.7	Very low	30.2	Very low	117 Å²	117	120.1 Å²	120.1	71%	0.709	67%	0.67	S	S	*	*			trans	-147.2	161.2	-160.7	-174.2	0	0	0	0	109.6
1584	K	26.4	Very low	30.1	Very low	162 Å²	162	124.6 Å²	124.6	70%	0.704	67%	0.668	S	S	*	*			trans	100.5	146.6	165.6	-59.5	-170	172.3	-171.5	0	115.2
1585	F	25.1	Very low	30.3	Very low	141 Å²	141	124.4 Å²	124.4	62%	0.618	67%	0.665	S	S	*	*			cis	-156	155.3	0.4	-117.9	1.7	0	0	0	109.3
1586	N	29.5	Very low	30.3	Very low	71 Å²	71	130 Å²	130	38%	0.38	68%	0.678	S	S	.	*			cis	-156.2	-49.9	-19.3	-156.5	41.3	0	0	0	113.9	T60	T60-N1586 WeakPolarHBondContact CB-O 3.36Å; T60-N1586 PolarHBondContact OG1-O 3.23Å
1587	E	30.9	Very low	30.4	Very low	91 Å²	91	131.1 Å²	131.1	43%	0.425	68%	0.683	S	S	.	*			trans	-154.2	-176.7	-154.3	67.3	-158.6	98.7	0	0	111	Q61 L62	Q61-E1587 VanDerWaalsContact CB-C 3.47Å; Q61-E1587 WeakPolarHBondContact CB-O 3.44Å; L62-E1587 PolarHBondContact N-O 3.48Å; L62-E1587 VanDerWaalsContact N-O 3.11Å; L62-E1587 VanDerWaalsContact O-O 3.12Å
1588	N	33	Very low	30.4	Very low	83 Å²	83	132.5 Å²	132.5	44%	0.444	68%	0.683	S	S	.	*			cis	-144.6	169.4	-3.7	-125.3	-26.6	0	0	0	107.9	Q61	Q61-N1588 VanDerWaalsContact CD-O 3.24Å; Q61-N1588 PolarHBondContact NE2-O 2.74Å; Q61-N1588 PolarHBondContact OE1-O 3.25Å
1589	G	30.4	Very low	30.3	Very low	55 Å²	55	136.5 Å²	136.5	57%	0.567	69%	0.69	S	S	*	*	S	Bend	cis	176.8	-169.4	3	0	0	0	0	0	111.9
1590	A	32	Very low	30	Very low	85 Å²	85	137.7 Å²	137.7	70%	0.702	69%	0.691	S	S	*	*			cis	-148.9	128.9	-3.7	0	0	0	0	0	112.2
1591	V	29.3	Very low	29.9	Very low	122 Å²	122	138.4 Å²	138.4	74%	0.739	69%	0.694	S	S	*	*			trans	31	107.9	149.6	-169.1	0	0	0	0	119.5
1592	E	31.4	Very low	29.8	Very low	191 Å²	191	137.1 Å²	137.1	89%	0.893	70%	0.704	S	S	*	*				-139.7	170.3	127.3	-133.8	179.9	-158.1	0	0	112
1593	K	34.9	Very low	29.8	Very low	188 Å²	188	141.7 Å²	141.7	82%	0.817	72%	0.715	S	S	*	*			trans	-103.4	114.4	-147	-63.6	161.4	-174.4	156.2	0	114	G1595	K1593-G1595 PolarHBondContact O-N 3.29Å
1594	K	31.6	Very low	29.8	Very low	170 Å²	170	138.6 Å²	138.6	74%	0.739	71%	0.706	S	S	*	*			trans	-68.9	128.1	162.8	-89.8	-166.8	175.9	-178.7	0	111.2	V57	V57-K1594 HydrophobicContact CG1-CD 4.07Å
1595	G	31.2	Very low	30.3	Very low	72 Å²	72	134.2 Å²	134.2	74%	0.742	70%	0.695	S	S	*	*			trans	-68.4	161	165.8	0	0	0	0	0	112.4	K1593 L1597	K1593-G1595 PolarHBondContact O-N 3.29Å; G1595-L1597 PolarHBondContact O-N 3.42Å
1596	K	27.7	Very low	31.3	Very low	212 Å²	212	131.2 Å²	131.2	92%	0.922	69%	0.69	S	S	*	*			trans	-74.4	105.9	-176.9	-64.7	170.2	-177.5	169.2	0	111.5	K1598	K1596-K1598 PolarHBondContact O-N 3.37Å
1597	L	32	Very low	32.3	Very low	159 Å²	159	137.4 Å²	137.4	83%	0.832	71%	0.709	S	S	*	*			trans	-85.5	102.7	162.8	-155.9	75.9	0	0	0	109.7	G1595	G1595-L1597 PolarHBondContact O-N 3.42Å
1598	K	28	Very low	33.7	Very low	172 Å²	172	135 Å²	135	75%	0.748	71%	0.709	S	S	*	*			trans	-86.6	107.2	162.6	-85.9	-175.1	173.8	-178.4	0	108.3	K1596	K1596-K1598 PolarHBondContact O-N 3.37Å
1599	Y	28.5	Very low	35.9	Very low	218 Å²	218	132.3 Å²	132.3	86%	0.855	69%	0.693	S	S	*	*			trans	-133	143.7	148.4	-94.3	-75.5	0	0	0	109.8
1600	I	29	Very low	38.3	Very low	126 Å²	126	131.4 Å²	131.4	65%	0.646	68%	0.68	S	S	*	*			trans	-142	124.8	-161.1	-64.7	177	0	0	0	108.4
1601	R	28.7	Very low	40.8	Very low	204 Å²	204	129.7 Å²	129.7	77%	0.77	66%	0.663	S	S	*	*			trans	51.4	74.6	163.4	-61.4	174.8	-177.8	-177.8	-2.1	116.5
1602	G	26.4	Very low	43.6	Very low	74 Å²	74	124 Å²	124	76%	0.763	63%	0.629	S	S	*	*	S	Bend	trans	-72.6	151.1	137.9	0	0	0	0	0	109.7
1603	R	31.5	Very low	46	Very low	263 Å²	263	117.8 Å²	117.8	99%	0.992	60%	0.604	S	S	*	*	S	Bend	trans	46.3	66.9	179.9	-67.5	-164	-96.3	-138.4	-1.1	114.9
1604	G	28.7	Very low	48.1	Very low	52 Å²	52	113.1 Å²	113.1	54%	0.536	59%	0.591	S	S	.	*			trans	-174.4	31.9	177.7	0	0	0	0	0	116
1605	C	35.8	Very low	50.6	Low	69 Å²	69	107.3 Å²	107.3	47%	0.466	57%	0.57	S	S	.	*	S	Bend	trans	-155.7	132.9	178.3	-167.2	0	0	0	0	109.3	Y1607	C1605-Y1607 VanDerWaalsContact C-N 3.27Å; C1605-Y1607 HydrophobicContact CB-CD2 3.79Å; C1605-Y1607 HydrophobicContact CB-CE2 3.55Å; C1605-Y1607 PolarHBondContact O-N 2.88Å; C1605-Y1607 WeakPolarHBondContact SG-CE2 3.44Å
1606	P	47.9	Very low	53	Low	78 Å²	78	113.8 Å²	113.8	51%	0.506	57%	0.572	S	S	.	*			trans	-83.7	58.7	-164.1	35.5	-39.3	0	0	0	113.1	G1608 W1609	P1606-G1608 VanDerWaalsContact C-N 3.28Å; P1606-G1608 PolarHBondContact O-N 3.47Å; P1606-W1609 HydrophobicContact CB-CB 4.24Å; P1606-W1609 PolarHBondContact O-N 3.19Å; P1606-W1609 VanDerWaalsContact O-N 3.07Å
1607	Y	49.4	Very low	55.7	Low	201 Å²	201	110 Å²	110	79%	0.788	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-20.3	-172	-79.1	-68.8	0	0	0	115.3	C1605	C1605-Y1607 VanDerWaalsContact C-N 3.27Å; C1605-Y1607 HydrophobicContact CB-CD2 3.79Å; C1605-Y1607 HydrophobicContact CB-CE2 3.55Å; C1605-Y1607 PolarHBondContact O-N 2.88Å; C1605-Y1607 WeakPolarHBondContact SG-CE2 3.44Å
1608	G	60.4	Low	58.2	Low	41 Å²	41	108.4 Å²	108.4	42%	0.423	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-15.8	170.7	0	0	0	0	0	115	Y1556 P1606 A1610	Y1556-G1608 PolarHBondContact OH-O 3Å; Y1556-G1608 VanDerWaalsContact OH-O 3.12Å; P1606-G1608 VanDerWaalsContact C-N 3.28Å; P1606-G1608 PolarHBondContact O-N 3.47Å; G1608-A1610 PolarHBondContact O-N 3.14Å
1609	W	80.3	Confident	60.9	Low	26 Å²	26	100.9 Å²	100.9	10%	0.098	51%	0.513	C	S	.	.			trans	-94	93.8	-174	-82.2	63.6	0	0	0	111.8	V1539 V1558 C1562 L1563 S1566 P1606 H1618 H1619 P1621 L1624	V1539-W1609 HydrophobicContact CG2-CD2 4.36Å; V1539-W1609 HydrophobicContact CG2-CG 4.35Å; V1539-W1609 HydrophobicContact CG2-CZ2 4.43Å; V1558-W1609 HydrophobicContact CG1-CH2 4.23Å; V1558-W1609 HydrophobicContact CG1-CZ2 3.87Å; V1558-W1609 HydrophobicContact CG2-CH2 4.21Å; V1558-W1609 HydrophobicContact CG2-CZ2 4.45Å; C1562-W1609 WeakPolarHBondContact O-CZ2 3.46Å; L1563-W1609 HydrophobicContact CD1-CH2 4.07Å; S1566-W1609 WeakPolarHBondContact OG-CZ2 3.28Å; P1606-W1609 HydrophobicContact CB-CB 4.24Å; P1606-W1609 PolarHBondContact O-N 3.19Å; P1606-W1609 VanDerWaalsContact O-N 3.07Å; W1609-H1618 PolarHBondContact O-ND1 3.47Å; W1609-H1618 VanDerWaalsContact O-ND1 3.16Å; W1609-H1619 HydrophobicContact CE3-CB 3.94Å; W1609-H1619 HydrophobicContact CZ3-CB 3.98Å; W1609-P1621 HydrophobicContact CH2-CB 4.39Å; W1609-P1621 HydrophobicContact CH2-CG 4.07Å; W1609-P1621 HydrophobicContact CZ3-CG 4Å; W1609-L1624 HydrophobicContact CH2-CD1 3.93Å; W1609-L1624 HydrophobicContact CZ3-CD1 4.04Å
1610	A	80.2	Confident	63.7	Low	36 Å²	36	93.1 Å²	93.1	30%	0.298	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-59.4	149.6	179.6	0	0	0	0	0	112.5	Y1556 G1608 H1619	Y1556-A1610 HydrophobicContact CD2-CB 4.32Å; Y1556-A1610 HydrophobicContact CE2-CB 3.6Å; Y1556-A1610 PolarHBondContact OH-N 3.1Å; G1608-A1610 PolarHBondContact O-N 3.14Å; A1610-H1619 PolarHBondContact O-CE1 3.3Å; A1610-H1619 PolarHBondContact O-ND1 3.35Å
1611	S	85.1	Confident	66.4	Low	50 Å²	50	87.6 Å²	87.6	35%	0.35	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-70.5	138.4	170.6	64.2	0	0	0	0	111.2	T1613 Q1617	S1611-T1613 PolarHBondContact O-N 2.7Å; S1611-T1613 VanDerWaalsContact O-N 3.13Å; S1611-Q1617 CarbonylContact C-O 3.53Å; S1611-Q1617 WeakPolarHBondContact CA-O 3.18Å
1612	C	87.5	Confident	69	Low	3 Å²	3	83.8 Å²	83.8	2%	0.02	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-53.3	118.4	171	-175.3	0	0	0	0	110.2	T1614 T1615 R1616 Q1617 H1619	C1612-T1614 PolarHBondContact O-N 3.39Å; C1612-T1614 VanDerWaalsContact O-N 3.17Å; C1612-T1615 WeakPolarHBondContact CB-OG1 3.49Å; C1612-T1615 PolarHBondContact O-N 2.97Å; C1612-R1616 WeakPolarHBondContact O-CA 3.49Å; C1612-R1616 PolarHBondContact O-N 2.91Å; C1612-Q1617 PolarHBondContact N-O 2.57Å; C1612-H1619 VanDerWaalsContact CA-CE1 3.43Å; C1612-H1619 WeakPolarHBondContact CA-CE1 3.32Å; C1612-H1619 VanDerWaalsContact CA-NE2 3.32Å; C1612-H1619 WeakPolarHBondContact CA-NE2 3.37Å; C1612-H1619 VanDerWaalsContact CB-NE2 3.31Å; C1612-H1619 WeakPolarHBondContact CB-NE2 3.37Å; C1612-H1619 PolarHBondContact N-CE1 3.3Å
1613	T	81.1	Confident	71.9	Confident	59 Å²	59	87.5 Å²	87.5	36%	0.362	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.6	-177.8	48	0	0	0	0	112.2	V1410 S1611	V1410-T1613 HydrophobicContact CB-CG2 4.27Å; V1410-T1613 HydrophobicContact CG2-CG2 4.09Å; S1611-T1613 PolarHBondContact O-N 2.7Å; S1611-T1613 VanDerWaalsContact O-N 3.13Å
1614	T	79.3	Confident	74.7	Confident	91 Å²	91	75.7 Å²	75.7	56%	0.558	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-39.7	-179.9	-49.2	0	0	0	0	113.8	K1553 C1612	K1553-T1614 WeakPolarHBondContact O-CB 3.35Å; K1553-T1614 PolarHBondContact O-OG1 3.28Å; C1612-T1614 PolarHBondContact O-N 3.39Å; C1612-T1614 VanDerWaalsContact O-N 3.17Å
1615	T	83.9	Confident	77.7	Confident	48 Å²	48	74.2 Å²	74.2	29%	0.294	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-12.5	-177.1	67.4	0	0	0	0	114.6	K1553 C1612 Q1617	K1553-T1615 HydrophobicContact CD-CG2 3.67Å; C1612-T1615 WeakPolarHBondContact CB-OG1 3.49Å; C1612-T1615 PolarHBondContact O-N 2.97Å; T1615-Q1617 PolarHBondContact O-N 3.48Å; T1615-Q1617 VanDerWaalsContact O-N 3.15Å; T1615-Q1617 PolarHBondContact OG1-N 3.27Å
1616	R	83	Confident	80.4	Confident	207 Å²	207	71.7 Å²	71.7	78%	0.781	37%	0.367	S	S	*	.	S	Bend	trans	58.2	13.9	-171	-54.2	-62.3	-176	135.8	2.8	115	C1612	C1612-R1616 WeakPolarHBondContact O-CA 3.49Å; C1612-R1616 PolarHBondContact O-N 2.91Å
1617	Q	82.7	Confident	82.4	Confident	133 Å²	133	68 Å²	68	62%	0.621	34%	0.343	S	S	*	.	S	Bend	trans	-100.3	157.2	173.1	-64.8	170.2	-28.4	0	0	109.8	S1611 C1612 T1615	S1611-Q1617 CarbonylContact C-O 3.53Å; S1611-Q1617 WeakPolarHBondContact CA-O 3.18Å; C1612-Q1617 PolarHBondContact N-O 2.57Å; T1615-Q1617 PolarHBondContact O-N 3.48Å; T1615-Q1617 VanDerWaalsContact O-N 3.15Å; T1615-Q1617 PolarHBondContact OG1-N 3.27Å
1618	H	84.6	Confident	84.4	Confident	125 Å²	125	58.6 Å²	58.6	58%	0.579	31%	0.307	S	S	*	.	B	Isolated β-bridge	trans	-59.9	150	168.2	-71	-83.7	0	0	0	110.8	W1609 D1620	W1609-H1618 PolarHBondContact O-ND1 3.47Å; W1609-H1618 VanDerWaalsContact O-ND1 3.16Å; H1618-D1620 PolarHBondContact O-N 2.89Å
1619	H	86.3	Confident	85.7	Confident	14 Å²	14	57 Å²	57	7%	0.065	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-66.4	121.4	171.8	-67.6	107.5	0	0	0	109.7	C1551 C1554 Y1556 W1609 A1610 C1612 P1621 L1624	C1551-H1619 VanDerWaalsContact CB-CD2 3.49Å; C1551-H1619 WeakPolarHBondContact CB-CD2 3.47Å; C1551-H1619 WeakPolarHBondContact CB-NE2 3.33Å; C1551-H1619 PolarHBondContact SG-CD2 3.3Å; C1551-H1619 PolarHBondContact SG-NE2 3.16Å; C1554-H1619 PolarHBondContact SG-NE2 2.7Å; C1554-H1619 VanDerWaalsContact SG-NE2 3.4Å; Y1556-H1619 WeakPolarHBondContact CB-CE1 3.17Å; Y1556-H1619 AromaticContact CD1-CE1 3.4Å; Y1556-H1619 VanDerWaalsContact CD1-CE1 3.4Å; Y1556-H1619 WeakPolarHBondContact CD1-CE1 3.4Å; Y1556-H1619 AromaticContact CD1-CG 3.82Å; Y1556-H1619 AromaticContact CD1-ND1 3.25Å; Y1556-H1619 WeakPolarHBondContact CD1-ND1 3.39Å; Y1556-H1619 AromaticContact CD2-CE1 3.88Å; Y1556-H1619 AromaticContact CE1-ND1 3.56Å; Y1556-H1619 AromaticContact CG-CE1 3.27Å; Y1556-H1619 AromaticContact CG-ND1 3.63Å; Y1556-H1619 AromaticContact CG-NE2 3.97Å; W1609-H1619 HydrophobicContact CE3-CB 3.94Å; W1609-H1619 HydrophobicContact CZ3-CB 3.98Å; A1610-H1619 PolarHBondContact O-CE1 3.3Å; A1610-H1619 PolarHBondContact O-ND1 3.35Å; C1612-H1619 VanDerWaalsContact CA-CE1 3.43Å; C1612-H1619 WeakPolarHBondContact CA-CE1 3.32Å; C1612-H1619 VanDerWaalsContact CA-NE2 3.32Å; C1612-H1619 WeakPolarHBondContact CA-NE2 3.37Å; C1612-H1619 VanDerWaalsContact CB-NE2 3.31Å; C1612-H1619 WeakPolarHBondContact CB-NE2 3.37Å; C1612-H1619 PolarHBondContact N-CE1 3.3Å; H1619-P1621 WeakPolarHBondContact O-CD 3.49Å; H1619-L1624 HydrophobicContact CB-CD2 4.31Å
1620	D	85.7	Confident	86.1	Confident	56 Å²	56	55.8 Å²	55.8	30%	0.299	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-78.3	118.9	170.4	177.1	-16.9	0	0	0	108.2	H1618 N1622 K1623	H1618-D1620 PolarHBondContact O-N 2.89Å; D1620-N1622 PolarHBondContact O-N 2.94Å; D1620-N1622 VanDerWaalsContact O-N 3.09Å; D1620-N1622 WeakPolarHBondContact OD1-CB 3.21Å; D1620-N1622 PolarHBondContact OD1-N 3.4Å; D1620-K1623 HydrophobicContact CB-CB 4.12Å; D1620-K1623 HydrophobicContact CB-CD 4.15Å; D1620-K1623 HydrophobicContact CB-CG 4.16Å; D1620-K1623 PolarHBondContact O-N 3.4Å; D1620-K1623 WeakPolarHBondContact OD2-CD 3.36Å; D1620-K1623 IonicContact OD2-NZ 3.82Å; D1620-K1623 PolarHBondContact OD2-NZ 3.47Å
1621	P	85.3	Confident	86.3	Confident	10 Å²	10	54.3 Å²	54.3	7%	0.065	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-53.9	-28.7	179.7	-29.1	37.7	0	0	0	113.9	L1563 S1566 K1567 W1609 H1619 K1623	L1563-P1621 HydrophobicContact CD1-CB 3.8Å; S1566-P1621 VanDerWaalsContact OG-CG 3.26Å; S1566-P1621 WeakPolarHBondContact OG-CG 3.42Å; K1567-P1621 HydrophobicContact CG-CB 4.16Å; W1609-P1621 HydrophobicContact CH2-CB 4.39Å; W1609-P1621 HydrophobicContact CH2-CG 4.07Å; W1609-P1621 HydrophobicContact CZ3-CG 4Å; H1619-P1621 WeakPolarHBondContact O-CD 3.49Å; P1621-K1623 VanDerWaalsContact C-N 3.31Å
1622	N	85.3	Confident	85.8	Confident	124 Å²	124	54.6 Å²	54.6	66%	0.663	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-89.8	6	-178.8	-58	-29.2	0	0	0	112.8	D1620	D1620-N1622 PolarHBondContact O-N 2.94Å; D1620-N1622 VanDerWaalsContact O-N 3.09Å; D1620-N1622 WeakPolarHBondContact OD1-CB 3.21Å; D1620-N1622 PolarHBondContact OD1-N 3.4Å
1623	K	86.5	Confident	85.5	Confident	152 Å²	152	56.6 Å²	56.6	66%	0.661	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-125.6	15.1	174.9	-61.7	-179.1	176.5	60.3	0	113	D1620 P1621	D1620-K1623 HydrophobicContact CB-CB 4.12Å; D1620-K1623 HydrophobicContact CB-CD 4.15Å; D1620-K1623 HydrophobicContact CB-CG 4.16Å; D1620-K1623 PolarHBondContact O-N 3.4Å; D1620-K1623 WeakPolarHBondContact OD2-CD 3.36Å; D1620-K1623 IonicContact OD2-NZ 3.82Å; D1620-K1623 PolarHBondContact OD2-NZ 3.47Å; P1621-K1623 VanDerWaalsContact C-N 3.31Å
1624	L	90.3	Very high	85.8	Confident	14 Å²	14	53.9 Å²	53.9	7%	0.073	28%	0.278	C	S	.	.	S	Bend	trans	-82.1	156.5	163.3	-60.1	179.7	0	0	0	109.4	W1549 C1551 V1558 L1563 W1609 H1619	W1549-L1624 HydrophobicContact CB-CB 4.02Å; W1549-L1624 HydrophobicContact CB-CD1 4.08Å; W1549-L1624 HydrophobicContact CE3-CB 3.95Å; W1549-L1624 WeakPolarHBondContact CZ3-O 3.49Å; C1551-L1624 HydrophobicContact CB-CD2 3.69Å; V1558-L1624 HydrophobicContact CB-CD1 4.43Å; V1558-L1624 HydrophobicContact CG2-CD1 4Å; L1563-L1624 HydrophobicContact CD1-CD1 4Å; W1609-L1624 HydrophobicContact CH2-CD1 3.93Å; W1609-L1624 HydrophobicContact CZ3-CD1 4.04Å; H1619-L1624 HydrophobicContact CB-CD2 4.31Å
1625	L	90.3	Very high	86.3	Confident	21 Å²	21	50 Å²	50	11%	0.11	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.7	-179.4	-173.3	65.7	0	0	0	109.7	F1417 F1433 A1525 W1549 V1550 T1627	F1417-L1625 HydrophobicContact CE1-CD2 4.23Å; F1417-L1625 HydrophobicContact CZ-CD2 4.22Å; F1433-L1625 HydrophobicContact CD1-CD2 3.82Å; F1433-L1625 HydrophobicContact CD2-CD2 3.6Å; F1433-L1625 HydrophobicContact CE1-CD2 3.82Å; F1433-L1625 HydrophobicContact CE2-CD2 3.59Å; F1433-L1625 HydrophobicContact CG-CD2 3.71Å; F1433-L1625 HydrophobicContact CZ-CD2 3.7Å; A1525-L1625 HydrophobicContact CB-CD2 3.66Å; A1525-L1625 HydrophobicContact CB-CG 4.07Å; W1549-L1625 WeakPolarHBondContact CA-O 3.42Å; V1550-L1625 PolarHBondContact N-O 3.03Å; V1550-L1625 WeakPolarHBondContact O-CB 3.37Å; V1550-L1625 PolarHBondContact O-N 2.92Å; L1625-T1627 PolarHBondContact O-N 3.38Å; L1625-T1627 PolarHBondContact O-OG1 3.32Å
1626	L	92.6	Very high	86.5	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.084	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	130.1	174.2	176.8	60.6	0	0	0	109.9	N1487 V1524 A1525 W1549	N1487-L1626 HydrophobicContact CB-CD2 3.84Å; V1524-L1626 HydrophobicContact CG2-CD2 3.92Å; V1524-L1626 HydrophobicContact CG2-CG 4.31Å; A1525-L1626 PolarHBondContact N-O 2.75Å; W1549-L1626 HydrophobicContact CD2-CB 4.37Å; W1549-L1626 HydrophobicContact CD2-CD1 4.43Å; W1549-L1626 HydrophobicContact CE3-CB 4.28Å; W1549-L1626 HydrophobicContact CH2-CB 3.91Å; W1549-L1626 HydrophobicContact CZ2-CB 3.98Å; W1549-L1626 HydrophobicContact CZ2-CD1 3.92Å; W1549-L1626 HydrophobicContact CZ2-CG 4.36Å; W1549-L1626 HydrophobicContact CZ3-CB 4.07Å
1627	T	91.2	Very high	86.7	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.7	-170.4	-51.2	0	0	0	0	111.3	F1417 A1525 K1527 T1547 H1548 V1550 L1625	F1417-T1627 HydrophobicContact CD2-CG2 4.44Å; F1417-T1627 HydrophobicContact CE2-CG2 3.43Å; F1417-T1627 VanDerWaalsContact CE2-CG2 3.43Å; F1417-T1627 HydrophobicContact CZ-CG2 3.69Å; F1417-T1627 WeakPolarHBondContact CZ-OG1 3.41Å; A1525-T1627 CarbonylContact O-C 3.6Å; A1525-T1627 VanDerWaalsContact O-CA 3.24Å; A1525-T1627 WeakPolarHBondContact O-CA 3.49Å; K1527-T1627 HydrophobicContact CB-CG2 3.78Å; T1547-T1627 WeakPolarHBondContact CA-O 3.41Å; H1548-T1627 VanDerWaalsContact CE1-CG2 3.43Å; H1548-T1627 WeakPolarHBondContact CE1-CG2 3.33Å; H1548-T1627 PolarHBondContact N-O 2.86Å; H1548-T1627 PolarHBondContact ND1-O 2.94Å; H1548-T1627 WeakPolarHBondContact NE2-CG2 3.48Å; H1548-T1627 WeakPolarHBondContact O-CA 3.39Å; H1548-T1627 WeakPolarHBondContact O-CB 3.32Å; H1548-T1627 PolarHBondContact O-N 3.48Å; H1548-T1627 VanDerWaalsContact O-O 3.13Å; V1550-T1627 HydrophobicContact CG2-CG2 4.12Å; V1550-T1627 WeakPolarHBondContact CG2-OG1 3.19Å; L1625-T1627 PolarHBondContact O-N 3.38Å; L1625-T1627 PolarHBondContact O-OG1 3.32Å
1628	S	90.6	Very high	87.1	Confident	5 Å²	5	38.8 Å²	38.8	4%	0.035	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	148.5	175.2	-165.3	0	0	0	0	110.7	A1525 K1527 N1546 L1630	A1525-S1628 PolarHBondContact O-N 2.81Å; K1527-S1628 PolarHBondContact N-O 2.97Å; N1546-S1628 PolarHBondContact OD1-OG 3.15Å; S1628-L1630 PolarHBondContact OG-O 3.36Å
1629	L	87.7	Confident	87.5	Confident	7 Å²	7	33.8 Å²	33.8	4%	0.037	19%	0.189	C	C	.	.	S	Bend	trans	-96.8	-37.8	169.3	-67.7	171.7	0	0	0	111.1	W1447 W1526 K1527 E1535 M1544 F1545 N1546	W1447-L1629 HydrophobicContact CZ2-CB 4.39Å; W1526-L1629 PolarHBondContact NE1-O 2.66Å; K1527-L1629 HydrophobicContact CB-CD2 4.07Å; K1527-L1629 HydrophobicContact CD-CD2 4.22Å; K1527-L1629 HydrophobicContact CG-CD2 4.14Å; E1535-L1629 HydrophobicContact CB-CD1 4.26Å; E1535-L1629 HydrophobicContact CG-CD1 4.47Å; E1535-L1629 HydrophobicContact CG-CD2 4.37Å; M1544-L1629 WeakPolarHBondContact O-CD1 3.39Å; F1545-L1629 WeakPolarHBondContact O-CD1 3.47Å; N1546-L1629 PolarHBondContact OD1-N 3.39Å
1630	L	88.4	Confident	87.7	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.207	C	C	.	.	S	Bend	trans	-75.4	138.9	170.3	-80.1	80.8	0	0	0	110.6	W1447 F1545 N1546 S1628 I1634 I1635 F2229	W1447-L1630 HydrophobicContact CB-CG 4.49Å; W1447-L1630 HydrophobicContact CD2-CD1 4.19Å; W1447-L1630 HydrophobicContact CD2-CG 3.81Å; W1447-L1630 HydrophobicContact CE3-CD1 3.73Å; W1447-L1630 HydrophobicContact CE3-CD2 4.33Å; W1447-L1630 HydrophobicContact CE3-CG 3.73Å; W1447-L1630 HydrophobicContact CG-CG 4.17Å; W1447-L1630 HydrophobicContact CH2-CD1 4.07Å; W1447-L1630 HydrophobicContact CZ2-CD1 4.49Å; W1447-L1630 HydrophobicContact CZ3-CD1 3.68Å; W1447-L1630 HydrophobicContact CZ3-CG 4.21Å; F1545-L1630 HydrophobicContact CZ-CD1 4.29Å; N1546-L1630 HydrophobicContact CB-CD1 3.78Å; N1546-L1630 WeakPolarHBondContact OD1-CD1 3.23Å; N1546-L1630 PolarHBondContact OD1-N 2.89Å; S1628-L1630 PolarHBondContact OG-O 3.36Å; L1630-I1634 HydrophobicContact CD2-CG2 4.06Å; L1630-I1635 HydrophobicContact CD2-CG1 4.1Å; L1630-F2229 HydrophobicContact CD2-CE2 3.75Å; L1630-F2229 HydrophobicContact CD2-CZ 3.98Å
1631	P	84	Confident	88	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.032	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-57	161.8	161.7	-28.4	35.1	0	0	0	114.8	S1439 R1444 W1526 I1634	S1439-P1631 WeakPolarHBondContact OG-CB 3.36Å; R1444-P1631 HydrophobicContact CG-CB 4.33Å; R1444-P1631 HydrophobicContact CG-CG 4.24Å; W1526-P1631 HydrophobicContact CZ2-CG 4.12Å; P1631-I1634 HydrophobicContact CB-CD1 3.71Å; P1631-I1634 HydrophobicContact CB-CG1 4.29Å; P1631-I1634 HydrophobicContact CG-CD1 3.91Å
1632	S	76.6	Confident	88.4	Confident	56 Å²	56	38.4 Å²	38.4	39%	0.392	20%	0.204	S	C	.	.	S	Bend	trans	-71.7	150.5	-178.7	35.4	0	0	0	0	112.2	S1436 I1634	S1436-S1632 WeakPolarHBondContact CB-OG 3.49Å; S1436-S1632 WeakPolarHBondContact OG-CB 3.43Å; S1436-S1632 PolarHBondContact OG-OG 2.97Å; S1632-I1634 PolarHBondContact O-N 2.91Å
1633	G	81	Confident	88.9	Confident	45 Å²	45	34.5 Å²	34.5	46%	0.464	18%	0.182	S	C	.	.	S	Bend	trans	82.1	-31.9	-177.8	0	0	0	0	0	114.4	I1635 G1636 R1637	G1633-I1635 PolarHBondContact O-N 2.95Å; G1633-G1636 PolarHBondContact O-N 3Å; G1633-G1636 VanDerWaalsContact O-N 3.16Å; G1633-R1637 PolarHBondContact O-N 3.4Å
1634	I	86.9	Confident	89.3	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-56.7	-45.5	-175.3	-59.7	-174.3	0	0	0	112.3	R1444 W1447 E1448 L1630 P1631 S1632 G1636 R1637 L1638	R1444-I1634 HydrophobicContact CB-CD1 4.39Å; W1447-I1634 HydrophobicContact CB-CD1 3.83Å; W1447-I1634 HydrophobicContact CB-CG2 4.27Å; E1448-I1634 HydrophobicContact CG-CD1 3.73Å; E1448-I1634 HydrophobicContact CG-CG1 3.96Å; E1448-I1634 HydrophobicContact CG-CG2 4.33Å; L1630-I1634 HydrophobicContact CD2-CG2 4.06Å; P1631-I1634 HydrophobicContact CB-CD1 3.71Å; P1631-I1634 HydrophobicContact CB-CG1 4.29Å; P1631-I1634 HydrophobicContact CG-CD1 3.91Å; S1632-I1634 PolarHBondContact O-N 2.91Å; I1634-G1636 PolarHBondContact O-N 2.79Å; I1634-R1637 PolarHBondContact O-N 3.13Å; I1634-L1638 HydrophobicContact CG2-CD1 3.72Å; I1634-L1638 HydrophobicContact CG2-CG 4.18Å; I1634-L1638 WeakPolarHBondContact O-CB 3.48Å; I1634-L1638 WeakPolarHBondContact O-CG 3.38Å; I1634-L1638 PolarHBondContact O-N 2.98Å
1635	I	89.8	Confident	89.4	Confident	10 Å²	10	35.7 Å²	35.7	5%	0.051	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-46.3	179.6	-62.2	174.8	0	0	0	111.2	L1477 E1480 L1481 L1484 L1630 G1633 L1638 I1639	L1477-I1635 HydrophobicContact CB-CG2 4.04Å; L1477-I1635 HydrophobicContact CD2-CG2 4.33Å; E1480-I1635 HydrophobicContact CB-CD1 4.14Å; L1481-I1635 HydrophobicContact CB-CG2 4.07Å; L1484-I1635 HydrophobicContact CD1-CD1 3.99Å; L1630-I1635 HydrophobicContact CD2-CG1 4.1Å; G1633-I1635 PolarHBondContact O-N 2.95Å; I1635-L1638 PolarHBondContact O-N 3.38Å; I1635-I1639 HydrophobicContact CG2-CD1 4.01Å; I1635-I1639 VanDerWaalsContact O-CG1 3.32Å; I1635-I1639 WeakPolarHBondContact O-CG1 3.34Å; I1635-I1639 PolarHBondContact O-N 3.32Å
1636	G	87.2	Confident	89.7	Confident	37 Å²	37	34.8 Å²	34.8	38%	0.381	18%	0.178	S	C	.	.	H	α-helix	trans	-65.5	-43.9	177.3	0	0	0	0	0	112.6	G1633 I1634 L1638 I1639 H1640	G1633-G1636 PolarHBondContact O-N 3Å; G1633-G1636 VanDerWaalsContact O-N 3.16Å; I1634-G1636 PolarHBondContact O-N 2.79Å; G1636-L1638 VanDerWaalsContact C-N 3.32Å; G1636-L1638 PolarHBondContact O-N 3.46Å; G1636-I1639 PolarHBondContact O-N 2.88Å; G1636-H1640 PolarHBondContact O-N 3.06Å
1637	R	88.1	Confident	89.7	Confident	109 Å²	109	40.5 Å²	40.5	41%	0.411	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-39.6	175.5	-72.8	-160.2	-80.1	-114.3	7.7	112.2	E1448 G1633 I1634 R1641	E1448-R1637 IonicContact OE1-CZ 3.8Å; E1448-R1637 IonicContact OE1-NE 3.34Å; E1448-R1637 PolarHBondContact OE1-NE 2.8Å; E1448-R1637 IonicContact OE1-NH2 3.21Å; E1448-R1637 PolarHBondContact OE1-NH2 2.65Å; G1633-R1637 PolarHBondContact O-N 3.4Å; I1634-R1637 PolarHBondContact O-N 3.13Å; R1637-R1641 WeakPolarHBondContact O-CB 3.49Å; R1637-R1641 WeakPolarHBondContact O-CG 3.25Å; R1637-R1641 PolarHBondContact O-N 2.92Å
1638	L	90.6	Very high	89.8	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-70.9	-41.5	176.8	-71.9	173.1	0	0	0	112.5	M1449 F1473 L1477 I1634 I1635 G1636 H1640 R1641 L1642 F2229	M1449-L1638 HydrophobicContact CG-CD2 4.01Å; M1449-L1638 HydrophobicContact SD-CD2 3.85Å; F1473-L1638 HydrophobicContact CZ-CD1 4.49Å; L1477-L1638 HydrophobicContact CD1-CB 3.7Å; I1634-L1638 HydrophobicContact CG2-CD1 3.72Å; I1634-L1638 HydrophobicContact CG2-CG 4.18Å; I1634-L1638 WeakPolarHBondContact O-CB 3.48Å; I1634-L1638 WeakPolarHBondContact O-CG 3.38Å; I1634-L1638 PolarHBondContact O-N 2.98Å; I1635-L1638 PolarHBondContact O-N 3.38Å; G1636-L1638 VanDerWaalsContact C-N 3.32Å; G1636-L1638 PolarHBondContact O-N 3.46Å; L1638-H1640 VanDerWaalsContact C-N 3.33Å; L1638-H1640 PolarHBondContact O-N 2.85Å; L1638-R1641 PolarHBondContact O-N 3.29Å; L1638-L1642 WeakPolarHBondContact O-CB 3.28Å; L1638-L1642 PolarHBondContact O-N 2.71Å; L1638-F2229 HydrophobicContact CD1-CE2 3.44Å; L1638-F2229 VanDerWaalsContact CD1-CE2 3.44Å; L1638-F2229 HydrophobicContact CD1-CZ 3.67Å
1639	I	92.7	Very high	89.9	Confident	20 Å²	20	47.9 Å²	47.9	10%	0.103	24%	0.237	C	C	.	.	H	α-helix	trans	-58.3	-46.5	172.7	-69.2	167.7	0	0	0	110.2	L1477 L1481 I1635 G1636 H1643	L1477-I1639 HydrophobicContact CB-CD1 3.87Å; L1477-I1639 HydrophobicContact CB-CG1 3.65Å; L1477-I1639 HydrophobicContact CD1-CG1 3.74Å; L1477-I1639 HydrophobicContact CG-CG1 4.38Å; L1481-I1639 HydrophobicContact CD2-CD1 4.11Å; I1635-I1639 HydrophobicContact CG2-CD1 4.01Å; I1635-I1639 VanDerWaalsContact O-CG1 3.32Å; I1635-I1639 WeakPolarHBondContact O-CG1 3.34Å; I1635-I1639 PolarHBondContact O-N 3.32Å; G1636-I1639 PolarHBondContact O-N 2.88Å; I1639-H1643 PolarHBondContact O-N 3.5Å; I1639-H1643 PolarHBondContact O-ND1 3.14Å
1640	H	91.6	Very high	90.2	Very high	98 Å²	98	56.8 Å²	56.8	45%	0.454	28%	0.275	S	S	.	.	H	α-helix	trans	-65.3	-48.5	179.5	-178.6	-114.6	0	0	0	112.4	G1636 L1638 L1642 H1643 R1644	G1636-H1640 PolarHBondContact O-N 3.06Å; L1638-H1640 VanDerWaalsContact C-N 3.33Å; L1638-H1640 PolarHBondContact O-N 2.85Å; H1640-L1642 PolarHBondContact O-N 3.25Å; H1640-H1643 PolarHBondContact O-N 3.37Å; H1640-R1644 WeakPolarHBondContact O-CB 3.4Å; H1640-R1644 PolarHBondContact O-N 3.5Å
1641	R	90.8	Very high	90.5	Very high	79 Å²	79	57.9 Å²	57.9	30%	0.298	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-41.1	178.2	-75.1	-178.6	177.3	-169.8	-2.4	112.3	M1449 R1637 L1638 H1643 R1644 I1645	M1449-R1641 HydrophobicContact SD-CB 4.39Å; M1449-R1641 WeakPolarHBondContact SD-CD 3.43Å; R1637-R1641 WeakPolarHBondContact O-CB 3.49Å; R1637-R1641 WeakPolarHBondContact O-CG 3.25Å; R1637-R1641 PolarHBondContact O-N 2.92Å; L1638-R1641 PolarHBondContact O-N 3.29Å; R1641-H1643 PolarHBondContact O-N 3.25Å; R1641-R1644 PolarHBondContact O-N 3.39Å; R1641-I1645 HydrophobicContact CB-CD1 4.33Å; R1641-I1645 WeakPolarHBondContact O-CB 3.35Å; R1641-I1645 WeakPolarHBondContact O-CD1 3.28Å; R1641-I1645 VanDerWaalsContact O-CG1 3.26Å; R1641-I1645 WeakPolarHBondContact O-CG1 3.27Å; R1641-I1645 PolarHBondContact O-N 3.1Å
1642	L	94.6	Very high	90.9	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-54.3	-52.7	175.9	177	68.3	0	0	0	111.6	L1466 F1473 C1474 L1638 H1640 A1646 L1653 I2232 L2236	L1466-L1642 HydrophobicContact CD2-CD1 3.86Å; F1473-L1642 HydrophobicContact CD1-CD1 4.35Å; F1473-L1642 HydrophobicContact CD1-CD2 3.92Å; C1474-L1642 HydrophobicContact CB-CD2 3.73Å; L1638-L1642 WeakPolarHBondContact O-CB 3.28Å; L1638-L1642 PolarHBondContact O-N 2.71Å; H1640-L1642 PolarHBondContact O-N 3.25Å; L1642-A1646 WeakPolarHBondContact O-CB 3.33Å; L1642-A1646 PolarHBondContact O-N 2.67Å; L1642-L1653 HydrophobicContact CD1-CD1 4.45Å; L1642-L1653 HydrophobicContact CD1-CD2 4.03Å; L1642-L1653 HydrophobicContact CD2-CD1 4.41Å; L1642-L1653 HydrophobicContact CG-CD1 3.96Å; L1642-L1653 HydrophobicContact CG-CD2 4.41Å; L1642-I2232 HydrophobicContact CD1-CG2 4.25Å; L1642-L2236 HydrophobicContact CB-CD1 4.4Å; L1642-L2236 HydrophobicContact CD1-CD1 4.33Å; L1642-L2236 HydrophobicContact CD1-CD2 4.11Å
1643	H	96.1	Very high	91.7	Very high	43 Å²	43	62.1 Å²	62.1	20%	0.199	30%	0.299	C	S	.	.	H	α-helix	trans	-70.3	-38.5	-179.1	-64	100.1	0	0	0	112.5	C1474 I1639 H1640 R1641 N1647 C1655 C1657	C1474-H1643 PolarHBondContact SG-CE1 2.99Å; C1474-H1643 PolarHBondContact SG-NE2 3.4Å; I1639-H1643 PolarHBondContact O-N 3.5Å; I1639-H1643 PolarHBondContact O-ND1 3.14Å; H1640-H1643 PolarHBondContact O-N 3.37Å; R1641-H1643 PolarHBondContact O-N 3.25Å; H1643-N1647 VanDerWaalsContact O-CB 3.24Å; H1643-N1647 WeakPolarHBondContact O-CB 3.44Å; H1643-N1647 PolarHBondContact O-N 3.24Å; H1643-C1655 PolarHBondContact NE2-SG 2.97Å; H1643-C1655 VanDerWaalsContact NE2-SG 3.43Å; H1643-C1657 WeakPolarHBondContact NE2-CB 3.48Å
1644	R	94.1	Very high	91.9	Very high	179 Å²	179	63 Å²	63	68%	0.675	31%	0.307	S	S	*	.	H	α-helix	trans	-61.5	-46.6	176.5	-174.2	174.4	177.5	178.3	-1	111.8	H1640 R1641 Y1648	H1640-R1644 WeakPolarHBondContact O-CB 3.4Å; H1640-R1644 PolarHBondContact O-N 3.5Å; R1641-R1644 PolarHBondContact O-N 3.39Å; R1644-Y1648 WeakPolarHBondContact O-CB 3.25Å; R1644-Y1648 PolarHBondContact O-N 3.36Å; R1644-Y1648 VanDerWaalsContact O-N 3.08Å
1645	I	93.8	Very high	92.1	Very high	11 Å²	11	63.9 Å²	63.9	6%	0.056	31%	0.313	C	S	.	.	H	α-helix	trans	-69.4	-42.5	179.9	-67.3	162.8	0	0	0	111	M1449 L1466 R1641 Y1648 Y1649 L2236 L2239 L2240	M1449-I1645 HydrophobicContact CE-CD1 4.36Å; L1466-I1645 HydrophobicContact CD1-CG2 4.21Å; R1641-I1645 HydrophobicContact CB-CD1 4.33Å; R1641-I1645 WeakPolarHBondContact O-CB 3.35Å; R1641-I1645 WeakPolarHBondContact O-CD1 3.28Å; R1641-I1645 VanDerWaalsContact O-CG1 3.26Å; R1641-I1645 WeakPolarHBondContact O-CG1 3.27Å; R1641-I1645 PolarHBondContact O-N 3.1Å; I1645-Y1648 PolarHBondContact O-N 3.22Å; I1645-Y1649 HydrophobicContact CG2-CD2 3.88Å; I1645-Y1649 HydrophobicContact CG2-CE2 4.17Å; I1645-Y1649 WeakPolarHBondContact O-CD2 3.18Å; I1645-Y1649 PolarHBondContact O-N 3.06Å; I1645-L2236 HydrophobicContact CB-CD2 4.06Å; I1645-L2236 HydrophobicContact CD1-CB 4.11Å; I1645-L2236 HydrophobicContact CD1-CD2 3.71Å; I1645-L2236 HydrophobicContact CD1-CG 4.47Å; I1645-L2236 HydrophobicContact CG1-CD2 4.5Å; I1645-L2236 HydrophobicContact CG2-CD2 4.04Å; I1645-L2239 HydrophobicContact CG2-CB 3.89Å; I1645-L2239 HydrophobicContact CG2-CD1 4.2Å; I1645-L2240 HydrophobicContact CD1-CD1 4.43Å; I1645-L2240 HydrophobicContact CD1-CD2 3.66Å; I1645-L2240 HydrophobicContact CD1-CG 3.77Å; I1645-L2240 HydrophobicContact CG1-CD2 3.89Å; I1645-L2240 HydrophobicContact CG1-CG 4.5Å
1646	A	95.2	Very high	91.9	Very high	3 Å²	3	71.4 Å²	71.4	3%	0.025	35%	0.354	C	S	.	.	H	α-helix	trans	-63.6	-43	177.2	0	0	0	0	0	112.3	L1642 Y1649 K1650 I1651 L1653	L1642-A1646 WeakPolarHBondContact O-CB 3.33Å; L1642-A1646 PolarHBondContact O-N 2.67Å; A1646-Y1649 CarbonylContact O-C 3.56Å; A1646-Y1649 PolarHBondContact O-N 3.21Å; A1646-K1650 CarbonylContact O-C 3.57Å; A1646-K1650 WeakPolarHBondContact O-CA 3.17Å; A1646-K1650 PolarHBondContact O-N 3.26Å; A1646-I1651 HydrophobicContact CB-CB 4.29Å; A1646-I1651 PolarHBondContact O-N 2.99Å; A1646-L1653 HydrophobicContact CB-CD1 3.56Å; A1646-L1653 HydrophobicContact CB-CD2 3.85Å; A1646-L1653 HydrophobicContact CB-CG 3.58Å
1647	N	93.1	Very high	91.8	Very high	136 Å²	136	72.2 Å²	72.2	73%	0.727	35%	0.353	S	S	*	.	H	α-helix	trans	-62.3	-46.6	176.1	-170.6	39.8	0	0	0	111.6	H1643 Y1649 K1650	H1643-N1647 VanDerWaalsContact O-CB 3.24Å; H1643-N1647 WeakPolarHBondContact O-CB 3.44Å; H1643-N1647 PolarHBondContact O-N 3.24Å; N1647-Y1649 PolarHBondContact O-N 3.01Å; N1647-K1650 PolarHBondContact O-N 3.21Å; N1647-K1650 VanDerWaalsContact O-N 3.07Å
1648	Y	92.6	Very high	90.7	Very high	118 Å²	118	71.2 Å²	71.2	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-57.2	-46.1	176.9	178	-88.9	0	0	0	112.4	R1644 I1645 K1650 N2243	R1644-Y1648 WeakPolarHBondContact O-CB 3.25Å; R1644-Y1648 PolarHBondContact O-N 3.36Å; R1644-Y1648 VanDerWaalsContact O-N 3.08Å; I1645-Y1648 PolarHBondContact O-N 3.22Å; Y1648-K1650 VanDerWaalsContact C-N 3.29Å; Y1648-K1650 PolarHBondContact O-N 3.05Å; Y1648-N2243 PolarHBondContact OH-OD1 3.49Å
1649	Y	93.1	Very high	88.7	Confident	41 Å²	41	76.7 Å²	76.7	16%	0.161	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	8.2	177.5	-71.9	-64	0	0	0	114.6	K1463 I1645 A1646 N1647 I1651 L2239	K1463-Y1649 VanDerWaalsContact CE-CD1 3.41Å; I1645-Y1649 HydrophobicContact CG2-CD2 3.88Å; I1645-Y1649 HydrophobicContact CG2-CE2 4.17Å; I1645-Y1649 WeakPolarHBondContact O-CD2 3.18Å; I1645-Y1649 PolarHBondContact O-N 3.06Å; A1646-Y1649 CarbonylContact O-C 3.56Å; A1646-Y1649 PolarHBondContact O-N 3.21Å; N1647-Y1649 PolarHBondContact O-N 3.01Å; Y1649-I1651 PolarHBondContact O-N 3.33Å; Y1649-L2239 HydrophobicContact CD2-CB 4.45Å; Y1649-L2239 HydrophobicContact CD2-CD2 3.95Å; Y1649-L2239 HydrophobicContact CE1-CD2 4.49Å; Y1649-L2239 HydrophobicContact CE2-CB 3.83Å; Y1649-L2239 HydrophobicContact CE2-CD2 3.56Å; Y1649-L2239 HydrophobicContact CE2-CG 4.2Å; Y1649-L2239 PolarHBondContact OH-O 2.99Å
1650	K	94	Very high	85.9	Confident	195 Å²	195	80.7 Å²	80.7	85%	0.848	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	29.9	-176.8	-56.8	-177.9	-179	178.5	0	114.4	A1646 N1647 Y1648 N1652	A1646-K1650 CarbonylContact O-C 3.57Å; A1646-K1650 WeakPolarHBondContact O-CA 3.17Å; A1646-K1650 PolarHBondContact O-N 3.26Å; N1647-K1650 PolarHBondContact O-N 3.21Å; N1647-K1650 VanDerWaalsContact O-N 3.07Å; Y1648-K1650 VanDerWaalsContact C-N 3.29Å; Y1648-K1650 PolarHBondContact O-N 3.05Å; K1650-N1652 PolarHBondContact O-N 3.25Å
1651	I	94.5	Very high	82.9	Confident	24 Å²	24	80.6 Å²	80.6	12%	0.123	44%	0.439	C	S	.	.			trans	-81.5	116	178.9	-55.2	174.4	0	0	0	109	K1463 L1466 E1467 A1646 Y1649 L1653	K1463-I1651 HydrophobicContact CB-CD1 4.1Å; K1463-I1651 HydrophobicContact CG-CD1 4.11Å; L1466-I1651 HydrophobicContact CB-CD1 3.97Å; L1466-I1651 HydrophobicContact CB-CG2 4.26Å; L1466-I1651 HydrophobicContact CD1-CD1 3.91Å; E1467-I1651 HydrophobicContact CB-CG2 4.11Å; A1646-I1651 HydrophobicContact CB-CB 4.29Å; A1646-I1651 PolarHBondContact O-N 2.99Å; Y1649-I1651 PolarHBondContact O-N 3.33Å; I1651-L1653 PolarHBondContact O-N 3.49Å
1652	N	92.6	Very high	79.8	Confident	133 Å²	133	81.7 Å²	81.7	71%	0.711	46%	0.458	S	S	*	.			trans	-73.7	106.6	172	-177.4	4.3	0	0	0	110.1	K1650 G1654	K1650-N1652 PolarHBondContact O-N 3.25Å; N1652-G1654 PolarHBondContact O-N 3.37Å; N1652-G1654 PolarHBondContact OD1-N 2.81Å
1653	L	92.5	Very high	76.8	Confident	17 Å²	17	84.1 Å²	84.1	9%	0.089	47%	0.473	C	S	.	.			trans	-71.7	-12.9	177.9	-66.4	171.3	0	0	0	113.9	G1471 L1642 A1646 I1651 C1655	G1471-L1653 WeakPolarHBondContact CA-O 3.38Å; G1471-L1653 PolarHBondContact N-O 3.2Å; G1471-L1653 VanDerWaalsContact N-O 3.17Å; L1642-L1653 HydrophobicContact CD1-CD1 4.45Å; L1642-L1653 HydrophobicContact CD1-CD2 4.03Å; L1642-L1653 HydrophobicContact CD2-CD1 4.41Å; L1642-L1653 HydrophobicContact CG-CD1 3.96Å; L1642-L1653 HydrophobicContact CG-CD2 4.41Å; A1646-L1653 HydrophobicContact CB-CD1 3.56Å; A1646-L1653 HydrophobicContact CB-CD2 3.85Å; A1646-L1653 HydrophobicContact CB-CG 3.58Å; I1651-L1653 PolarHBondContact O-N 3.49Å; L1653-C1655 VanDerWaalsContact CB-SG 3.56Å; L1653-C1655 PolarHBondContact O-N 2.96Å
1654	G	86.6	Confident	73.6	Confident	62 Å²	62	87.8 Å²	87.8	64%	0.639	50%	0.499	S	S	*	.			trans	64.5	19.6	-177.2	0	0	0	0	0	114.8	N1652	N1652-G1654 PolarHBondContact O-N 3.37Å; N1652-G1654 PolarHBondContact OD1-N 2.81Å
1655	C	91	Very high	70.5	Confident	21 Å²	21	80.2 Å²	80.2	14%	0.142	48%	0.476	C	S	.	.			trans	-106.3	145.4	-180	59.8	0	0	0	0	112.5	C1474 H1643 L1653 C1657	C1474-C1655 HydrophobicContact CB-CB 4.19Å; H1643-C1655 PolarHBondContact NE2-SG 2.97Å; H1643-C1655 VanDerWaalsContact NE2-SG 3.43Å; L1653-C1655 VanDerWaalsContact CB-SG 3.56Å; L1653-C1655 PolarHBondContact O-N 2.96Å; C1655-C1657 PolarHBondContact O-N 2.83Å
1656	N	85.4	Confident	67.3	Low	169 Å²	169	85.2 Å²	85.2	90%	0.904	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	18.3	-179.9	-59	5.6	0	0	0	114
1657	C	85.2	Confident	64.1	Low	54 Å²	54	91.8 Å²	91.8	37%	0.365	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	4.5	-174.5	-58.7	0	0	0	0	113.3	C1474 H1478 H1643 C1655	C1474-C1657 VanDerWaalsContact SG-SG 3.65Å; H1478-C1657 PolarHBondContact NE2-SG 2.8Å; H1478-C1657 VanDerWaalsContact NE2-SG 3.36Å; H1643-C1657 WeakPolarHBondContact NE2-CB 3.48Å; C1655-C1657 PolarHBondContact O-N 2.83Å
1658	S	65	Low	60.9	Low	87 Å²	87	88.4 Å²	88.4	61%	0.608	53%	0.529	S	S	*	.	S	Bend	trans	-56.9	139.7	168.8	-59.6	0	0	0	0	110.9	S1660	S1658-S1660 PolarHBondContact O-N 3.3Å; S1658-S1660 VanDerWaalsContact O-N 3.17Å
1659	P	48.7	Very low	57.8	Low	120 Å²	120	88.4 Å²	88.4	78%	0.779	54%	0.541	S	S	*	.			trans	-61.3	121.1	175.5	26.2	-33.6	0	0	0	109.2	S1661	P1659-S1661 PolarHBondContact O-N 3.06Å; P1659-S1661 VanDerWaalsContact O-N 3.16Å
1660	S	33.3	Very low	54.5	Low	104 Å²	104	88.7 Å²	88.7	73%	0.727	55%	0.546	S	S	*	.			trans	-68	113.8	-173.2	57.3	0	0	0	0	111.2	S1658 S1662	S1658-S1660 PolarHBondContact O-N 3.3Å; S1658-S1660 VanDerWaalsContact O-N 3.17Å; S1660-S1662 PolarHBondContact O-N 3.11Å
1661	S	28.5	Very low	51.2	Low	96 Å²	96	83.2 Å²	83.2	67%	0.671	53%	0.525	S	S	*	.			trans	-65.3	85.6	163.2	40.5	0	0	0	0	109.5	P1659 T1663	P1659-S1661 PolarHBondContact O-N 3.06Å; P1659-S1661 VanDerWaalsContact O-N 3.16Å; S1661-T1663 PolarHBondContact O-N 2.81Å
1662	S	25.7	Very low	47.8	Very low	102 Å²	102	84.1 Å²	84.1	71%	0.713	53%	0.534	S	S	*	.			trans	-72.2	112	-171.6	56.4	0	0	0	0	112	S1660	S1660-S1662 PolarHBondContact O-N 3.11Å
1663	T	32.4	Very low	44.7	Very low	51 Å²	51	83.4 Å²	83.4	31%	0.313	53%	0.53	S	S	.	.			trans	-148.8	138.7	163	-47.1	0	0	0	0	109.9	S1661 A2526 S2527	S1661-T1663 PolarHBondContact O-N 2.81Å; T1663-A2526 VanDerWaalsContact OG1-CB 3.31Å; T1663-A2526 WeakPolarHBondContact OG1-CB 3.17Å; T1663-S2527 VanDerWaalsContact CB-O 3.23Å; T1663-S2527 WeakPolarHBondContact CB-O 3.41Å; T1663-S2527 WeakPolarHBondContact CG2-O 3.41Å
1664	V	28.5	Very low	41.5	Very low	121 Å²	121	89 Å²	89	73%	0.733	56%	0.559	S	S	*	*			trans	-115.7	134.5	-168.4	174.8	0	0	0	0	109.2
1665	G	29.2	Very low	38.6	Very low	19 Å²	19	91 Å²	91	20%	0.196	56%	0.56	C	S	.	*			trans	-165.8	128.9	168	0	0	0	0	0	108.2	I2528 F2530	G1665-I2528 WeakPolarHBondContact O-CG2 3.17Å; G1665-F2530 WeakPolarHBondContact O-CD2 3.31Å; G1665-F2530 WeakPolarHBondContact O-CE2 3.07Å
1666	N	26.1	Very low	35.5	Very low	117 Å²	117	97.9 Å²	97.9	63%	0.626	59%	0.594	S	S	*	*			trans	-83.6	165.4	178.1	-58.2	-32.3	0	0	0	108.7	F2530	N1666-F2530 HydrophobicContact CB-CE2 4.43Å; N1666-F2530 HydrophobicContact CB-CZ 4.24Å
1667	D	27.8	Very low	32.6	Very low	140 Å²	140	95.5 Å²	95.5	75%	0.749	58%	0.581	S	S	*	*			cis	-137.3	168.5	35.2	-68.9	-56.3	0	0	0	115.6
1668	A	26.6	Very low	29.8	Very low	66 Å²	66	100.1 Å²	100.1	55%	0.545	60%	0.595	S	S	.	*			trans	-103.3	159.6	159.7	0	0	0	0	0	108.5	F2530	A1668-F2530 HydrophobicContact CB-CD1 4.42Å; A1668-F2530 HydrophobicContact CB-CE1 3.95Å
1669	T	26.7	Very low	27.9	Very low	117 Å²	117	104.4 Å²	104.4	72%	0.718	61%	0.607	S	S	*	*			cis	-157	172.9	42.5	46.6	0	0	0	0	108.3
1670	D	23.3	Very low	26.6	Very low	48 Å²	48	108.2 Å²	108.2	26%	0.257	61%	0.612	S	S	.	*			cis	-156.2	150.4	22.8	-103	-88.6	0	0	0	110	N96 L97	N96-D1670 HydrophobicContact CB-CB 4.24Å; N96-D1670 VanDerWaalsContact CB-CG 3.47Å; N96-D1670 WeakPolarHBondContact CB-OD2 3.44Å; N96-D1670 VanDerWaalsContact ND2-CG 3.34Å; N96-D1670 PolarHBondContact ND2-OD2 2.92Å; L97-D1670 WeakPolarHBondContact CB-OD1 3.25Å; L97-D1670 HydrophobicContact CD1-CB 4.5Å; L97-D1670 WeakPolarHBondContact CD1-OD1 3.41Å; L97-D1670 PolarHBondContact N-OD1 3.26Å
1671	L	25.6	Very low	26.2	Very low	80 Å²	80	108.8 Å²	108.8	42%	0.419	61%	0.613	S	S	.	*				-165.8	170.6	121.4	-134.1	73.7	0	0	0	112.5	S2533 S2535	L1671-S2533 WeakPolarHBondContact O-CB 3.06Å; L1671-S2535 WeakPolarHBondContact CD2-O 3.5Å
1672	S	23.9	Very low	26	Very low	43 Å²	43	112.1 Å²	112.1	30%	0.301	62%	0.62	S	S	.	*			trans	-98.5	153.9	-169.5	35.1	0	0	0	0	114.4	S2534 S2535	S1672-S2534 PolarHBondContact O-OG 3.01Å; S1672-S2535 PolarHBondContact O-OG 2.71Å
1673	N	26.2	Very low	25.9	Very low	117 Å²	117	115.9 Å²	115.9	63%	0.626	62%	0.623	S	S	*	*			trans	37.3	115.2	147.1	-55.4	-18.6	0	0	0	118.2	S2534	N1673-S2534 PolarHBondContact N-OG 2.67Å
1674	D	25.7	Very low	25.5	Very low	134 Å²	134	115.8 Å²	115.8	72%	0.717	63%	0.625	S	S	*	*				-160.4	127.2	89.9	-112.4	-23.7	0	0	0	112.6
1675	T	26.1	Very low	25.3	Very low	106 Å²	106	116.7 Å²	116.7	65%	0.65	63%	0.625	S	S	*	*			trans	-160.1	91.1	170.1	-59	0	0	0	0	109
1676	L	25.2	Very low	25	Very low	165 Å²	165	122.6 Å²	122.6	86%	0.864	65%	0.652	S	S	*	*			trans	-137.4	83.8	171	-87.2	179.8	0	0	0	112
1677	L	24.7	Very low	25	Very low	119 Å²	119	124.5 Å²	124.5	62%	0.623	66%	0.662	S	S	*	*	S	Bend		-156.5	168.6	126	-97.8	161	0	0	0	107.6	N2110	L1677-N2110 WeakPolarHBondContact CD1-ND2 3.43Å
1678	F	27	Very low	24.8	Very low	150 Å²	150	129.2 Å²	129.2	66%	0.658	67%	0.67	S	S	*	*	S	Bend	trans	65.6	25.4	178.5	-61.1	-72.7	0	0	0	120.5	Q2203	F1678-Q2203 HydrophobicContact CE1-CB 4Å; F1678-Q2203 HydrophobicContact CE1-CG 4.11Å; F1678-Q2203 HydrophobicContact CZ-CB 4.01Å; F1678-Q2203 HydrophobicContact CZ-CG 4.06Å; F1678-Q2203 VanDerWaalsContact CZ-OE1 3.28Å
1679	M	25	Very low	24.8	Very low	177 Å²	177	133.8 Å²	133.8	87%	0.872	68%	0.679	S	S	*	*			trans	-136.1	97	161.4	-77.3	-141.6	94.1	0	0	115.9
1680	K	21.3	Very low	24.7	Very low	201 Å²	201	133.3 Å²	133.3	87%	0.874	68%	0.68	S	S	*	*			trans	-138.8	138.4	140.1	-73.3	-172.8	-178.5	169.4	0	105.6
1681	P	24.8	Very low	24.8	Very low	115 Å²	115	138.3 Å²	138.3	75%	0.747	71%	0.706	S	S	*	*	S	Bend	cis	-127.1	160.2	48.9	39.5	-28.1	0	0	0	117
1682	M	24.2	Very low	24.8	Very low	167 Å²	167	141.6 Å²	141.6	82%	0.823	72%	0.724	S	S	*	*			trans	42.8	100.3	151.7	-63.8	-173.7	178.8	0	0	119.6
1683	K	24.3	Very low	25	Very low	180 Å²	180	150.4 Å²	150.4	78%	0.783	75%	0.75	S	S	*	*			trans	-101.5	116.1	133.1	-71.7	-179.2	179.4	176.1	0	108.9	L102	L102-K1683 HydrophobicContact CD2-CB 4.47Å; L102-K1683 VanDerWaalsContact CD2-O 3.27Å; L102-K1683 WeakPolarHBondContact CD2-O 3.34Å
1684	S	22.4	Very low	25.3	Very low	49 Å²	49	151.1 Å²	151.1	34%	0.343	75%	0.754	S	S	.	*				-156.1	123.7	108.9	98.4	0	0	0	0	108.7	L102 H103	L102-S1684 VanDerWaalsContact CD1-CB 3.48Å; H103-S1684 WeakPolarHBondContact CE1-CB 3.43Å; H103-S1684 PolarHBondContact CE1-OG 3.46Å; H103-S1684 PolarHBondContact NE2-OG 2.98Å
1685	L	25.3	Very low	25.7	Very low	141 Å²	141	148.9 Å²	148.9	74%	0.738	75%	0.749	S	S	*	*				-165.3	86.5	112.8	-144.8	79.6	0	0	0	108	N1687	L1685-N1687 PolarHBondContact O-N 3.28Å
1686	N	22.9	Very low	26.1	Very low	142 Å²	142	149.3 Å²	149.3	76%	0.759	75%	0.747	S	S	*	*			trans	-87.2	95.5	167.7	-96.4	11.3	0	0	0	108.4
1687	N	26.3	Very low	26.6	Very low	157 Å²	157	148 Å²	148	84%	0.84	74%	0.741	S	S	*	*			trans	-149.4	148	146.3	-113.3	-33.5	0	0	0	110.5	L1685	L1685-N1687 PolarHBondContact O-N 3.28Å
1688	R	24	Very low	27.4	Very low	240 Å²	240	147.6 Å²	147.6	91%	0.906	74%	0.738	S	S	*	*			trans	-74.5	131.8	-159.1	-69.6	166.9	161.2	161.9	-9.1	114.3
1689	E	25.9	Very low	27.9	Very low	161 Å²	161	145.1 Å²	145.1	75%	0.752	73%	0.731	S	S	*	*			trans	-175.2	87.3	139.2	-106.2	172.2	-160	0	0	105.5	K1496	K1496-E1689 IonicContact NZ-OE2 2.93Å; K1496-E1689 PolarHBondContact NZ-OE2 3.05Å; K1496-E1689 VanDerWaalsContact NZ-OE2 3.12Å
1690	C	24.1	Very low	28.3	Very low	107 Å²	107	138.7 Å²	138.7	72%	0.723	71%	0.707	S	S	*	*				82.2	116.3	64.8	-162.4	0	0	0	0	112.7
1691	L	25.6	Very low	29	Very low	154 Å²	154	132.6 Å²	132.6	81%	0.806	68%	0.684	S	S	*	*			trans	50.3	106.5	167	-65.1	167.6	0	0	0	118.2
1692	D	26.6	Very low	29.7	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	67%	0.671	S	S	*	*				-143.8	134.3	110.7	-140.5	-21.3	0	0	0	110.4
1693	R	27.5	Very low	30.3	Very low	227 Å²	227	126.7 Å²	126.7	86%	0.857	66%	0.657	S	S	*	*			trans	-112	98.3	175.4	-91.9	-170	173.7	-169.2	-1.8	107	S1695	R1693-S1695 PolarHBondContact O-N 3.08Å
1694	N	32	Very low	30.9	Very low	133 Å²	133	124.2 Å²	124.2	71%	0.711	65%	0.652	S	S	*	*			trans	-57.7	136.2	179.2	-74.2	-5.9	0	0	0	111	L1696	N1694-L1696 PolarHBondContact O-N 3.17Å
1695	S	34.2	Very low	31.6	Very low	86 Å²	86	128 Å²	128	60%	0.601	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	3.5	-163.9	45.4	0	0	0	0	116.8	R1693 L1699	R1693-S1695 PolarHBondContact O-N 3.08Å; S1695-L1699 VanDerWaalsContact O-CD1 3.28Å; S1695-L1699 WeakPolarHBondContact O-CD1 3.39Å; S1695-L1699 PolarHBondContact O-N 2.86Å
1696	L	35.2	Very low	31.8	Very low	115 Å²	115	124.8 Å²	124.8	60%	0.602	66%	0.655	S	S	*	*	H	α-helix	trans	-77.6	-44	-173.5	-147.4	77.9	0	0	0	113.1	N1694 L1698 L1699 A1700	N1694-L1696 PolarHBondContact O-N 3.17Å; L1696-L1698 VanDerWaalsContact C-N 3.26Å; L1696-L1698 PolarHBondContact O-N 3.37Å; L1696-L1699 PolarHBondContact O-N 3.04Å; L1696-L1699 VanDerWaalsContact O-N 3.17Å; L1696-A1700 PolarHBondContact O-N 3.42Å; L1696-A1700 VanDerWaalsContact O-N 3.11Å
1697	D	36.5	Very low	32.1	Very low	138 Å²	138	123.7 Å²	123.7	74%	0.738	65%	0.65	S	S	*	*	H	α-helix	trans	-65.1	-34.4	179.3	-63.4	-27.6	0	0	0	110.9	A1700 D1701	D1697-A1700 PolarHBondContact O-N 3.11Å; D1697-D1701 WeakPolarHBondContact O-CB 3.11Å; D1697-D1701 PolarHBondContact O-N 2.96Å
1698	L	40.2	Very low	32.2	Very low	110 Å²	110	122.3 Å²	122.3	58%	0.576	64%	0.64	S	S	*	*	H	α-helix	trans	-68.4	-36.3	175.3	-167.3	71.4	0	0	0	111.9	L1696 D1701 I1702	L1696-L1698 VanDerWaalsContact C-N 3.26Å; L1696-L1698 PolarHBondContact O-N 3.37Å; L1698-D1701 PolarHBondContact O-N 3.01Å; L1698-I1702 HydrophobicContact CD2-CD1 4.35Å; L1698-I1702 HydrophobicContact CG-CD1 3.93Å; L1698-I1702 HydrophobicContact CG-CG1 4.49Å; L1698-I1702 WeakPolarHBondContact O-CB 3.44Å; L1698-I1702 WeakPolarHBondContact O-CD1 3.46Å; L1698-I1702 WeakPolarHBondContact O-CG1 3.32Å; L1698-I1702 PolarHBondContact O-N 3.47Å
1699	L	37.1	Very low	32.3	Very low	98 Å²	98	112.1 Å²	112.1	51%	0.513	61%	0.609	S	S	.	*	H	α-helix	trans	-67.4	-36.1	174.1	-101.9	91.8	0	0	0	112.4	S1695 L1696 I1702 A1703	S1695-L1699 VanDerWaalsContact O-CD1 3.28Å; S1695-L1699 WeakPolarHBondContact O-CD1 3.39Å; S1695-L1699 PolarHBondContact O-N 2.86Å; L1696-L1699 PolarHBondContact O-N 3.04Å; L1696-L1699 VanDerWaalsContact O-N 3.17Å; L1699-I1702 PolarHBondContact O-N 3.19Å; L1699-A1703 WeakPolarHBondContact O-CB 3.17Å; L1699-A1703 PolarHBondContact O-N 3.17Å
1700	A	34.1	Very low	32.4	Very low	43 Å²	43	110.6 Å²	110.6	36%	0.355	61%	0.606	S	S	.	*	H	α-helix	trans	-65.7	-42.7	173.2	0	0	0	0	0	111.6	L1696 D1697 I1702 A1703 L1704	L1696-A1700 PolarHBondContact O-N 3.42Å; L1696-A1700 VanDerWaalsContact O-N 3.11Å; D1697-A1700 PolarHBondContact O-N 3.11Å; A1700-I1702 VanDerWaalsContact C-N 3.32Å; A1700-I1702 PolarHBondContact O-N 3.19Å; A1700-A1703 PolarHBondContact O-N 2.95Å; A1700-L1704 WeakPolarHBondContact O-CB 3.3Å; A1700-L1704 WeakPolarHBondContact O-CG 3.31Å; A1700-L1704 PolarHBondContact O-N 3.05Å
1701	D	36.2	Very low	32.6	Very low	73 Å²	73	111.6 Å²	111.6	39%	0.39	61%	0.609	S	S	.	*	H	α-helix	trans	-69.1	-29	178	-144.6	56.7	0	0	0	112.4	D1697 L1698 K1705	D1697-D1701 WeakPolarHBondContact O-CB 3.11Å; D1697-D1701 PolarHBondContact O-N 2.96Å; L1698-D1701 PolarHBondContact O-N 3.01Å; D1701-K1705 WeakPolarHBondContact O-CB 3.45Å; D1701-K1705 VanDerWaalsContact O-CD 3.28Å; D1701-K1705 WeakPolarHBondContact O-CD 3.42Å; D1701-K1705 VanDerWaalsContact O-CG 3.24Å; D1701-K1705 WeakPolarHBondContact O-CG 3.31Å; D1701-K1705 PolarHBondContact O-N 2.87Å; D1701-K1705 IonicContact OD1-NZ 3.52Å; D1701-K1705 IonicContact OD2-NZ 3.12Å; D1701-K1705 PolarHBondContact OD2-NZ 2.87Å
1702	I	38.4	Very low	32.6	Very low	94 Å²	94	107.7 Å²	107.7	48%	0.482	61%	0.606	S	S	.	*	H	α-helix	trans	-74.8	-45.1	171.2	-73.7	166.3	0	0	0	111.1	L1698 L1699 A1700 L1704 K1705 A1706	L1698-I1702 HydrophobicContact CD2-CD1 4.35Å; L1698-I1702 HydrophobicContact CG-CD1 3.93Å; L1698-I1702 HydrophobicContact CG-CG1 4.49Å; L1698-I1702 WeakPolarHBondContact O-CB 3.44Å; L1698-I1702 WeakPolarHBondContact O-CD1 3.46Å; L1698-I1702 WeakPolarHBondContact O-CG1 3.32Å; L1698-I1702 PolarHBondContact O-N 3.47Å; L1699-I1702 PolarHBondContact O-N 3.19Å; A1700-I1702 VanDerWaalsContact C-N 3.32Å; A1700-I1702 PolarHBondContact O-N 3.19Å; I1702-L1704 PolarHBondContact O-N 2.77Å; I1702-K1705 CarbonylContact O-C 3.37Å; I1702-K1705 WeakPolarHBondContact O-CA 3.41Å; I1702-K1705 PolarHBondContact O-N 3.05Å; I1702-A1706 WeakPolarHBondContact O-CB 3.26Å; I1702-A1706 PolarHBondContact O-N 3.34Å
1703	A	37.1	Very low	32.7	Very low	64 Å²	64	105.5 Å²	105.5	53%	0.529	60%	0.603	S	S	.	*	H	α-helix	trans	-59	-38.4	176.6	0	0	0	0	0	111.6	L1699 A1700 K1705	L1699-A1703 WeakPolarHBondContact O-CB 3.17Å; L1699-A1703 PolarHBondContact O-N 3.17Å; A1700-A1703 PolarHBondContact O-N 2.95Å; A1703-K1705 PolarHBondContact O-N 3.39Å
1704	L	38.3	Very low	32.5	Very low	127 Å²	127	102 Å²	102	67%	0.665	60%	0.6	S	S	*	*	H	α-helix	trans	-79.3	1.3	174.9	-65.7	171.3	0	0	0	114.5	A1700 I1702	A1700-L1704 WeakPolarHBondContact O-CB 3.3Å; A1700-L1704 WeakPolarHBondContact O-CG 3.31Å; A1700-L1704 PolarHBondContact O-N 3.05Å; I1702-L1704 PolarHBondContact O-N 2.77Å
1705	K	36.3	Very low	32.3	Very low	130 Å²	130	101.1 Å²	101.1	57%	0.565	60%	0.6	S	S	*	*	H	α-helix	trans	-118.6	-12.2	173	-73.3	170.1	-174.4	160.8	0	113.3	D1701 I1702 A1703 D1707 M1708	D1701-K1705 WeakPolarHBondContact O-CB 3.45Å; D1701-K1705 VanDerWaalsContact O-CD 3.28Å; D1701-K1705 WeakPolarHBondContact O-CD 3.42Å; D1701-K1705 VanDerWaalsContact O-CG 3.24Å; D1701-K1705 WeakPolarHBondContact O-CG 3.31Å; D1701-K1705 PolarHBondContact O-N 2.87Å; D1701-K1705 IonicContact OD1-NZ 3.52Å; D1701-K1705 IonicContact OD2-NZ 3.12Å; D1701-K1705 PolarHBondContact OD2-NZ 2.87Å; I1702-K1705 CarbonylContact O-C 3.37Å; I1702-K1705 WeakPolarHBondContact O-CA 3.41Å; I1702-K1705 PolarHBondContact O-N 3.05Å; A1703-K1705 PolarHBondContact O-N 3.39Å; K1705-D1707 PolarHBondContact O-N 3.31Å; K1705-M1708 PolarHBondContact O-N 3.08Å
1706	A	30.2	Very low	32	Very low	72 Å²	72	103.4 Å²	103.4	60%	0.595	61%	0.61	S	S	*	*	H	α-helix	trans	-66.3	-26.5	177.2	0	0	0	0	0	112.6	I1702 M1708	I1702-A1706 WeakPolarHBondContact O-CB 3.26Å; I1702-A1706 PolarHBondContact O-N 3.34Å; A1706-M1708 PolarHBondContact O-N 3.18Å; A1706-M1708 VanDerWaalsContact O-N 3.09Å
1707	D	29.5	Very low	31.5	Very low	119 Å²	119	101.2 Å²	101.2	64%	0.636	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	10.3	172.3	-77.5	-26.1	0	0	0	114.1	K1705 C2515	K1705-D1707 PolarHBondContact O-N 3.31Å; D1707-C2515 WeakPolarHBondContact O-CB 3.37Å; D1707-C2515 PolarHBondContact O-SG 3.04Å
1708	M	27.7	Very low	30.9	Very low	128 Å²	128	102.6 Å²	102.6	63%	0.631	62%	0.622	S	S	*	*	S	Bend	trans	-135.1	69.6	172.1	-76	-78.4	105.4	0	0	112.2	K1705 A1706 C2515 S2516	K1705-M1708 PolarHBondContact O-N 3.08Å; A1706-M1708 PolarHBondContact O-N 3.18Å; A1706-M1708 VanDerWaalsContact O-N 3.09Å; M1708-C2515 HydrophobicContact CE-CB 4.08Å; M1708-S2516 VanDerWaalsContact CA-OG 3.28Å; M1708-S2516 WeakPolarHBondContact CA-OG 3.47Å
1709	G	26.4	Very low	30.1	Very low	26 Å²	26	101.4 Å²	101.4	27%	0.268	62%	0.623	S	S	.	*			trans	-155.8	158.4	151.6	0	0	0	0	0	113.8	S2516	G1709-S2516 VanDerWaalsContact C-OG 3.32Å; G1709-S2516 WeakPolarHBondContact CA-OG 3.35Å; G1709-S2516 PolarHBondContact N-OG 3.36Å
1710	N	27	Very low	29.5	Very low	129 Å²	129	102.9 Å²	102.9	69%	0.69	63%	0.632	S	S	*	*			cis	-170.4	134.7	-19.4	-171.7	11.3	0	0	0	108.4
1711	T	28.1	Very low	29.2	Very low	129 Å²	129	108 Å²	108	79%	0.791	65%	0.653	S	S	*	*			trans	-125.5	116.6	163.6	58	0	0	0	0	109.1
1712	G	27.1	Very low	28.7	Very low	71 Å²	71	109.1 Å²	109.1	73%	0.732	67%	0.667	S	S	*	*			trans	-143.2	175.1	-168.1	0	0	0	0	0	114.7
1713	S	27.1	Very low	28.2	Very low	104 Å²	104	109.3 Å²	109.3	73%	0.727	68%	0.676	S	S	*	*			trans	-147.6	121.2	166.7	-175.9	0	0	0	0	104.6
1714	L	24	Very low	27.8	Very low	153 Å²	153	112.9 Å²	112.9	80%	0.801	69%	0.687	S	S	*	*				48.4	119.3	80.3	-61.4	169.4	0	0	0	110.5
1715	T	28.3	Very low	27.5	Very low	115 Å²	115	110 Å²	110	71%	0.706	69%	0.688	S	S	*	*			cis	-144.1	164.8	33.4	53.9	0	0	0	0	114.6
1716	T	27	Very low	27.1	Very low	134 Å²	134	110 Å²	110	82%	0.822	69%	0.693	S	S	*	*			trans	33	129.9	146.5	57.4	0	0	0	0	120.7
1717	G	25.2	Very low	27	Very low	68 Å²	68	112.4 Å²	112.4	70%	0.701	69%	0.694	S	S	*	*			cis	123.9	110.8	3.3	0	0	0	0	0	113.3
1718	N	23.9	Very low	26.8	Very low	167 Å²	167	112.9 Å²	112.9	89%	0.893	70%	0.697	S	S	*	*			trans	63.2	149.3	167.6	-75	5.2	0	0	0	119.1
1719	S	24	Very low	26.7	Very low	85 Å²	85	112.1 Å²	112.1	59%	0.594	70%	0.695	S	S	*	*			cis	-168	160.8	-25.6	-151	0	0	0	0	111.3
1720	N	24.7	Very low	26.6	Very low	129 Å²	129	116.3 Å²	116.3	69%	0.69	72%	0.715	S	S	*	*			trans	74.4	133.8	154.8	-54.9	-12.9	0	0	0	120.8
1721	N	26.6	Very low	26.4	Very low	151 Å²	151	116.4 Å²	116.4	81%	0.807	72%	0.72	S	S	*	*			trans	71.2	143.5	146.6	-62.8	-3.1	0	0	0	119.3
1722	S	26.5	Very low	26.2	Very low	96 Å²	96	116.9 Å²	116.9	67%	0.671	72%	0.722	S	S	*	*			cis	-173.2	169.9	-11.3	48.3	0	0	0	0	111.5
1723	S	26.8	Very low	26.1	Very low	98 Å²	98	121.7 Å²	121.7	69%	0.685	73%	0.726	S	S	*	*			trans	75.9	155.1	160	85.8	0	0	0	0	116.4
1724	N	28.5	Very low	25.8	Very low	140 Å²	140	121.5 Å²	121.5	75%	0.749	72%	0.721	S	S	*	*			cis	-143.6	168.1	12	-98.9	-51.5	0	0	0	112.1	I1726	N1724-I1726 WeakPolarHBondContact OD1-CD1 3.39Å
1725	G	33.6	Very low	25.6	Very low	67 Å²	67	120.3 Å²	120.3	69%	0.691	71%	0.711	S	S	*	*			trans	105.7	75.2	168.2	0	0	0	0	0	115.6
1726	I	27.6	Very low	25.3	Very low	130 Å²	130	123.7 Å²	123.7	67%	0.667	72%	0.716	S	S	*	*			cis	70	123.4	31.3	-64.9	173.8	0	0	0	111.5	N1724	N1724-I1726 WeakPolarHBondContact OD1-CD1 3.39Å
1727	I	27.5	Very low	25	Very low	122 Å²	122	124.4 Å²	124.4	63%	0.626	72%	0.715	S	S	*	*			cis	-152.9	143.2	-0.6	-117.5	173.5	0	0	0	106.4
1728	D	25.4	Very low	24.9	Very low	129 Å²	129	125.8 Å²	125.8	69%	0.69	72%	0.72	S	S	*	*				51.7	168.2	84.8	-43.6	-57.9	0	0	0	115
1729	N	25.9	Very low	24.9	Very low	112 Å²	112	122.4 Å²	122.4	60%	0.599	71%	0.709	S	S	*	*			cis	-166.9	141.8	23.5	-128.2	-38.9	0	0	0	112.4
1730	V	23.3	Very low	24.8	Very low	114 Å²	114	126 Å²	126	69%	0.691	72%	0.716	S	S	*	*				50.2	114.8	129.7	164.1	0	0	0	0	122.3
1731	V	24.5	Very low	24.9	Very low	131 Å²	131	126.1 Å²	126.1	79%	0.794	72%	0.717	S	S	*	*			trans	87	148.9	135.2	163	0	0	0	0	123.3
1732	V	22.7	Very low	24.7	Very low	138 Å²	138	125.2 Å²	125.2	84%	0.836	71%	0.712	S	S	*	*			trans	86.9	145.9	166.6	148.7	0	0	0	0	118.9
1733	E	24.5	Very low	24.9	Very low	172 Å²	172	125.5 Å²	125.5	80%	0.804	71%	0.711	S	S	*	*			trans	-98	146.5	-170.2	-48.9	164	118.2	0	0	112.1
1734	T	21.3	Very low	24.6	Very low	101 Å²	101	125.6 Å²	125.6	62%	0.62	71%	0.712	S	S	*	*				-177.3	143.1	110.8	22.5	0	0	0	0	115
1735	E	20.1	Very low	24.2	Very low	127 Å²	127	127 Å²	127	59%	0.593	71%	0.712	S	S	*	*			trans	29.8	102.4	148.1	-60	-167.4	146.6	0	0	122.1	R127	R127-E1735 IonicContact CZ-OE2 3.96Å; R127-E1735 IonicContact NH1-OE2 3.82Å; R127-E1735 PolarHBondContact NH1-OE2 2.94Å; R127-E1735 IonicContact NH2-OE2 2.72Å; R127-E1735 PolarHBondContact NH2-OE2 2.98Å
1736	F	22.1	Very low	23.7	Very low	187 Å²	187	130.6 Å²	130.6	82%	0.82	71%	0.714	S	S	*	*				70.9	151	121.9	-93.6	-91.4	0	0	0	122.7
1737	N	21	Very low	23.4	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	71%	0.707	S	S	*	*			trans	71.6	125.6	174.3	-51.7	-35.9	0	0	0	114.1
1738	A	23.3	Very low	23.2	Very low	96 Å²	96	127.6 Å²	127.6	79%	0.793	71%	0.708	S	S	*	*			cis	-152.1	-178.8	-2.7	0	0	0	0	0	108.4
1739	S	22.7	Very low	23.2	Very low	96 Å²	96	127.7 Å²	127.7	67%	0.671	71%	0.708	S	S	*	*			cis	-156.1	156.3	6	91.4	0	0	0	0	110.6
1740	H	22.9	Very low	23.3	Very low	160 Å²	160	127.8 Å²	127.8	74%	0.741	71%	0.709	S	S	*	*			trans	30.7	144.9	136.8	-72.7	-83.5	0	0	0	123
1741	N	25.9	Very low	23.4	Very low	132 Å²	132	125 Å²	125	71%	0.706	70%	0.704	S	S	*	*			trans	74.2	148.3	150.6	-58.5	-17.1	0	0	0	117.3
1742	N	22.4	Very low	23.4	Very low	132 Å²	132	122.7 Å²	122.7	71%	0.706	69%	0.69	S	S	*	*			cis	-160.3	163.3	-35.1	-119.3	-8.5	0	0	0	107.1
1743	P	31.4	Very low	23.5	Very low	102 Å²	102	120.7 Å²	120.7	66%	0.662	68%	0.682	S	S	*	*			trans	-76.6	178.6	172.6	35	-36	0	0	0	111.6
1744	S	20.9	Very low	23.5	Very low	101 Å²	101	118.6 Å²	118.6	71%	0.706	68%	0.675	S	S	*	*			trans	100.7	127.8	145.2	82.3	0	0	0	0	119.6
1745	F	20.4	Very low	23.6	Very low	168 Å²	168	117.1 Å²	117.1	74%	0.737	67%	0.669	S	S	*	*			trans	80.2	155.7	131.9	-102.5	-113.3	0	0	0	119.8
1746	I	21.1	Very low	23.8	Very low	144 Å²	144	115.7 Å²	115.7	74%	0.738	67%	0.666	S	S	*	*			trans	73.4	119	169.6	-55.3	-167.7	0	0	0	113.3
1747	T	21.7	Very low	23.9	Very low	84 Å²	84	112.5 Å²	112.5	52%	0.515	66%	0.657	S	S	.	*			cis	-164.9	174.7	0.3	14.3	0	0	0	0	110
1748	T	24.2	Very low	24.1	Very low	105 Å²	105	112 Å²	112	64%	0.644	65%	0.654	S	S	*	*			trans	59.1	141.9	144.1	54.2	0	0	0	0	119.1
1749	D	25.8	Very low	24.2	Very low	131 Å²	131	113.8 Å²	113.8	70%	0.701	65%	0.65	S	S	*	*			cis	-162.2	179.3	-3.7	-111.5	-5.6	0	0	0	110.9
1750	N	27	Very low	24.4	Very low	113 Å²	113	115.4 Å²	115.4	60%	0.604	65%	0.652	S	S	*	*			trans	-23.5	147.3	158.4	-40.9	-70.6	0	0	0	115.2
1751	G	25.8	Very low	24.6	Very low	57 Å²	57	114.7 Å²	114.7	59%	0.588	65%	0.653	S	S	*	*			cis	125.3	175.6	20	0	0	0	0	0	110.5
1752	V	25.2	Very low	24.5	Very low	82 Å²	82	114.9 Å²	114.9	50%	0.497	65%	0.65	S	S	.	*			trans	73.9	105.5	173.6	-166.4	0	0	0	0	114.2	T716	T716-V1752 HydrophobicContact CG2-CG2 3.47Å; T716-V1752 VanDerWaalsContact CG2-CG2 3.47Å
1753	S	23.4	Very low	24.6	Very low	96 Å²	96	118.6 Å²	118.6	67%	0.671	65%	0.654	S	S	*	*				69.4	142.3	78	-49.4	0	0	0	0	113.3
1754	L	25.7	Very low	24.6	Very low	128 Å²	128	122.3 Å²	122.3	67%	0.67	66%	0.66	S	S	*	*			cis	-144.6	153.9	45.5	-72.4	159.3	0	0	0	110.6
1755	S	23.5	Very low	24.6	Very low	70 Å²	70	121.9 Å²	121.9	49%	0.49	65%	0.648	S	S	.	*				71.1	134.3	64.1	119.9	0	0	0	0	112.7
1756	D	23.4	Very low	24.8	Very low	97 Å²	97	119.1 Å²	119.1	52%	0.519	64%	0.64	S	S	.	*			cis	-157.7	179.4	11.4	-86.4	-45.5	0	0	0	114.4
1757	N	25.1	Very low	24.9	Very low	120 Å²	120	119.1 Å²	119.1	64%	0.642	64%	0.638	S	S	*	*			trans	79.9	104.9	150.3	-65.6	-18.7	0	0	0	123.8
1758	D	24.1	Very low	25.1	Very low	137 Å²	137	124 Å²	124	73%	0.733	66%	0.657	S	S	*	*				57.7	119.6	114.9	-73.6	-5.4	0	0	0	125.6
1759	N	26.2	Very low	25	Very low	134 Å²	134	125.7 Å²	125.7	72%	0.717	66%	0.662	S	S	*	*				34.2	130.9	123.2	-60.7	-47.9	0	0	0	119.7
1760	N	26.7	Very low	24.8	Very low	131 Å²	131	129.2 Å²	129.2	70%	0.701	67%	0.672	S	S	*	*				-174.1	147.7	56.2	-113.8	-41.5	0	0	0	112.6
1761	N	26.7	Very low	24.8	Very low	145 Å²	145	129.7 Å²	129.7	78%	0.775	68%	0.681	S	S	*	*			trans	57.4	158.8	154.6	-65.4	-26.2	0	0	0	119.2
1762	E	24.3	Very low	24.7	Very low	136 Å²	136	131.7 Å²	131.7	64%	0.636	69%	0.686	S	S	*	*			cis	-143.1	164.8	9.2	-147.6	-163.2	-120	0	0	111.8
1763	R	24.3	Very low	24.7	Very low	209 Å²	209	136.6 Å²	136.6	79%	0.789	70%	0.703	S	S	*	*			trans	33	108.4	160.9	-75.9	-178.9	173.4	109.9	-7.1	118.7
1764	K	30.7	Very low	24.7	Very low	181 Å²	181	137.1 Å²	137.1	79%	0.787	71%	0.707	S	S	*	*			trans	-137.8	117.1	134.7	-154	171.7	-179.3	-179.8	0	111.2	I1766	K1764-I1766 HydrophobicContact CD-CD1 3.88Å; K1764-I1766 HydrophobicContact CD-CG1 4.3Å; K1764-I1766 HydrophobicContact CG-CD1 4.2Å; K1764-I1766 HydrophobicContact CG-CG1 4.08Å; K1764-I1766 PolarHBondContact O-N 3.44Å
1765	M	21.5	Very low	24.5	Very low	91 Å²	91	142.5 Å²	142.5	45%	0.448	72%	0.719	S	S	.	*			trans	-77.7	116.4	168.2	-81.3	-122.1	46.5	0	0	108.9	N2261 L2262	M1765-N2261 WeakPolarHBondContact CB-OD1 3.39Å; M1765-N2261 VanDerWaalsContact CE-OD1 3.29Å; M1765-N2261 WeakPolarHBondContact CE-OD1 3.21Å; M1765-N2261 HydrophobicContact CG-CB 4.33Å; M1765-N2261 HydrophobicContact SD-CB 3.71Å; M1765-N2261 VanDerWaalsContact SD-CG 3.6Å; M1765-N2261 PolarHBondContact SD-OD1 2.85Å; M1765-L2262 HydrophobicContact CE-CB 4.31Å; M1765-L2262 HydrophobicContact CE-CD2 3.35Å; M1765-L2262 HydrophobicContact CE-CG 4.42Å; M1765-L2262 HydrophobicContact SD-CB 3.98Å; M1765-L2262 HydrophobicContact SD-CD2 3.94Å
1766	I	24.3	Very low	24.5	Very low	111 Å²	111	146.3 Å²	146.3	57%	0.569	73%	0.732	S	S	*	*			trans	-138	147.7	170.5	-62.3	-175.4	0	0	0	106.3	K1764 M1768	K1764-I1766 HydrophobicContact CD-CD1 3.88Å; K1764-I1766 HydrophobicContact CD-CG1 4.3Å; K1764-I1766 HydrophobicContact CG-CD1 4.2Å; K1764-I1766 HydrophobicContact CG-CG1 4.08Å; K1764-I1766 PolarHBondContact O-N 3.44Å; I1766-M1768 PolarHBondContact O-N 3.09Å
1767	M	23.2	Very low	24.5	Very low	143 Å²	143	149.5 Å²	149.5	70%	0.704	74%	0.743	S	S	*	*			trans	-48.8	130.3	172	-64.1	176.7	-74.6	0	0	110.8
1768	M	25	Very low	24.4	Very low	186 Å²	186	149.3 Å²	149.3	92%	0.916	75%	0.75	S	S	*	*			trans	-104.6	106.2	162.3	-79.3	-169.9	164.9	0	0	108.5	I1766	I1766-M1768 PolarHBondContact O-N 3.09Å
1769	D	22.2	Very low	24.4	Very low	141 Å²	141	148.5 Å²	148.5	75%	0.754	75%	0.75	S	S	*	*			trans	-50.2	144.8	163.6	-67.4	-79.2	0	0	0	110.6	P1771	D1769-P1771 WeakPolarHBondContact O-CD 3.44Å
1770	F	22	Very low	24.4	Very low	205 Å²	205	150.4 Å²	150.4	90%	0.899	75%	0.747	S	S	*	*			trans	-67.7	112.8	166	-81.6	-99.3	0	0	0	108.9	S1772	F1770-S1772 PolarHBondContact O-N 3.2Å
1771	P	27.1	Very low	24.3	Very low	123 Å²	123	150.6 Å²	150.6	80%	0.799	74%	0.738	S	S	*	*			trans	-78.2	97.9	171.9	-1.6	22.4	0	0	0	106.7	D1769 H1773	D1769-P1771 WeakPolarHBondContact O-CD 3.44Å; P1771-H1773 PolarHBondContact O-N 3.4Å; P1771-H1773 VanDerWaalsContact O-N 3.11Å
1772	S	24	Very low	24.2	Very low	100 Å²	100	151.2 Å²	151.2	70%	0.699	74%	0.736	S	S	*	*			trans	-60.9	109.5	155.7	55.3	0	0	0	0	107.7	F1770	F1770-S1772 PolarHBondContact O-N 3.2Å
1773	H	24.7	Very low	24.3	Very low	184 Å²	184	152.9 Å²	152.9	85%	0.852	75%	0.747	S	S	*	*			trans	-158.9	123.9	146.4	-92.2	-50.5	0	0	0	112.5	P1771	P1771-H1773 PolarHBondContact O-N 3.4Å; P1771-H1773 VanDerWaalsContact O-N 3.11Å
1774	S	23.7	Very low	24.3	Very low	107 Å²	107	148.1 Å²	148.1	75%	0.748	74%	0.738	S	S	*	*			trans	-74.6	123.3	164.5	52.6	0	0	0	0	111
1775	W	21.9	Very low	24.1	Very low	242 Å²	242	148.9 Å²	148.9	92%	0.917	74%	0.744	S	S	*	*			trans	-149.4	143.9	151.5	-88.5	-2.1	0	0	0	105.4
1776	I	23.1	Very low	24.2	Very low	149 Å²	149	155.5 Å²	155.5	76%	0.764	76%	0.764	S	S	*	*			cis	-127.5	143.5	12	-62.5	171.7	0	0	0	109.3	C1778	I1776-C1778 HydrophobicContact CG2-CB 4.35Å
1777	H	23.6	Very low	24.1	Very low	165 Å²	165	156 Å²	156	76%	0.764	78%	0.778	S	S	*	*			trans	-100.5	119.9	165.7	-153.7	-75.8	0	0	0	109
1778	C	22.2	Very low	24.2	Very low	116 Å²	116	154.4 Å²	154.4	78%	0.784	78%	0.779	S	S	*	*			trans	-140.8	79.8	175.8	-166.2	0	0	0	0	111.8	I1776	I1776-C1778 HydrophobicContact CG2-CB 4.35Å
1779	T	24.6	Very low	24.1	Very low	119 Å²	119	154.1 Å²	154.1	73%	0.73	77%	0.769	S	S	*	*			trans	-89.8	119.1	168.2	43.8	0	0	0	0	109.6
1780	R	26	Very low	24.1	Very low	174 Å²	174	155 Å²	155	66%	0.657	77%	0.769	S	S	*	*			trans	-141	122.1	169.6	-157.4	-179.3	-159.9	-171.5	9.2	110.5	T2538	R1780-T2538 PolarHBondContact NH2-OG1 2.86Å
1781	R	24.5	Very low	24.4	Very low	136 Å²	136	153 Å²	153	51%	0.513	76%	0.76	S	S	.	*			trans	-116.6	163.2	161.8	-91.3	-151.6	-178.3	115.3	-0.9	111.2	D2108 G2155	R1781-D2108 IonicContact CZ-OD1 2.74Å; R1781-D2108 VanDerWaalsContact CZ-OD1 3.3Å; R1781-D2108 IonicContact CZ-OD2 3.78Å; R1781-D2108 IonicContact NH1-OD1 2.74Å; R1781-D2108 PolarHBondContact NH1-OD1 3.37Å; R1781-D2108 IonicContact NH1-OD2 3.61Å; R1781-D2108 VanDerWaalsContact NH2-CG 3.29Å; R1781-D2108 IonicContact NH2-OD1 3.16Å; R1781-D2108 PolarHBondContact NH2-OD1 3.24Å; R1781-D2108 IonicContact NH2-OD2 2.88Å; R1781-D2108 PolarHBondContact NH2-OD2 2.9Å; R1781-G2155 PolarHBondContact NE-O 2.71Å
1782	H	25.8	Very low	24.1	Very low	157 Å²	157	153.2 Å²	153.2	73%	0.727	75%	0.753	S	S	*	*			trans	-91.8	154.3	-165	-70.8	-125.9	0	0	0	113.3
1783	I	26.3	Very low	24.1	Very low	171 Å²	171	154 Å²	154	88%	0.877	75%	0.75	S	S	*	*			trans	-125.5	144.9	130.8	-67.2	-172.3	0	0	0	108.1
1784	N	24.8	Very low	24.1	Very low	110 Å²	110	152 Å²	152	59%	0.588	75%	0.745	S	S	*	*			trans	-87.3	147.9	-173.8	-69.2	-75.1	0	0	0	113.4
1785	Q	24.9	Very low	24.2	Very low	196 Å²	196	150.5 Å²	150.5	92%	0.916	74%	0.739	S	S	*	*				-132.8	151.6	123.1	-75.2	-158.4	3.9	0	0	110.2
1786	R	24.2	Very low	24.2	Very low	230 Å²	230	142.5 Å²	142.5	87%	0.868	72%	0.724	S	S	*	*			trans	-117.7	122.5	-173.3	-70.4	177.6	174.2	171.7	-3.1	111.1
1787	S	22.7	Very low	24.2	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	73%	0.725	S	S	*	*			trans	-174.6	141.1	148.4	-160.1	0	0	0	0	107.9
1788	C	24.4	Very low	24.1	Very low	110 Å²	110	140 Å²	140	74%	0.743	72%	0.723	S	S	*	*			cis	-137.7	140.4	-0.7	-159.8	0	0	0	0	109.4
1789	Y	22.6	Very low	24.2	Very low	179 Å²	179	138 Å²	138	70%	0.702	72%	0.715	S	S	*	*			trans	-69.7	132.2	154.4	-97.5	-101.6	0	0	0	107.4	H1831	Y1789-H1831 PolarHBondContact OH-CD2 3.44Å
1790	Q	23.6	Very low	24.2	Very low	159 Å²	159	140.3 Å²	140.3	74%	0.743	71%	0.714	S	S	*	*				-167.3	138.6	125.1	-111.6	178.7	28.4	0	0	114.7
1791	K	26.8	Very low	24.2	Very low	165 Å²	165	139 Å²	139	72%	0.717	72%	0.715	S	S	*	*			trans	75.2	139.6	148.7	-68.4	-172.5	-177.1	-176.9	0	119.3
1792	I	22.6	Very low	24.3	Very low	126 Å²	126	140 Å²	140	65%	0.646	72%	0.724	S	S	*	*			cis	-155.8	-178.8	-27.3	-138.5	174.1	0	0	0	108.3
1793	N	23.8	Very low	24.3	Very low	118 Å²	118	138.1 Å²	138.1	63%	0.631	72%	0.723	S	S	*	*			trans	-33.1	163.5	152.5	-29.5	-14.5	0	0	0	113.1
1794	D	24.5	Very low	24.1	Very low	140 Å²	140	138.1 Å²	138.1	75%	0.749	72%	0.717	S	S	*	*			cis	-164.5	159.5	47.2	-85.7	-57.4	0	0	0	107.7
1795	A	24.3	Very low	24.1	Very low	76 Å²	76	139 Å²	139	63%	0.628	72%	0.717	S	S	*	*			cis	-169.5	-174.2	-17.5	0	0	0	0	0	109
1796	A	23.1	Very low	24.1	Very low	74 Å²	74	133.8 Å²	133.8	61%	0.612	70%	0.695	S	S	*	*			trans	40.4	129.3	130.4	0	0	0	0	0	120.2
1797	N	22.2	Very low	24.2	Very low	147 Å²	147	125.9 Å²	125.9	79%	0.786	67%	0.671	S	S	*	*			trans	75.7	144.6	138.7	-62.2	-7.8	0	0	0	117.2
1798	T	23.2	Very low	24.3	Very low	116 Å²	116	124.3 Å²	124.3	71%	0.712	65%	0.653	S	S	*	*			cis	-164.3	173	-11.1	19.3	0	0	0	0	107
1799	A	23.7	Very low	24.3	Very low	74 Å²	74	123.9 Å²	123.9	61%	0.612	64%	0.64	S	S	*	*			trans	73.5	152.2	140.8	0	0	0	0	0	117.4
1800	K	24.6	Very low	24.4	Very low	166 Å²	166	117.1 Å²	117.1	72%	0.722	62%	0.624	S	S	*	*			cis	-161.9	147.1	-11.5	-114.2	163.4	-166.4	171.8	0	107.7
1801	H	26.2	Very low	24.4	Very low	146 Å²	146	117.5 Å²	117.5	68%	0.676	62%	0.624	S	S	*	*			trans	66.6	159.1	148.8	-63.3	-30	0	0	0	116.7
1802	K	26.1	Very low	24.3	Very low	159 Å²	159	116.1 Å²	116.1	69%	0.691	62%	0.624	S	S	*	*			cis	-157.8	154.7	-10.6	-120.1	167.9	-173.7	-178.2	0	109
1803	T	25.9	Very low	24.4	Very low	117 Å²	117	115.7 Å²	115.7	72%	0.718	62%	0.618	S	S	*	*			trans	63	134.8	154.3	45.3	0	0	0	0	118.2
1804	K	22.9	Very low	24.4	Very low	171 Å²	171	117.1 Å²	117.1	74%	0.743	62%	0.621	S	S	*	*				62	133.4	64.1	-73.4	-176.5	163	-157.1	0	112.4
1805	H	24.4	Very low	24.6	Very low	128 Å²	128	121.3 Å²	121.3	59%	0.593	63%	0.626	S	S	*	*			cis	-158.3	172.8	10.4	-111.9	-70.1	0	0	0	111.9
1806	N	24.3	Very low	24.7	Very low	86 Å²	86	126.2 Å²	126.2	46%	0.46	64%	0.636	S	S	.	*			trans	52.4	139.9	148.2	-68.1	31.9	0	0	0	124.3	S672 P673 T674 G675	S672-N1806 VanDerWaalsContact OG-CA 3.31Å; S672-N1806 WeakPolarHBondContact OG-CA 3.46Å; S672-N1806 WeakPolarHBondContact OG-CB 3.49Å; S672-N1806 PolarHBondContact OG-ND2 2.97Å; P673-N1806 VanDerWaalsContact CA-CA 3.4Å; T674-N1806 CarbonylContact C-O 3.26Å; T674-N1806 VanDerWaalsContact CA-O 3.23Å; T674-N1806 WeakPolarHBondContact CA-O 3.45Å; T674-N1806 PolarHBondContact N-O 2.84Å; T674-N1806 VanDerWaalsContact O-O 3.1Å; G675-N1806 PolarHBondContact N-O 2.77Å; G675-N1806 VanDerWaalsContact N-O 3.17Å
1807	D	26	Very low	25.1	Very low	65 Å²	65	127 Å²	127	35%	0.348	64%	0.637	S	S	.	*			trans	117.6	112	-162.9	-67	75.8	0	0	0	121.6	K671 S672 P673 T674	K671-D1807 VanDerWaalsContact C-OD1 3.27Å; K671-D1807 WeakPolarHBondContact CA-OD2 3.31Å; K671-D1807 WeakPolarHBondContact CB-OD2 3.49Å; K671-D1807 WeakPolarHBondContact CG-OD2 3.3Å; K671-D1807 VanDerWaalsContact O-CG 3.24Å; K671-D1807 VanDerWaalsContact O-OD2 3.09Å; S672-D1807 CarbonylContact C-O 2.77Å; S672-D1807 VanDerWaalsContact CA-N 3.3Å; S672-D1807 PolarHBondContact N-OD2 2.85Å; S672-D1807 PolarHBondContact OG-N 2.93Å; S672-D1807 PolarHBondContact OG-OD1 3.25Å; P673-D1807 CarbonylContact C-O 3.56Å; P673-D1807 WeakPolarHBondContact CA-O 3.46Å; P673-D1807 VanDerWaalsContact N-O 3.13Å; T674-D1807 WeakPolarHBondContact CB-O 3.36Å; T674-D1807 VanDerWaalsContact N-C 3.32Å; T674-D1807 PolarHBondContact N-O 3.17Å; T674-D1807 WeakPolarHBondContact O-CA 3.38Å; T674-D1807 PolarHBondContact OG1-O 3.44Å
1808	N	24.8	Very low	26.2	Very low	89 Å²	89	123.5 Å²	123.5	48%	0.476	62%	0.618	S	S	.	*			trans	-166.6	-164.2	178.4	-158.1	-3.1	0	0	0	120.9	K671 S672	K671-N1808 WeakPolarHBondContact CD-O 3.23Å; K671-N1808 WeakPolarHBondContact CG-O 3.27Å; S672-N1808 WeakPolarHBondContact O-CB 3.25Å; S672-N1808 PolarHBondContact O-ND2 3.12Å
1809	H	24.7	Very low	27.1	Very low	101 Å²	101	122.2 Å²	122.2	47%	0.468	61%	0.606	S	S	.	*				160.6	145.8	114.7	-130.1	-59.5	0	0	0	110.5	K671 K2557	K671-H1809 WeakPolarHBondContact CA-CD2 3.48Å; K671-H1809 HydrophobicContact CD-CB 4.29Å; K671-H1809 WeakPolarHBondContact CE-CD2 3.49Å; K671-H1809 HydrophobicContact CG-CB 3.98Å; K671-H1809 PolarHBondContact N-CD2 2.89Å; K671-H1809 PolarHBondContact N-NE2 2.99Å; H1809-K2557 PolarHBondContact O-NZ 3.3Å
1810	G	25.2	Very low	28.4	Very low	37 Å²	37	123.7 Å²	123.7	38%	0.381	60%	0.599	S	S	.	*			trans	66.7	160.5	157.6	0	0	0	0	0	117.3	K2557	G1810-K2557 WeakPolarHBondContact O-CE 3.4Å; G1810-K2557 PolarHBondContact O-NZ 3.09Å
1811	F	24	Very low	29.3	Very low	166 Å²	166	120 Å²	120	73%	0.728	59%	0.586	S	S	*	*			cis	-151.4	144	-2.5	-149.3	-89.9	0	0	0	106.7
1812	D	23.8	Very low	30.3	Very low	137 Å²	137	113.9 Å²	113.9	73%	0.733	56%	0.557	S	S	*	*			trans	-68.7	145.9	176.3	-81.5	-56.5	0	0	0	111.8
1813	F	24.1	Very low	30.8	Very low	116 Å²	116	112.9 Å²	112.9	51%	0.509	55%	0.553	S	S	.	*			trans	-138.7	141.8	152.5	-116.6	-79.3	0	0	0	112.4	P444 S445	P444-F1813 HydrophobicContact CB-CZ 4.15Å; P444-F1813 HydrophobicContact CG-CE1 3.85Å; P444-F1813 HydrophobicContact CG-CE2 4.25Å; P444-F1813 HydrophobicContact CG-CZ 3.41Å; P444-F1813 VanDerWaalsContact CG-CZ 3.41Å; P444-F1813 WeakPolarHBondContact O-CZ 3.43Å; S445-F1813 VanDerWaalsContact CB-CZ 3.45Å
1814	H	25.3	Very low	31	Very low	149 Å²	149	109.8 Å²	109.8	69%	0.69	54%	0.535	S	S	*	.			trans	-58.3	139	-177	-74.3	-111.6	0	0	0	111.9
1815	R	27.6	Very low	31.2	Very low	228 Å²	228	106.6 Å²	106.6	86%	0.86	53%	0.534	S	S	*	.			trans	-124.4	118.2	162.4	-171.1	175.1	-175	173.8	3	110.2	S1817	R1815-S1817 PolarHBondContact O-N 3.23Å; R1815-S1817 PolarHBondContact O-OG 2.88Å
1816	E	27.2	Very low	31.2	Very low	179 Å²	179	107.6 Å²	107.6	84%	0.836	54%	0.539	S	S	*	.			trans	-59.1	128	174.9	-61	176.8	115	0	0	110.4
1817	S	31.2	Very low	31.3	Very low	91 Å²	91	110 Å²	110	64%	0.636	55%	0.551	S	S	*	*			trans	-151.7	46.7	-176	40.6	0	0	0	0	110.9	R1815 L1819	R1815-S1817 PolarHBondContact O-N 3.23Å; R1815-S1817 PolarHBondContact O-OG 2.88Å; S1817-L1819 PolarHBondContact O-N 3.26Å
1818	N	45.4	Very low	31.3	Very low	72 Å²	72	113.1 Å²	113.1	39%	0.385	57%	0.566	S	S	.	*			trans	-72.9	-7.5	-174.1	-73.6	-35.6	0	0	0	115.1
1819	L	42.2	Very low	31.4	Very low	90 Å²	90	115.4 Å²	115.4	47%	0.471	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.7	117.4	171.7	-86.6	70.5	0	0	0	110.2	S1817 L1841 A1852	S1817-L1819 PolarHBondContact O-N 3.26Å; L1819-L1841 HydrophobicContact CD1-CD2 4.38Å; L1819-L1841 HydrophobicContact CG-CD2 4.19Å; L1819-A1852 HydrophobicContact CD2-CB 3.93Å; L1819-A1852 HydrophobicContact CG-CB 4.44Å
1820	K	50.5	Low	31.4	Very low	105 Å²	105	119.5 Å²	119.5	46%	0.457	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.4	103	158.2	-78.3	-169.8	174.6	-174.6	0	108.9	Y1822	K1820-Y1822 HydrophobicContact CB-CD2 4.41Å; K1820-Y1822 HydrophobicContact CB-CE2 4.3Å; K1820-Y1822 PolarHBondContact O-N 3.43Å
1821	I	44.6	Very low	31.7	Very low	89 Å²	89	124.3 Å²	124.3	46%	0.456	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.6	121	160.3	-57.3	172.4	0	0	0	105.9	K1823 V1837 L1839	I1821-K1823 HydrophobicContact CG2-CG 4.11Å; I1821-K1823 PolarHBondContact O-N 3.5Å; I1821-V1837 HydrophobicContact CG2-CG1 4.08Å; I1821-L1839 HydrophobicContact CG1-CD1 4.18Å
1822	Y	45.4	Very low	32.2	Very low	16 Å²	16	123.2 Å²	123.2	6%	0.063	60%	0.598	C	S	.	*			trans	-76.7	66.2	-178.7	-91.4	-112.3	0	0	0	111.3	K1820 P1824 V1837 F1838 R1840 D2046 N2048	K1820-Y1822 HydrophobicContact CB-CD2 4.41Å; K1820-Y1822 HydrophobicContact CB-CE2 4.3Å; K1820-Y1822 PolarHBondContact O-N 3.43Å; Y1822-P1824 WeakPolarHBondContact O-CD 3.42Å; Y1822-V1837 WeakPolarHBondContact O-CG1 3.48Å; Y1822-V1837 WeakPolarHBondContact O-CG2 3.28Å; Y1822-F1838 HydrophobicContact CD1-CZ 4.5Å; Y1822-F1838 HydrophobicContact CG-CZ 4.49Å; Y1822-F1838 PolarHBondContact N-O 3.33Å; Y1822-R1840 HydrophobicContact CD2-CB 3.9Å; Y1822-R1840 HydrophobicContact CE2-CB 3.65Å; Y1822-R1840 HydrophobicContact CE2-CG 4.3Å; Y1822-R1840 PolarHBondContact OH-NH1 3.04Å; Y1822-D2046 WeakPolarHBondContact CE1-OD1 3.49Å; Y1822-N2048 HydrophobicContact CE1-CB 3.87Å
1823	K	37.2	Very low	33.6	Very low	138 Å²	138	120.7 Å²	120.7	60%	0.6	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-72.2	121.2	165.5	-68.7	-171.1	171.6	-164.5	0	108.6	I1821 E1826	I1821-K1823 HydrophobicContact CG2-CG 4.11Å; I1821-K1823 PolarHBondContact O-N 3.5Å; K1823-E1826 IonicContact NZ-OE1 3.5Å
1824	P	30.3	Very low	35.1	Very low	52 Å²	52	120.1 Å²	120.1	34%	0.338	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-61.3	140.7	163.7	27.6	-33.6	0	0	0	108.7	Y1822 E1826 H1834	Y1822-P1824 WeakPolarHBondContact O-CD 3.42Å; P1824-E1826 PolarHBondContact O-N 3.38Å; P1824-H1834 HydrophobicContact CG-CB 4.43Å
1825	S	26.2	Very low	37.1	Very low	105 Å²	105	114 Å²	114	73%	0.734	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-52.1	128.8	-173.9	-56.3	0	0	0	0	112.5	I1827	S1825-I1827 VanDerWaalsContact C-N 3.26Å; S1825-I1827 PolarHBondContact O-N 3.08Å
1826	E	25	Very low	39.3	Very low	149 Å²	149	105 Å²	105	70%	0.696	52%	0.524	S	S	*	.			trans	-70.9	77.4	179.7	-71.3	177.2	-174.3	0	0	111.6	K1823 P1824	K1823-E1826 IonicContact NZ-OE1 3.5Å; P1824-E1826 PolarHBondContact O-N 3.38Å
1827	I	26.4	Very low	41.5	Very low	137 Å²	137	98.8 Å²	98.8	70%	0.703	50%	0.499	S	S	*	.			trans	-115.6	123.7	167.2	-62	-178	0	0	0	108.4	S1825 N1829	S1825-I1827 VanDerWaalsContact C-N 3.26Å; S1825-I1827 PolarHBondContact O-N 3.08Å; I1827-N1829 PolarHBondContact O-N 2.99Å
1828	I	26.4	Very low	44	Very low	130 Å²	130	94.6 Å²	94.6	67%	0.667	47%	0.469	S	S	*	.			trans	-70.4	95.8	-177.2	-58.2	169.6	0	0	0	109.5
1829	N	25.9	Very low	46.1	Very low	136 Å²	136	91.4 Å²	91.4	73%	0.727	45%	0.452	S	S	*	.			trans	-151.1	135.3	156.1	-100.8	-44.7	0	0	0	111.8	I1827	I1827-N1829 PolarHBondContact O-N 2.99Å
1830	R	25.8	Very low	48.4	Very low	188 Å²	188	87.8 Å²	87.8	71%	0.709	43%	0.432	S	S	*	.	S	Bend	trans	-81.1	151	173.3	-64.9	171.6	177.9	155.1	0.4	108.7	F2541	R1830-F2541 VanDerWaalsContact NH2-CZ 3.28Å
1831	H	30.4	Very low	50.4	Low	138 Å²	138	82.8 Å²	82.8	64%	0.639	41%	0.41	S	S	*	.			trans	92.2	32.2	174.4	-50.4	-71	0	0	0	119	Y1789	Y1789-H1831 PolarHBondContact OH-CD2 3.44Å
1832	H	36.1	Very low	52.4	Low	142 Å²	142	81.2 Å²	81.2	66%	0.657	40%	0.401	S	S	*	.			trans	-120	147	160	-74.1	-13.2	0	0	0	112.2	H1834	H1832-H1834 VanDerWaalsContact C-N 3.27Å; H1832-H1834 PolarHBondContact O-CD2 3.48Å; H1832-H1834 VanDerWaalsContact O-CD2 3.26Å; H1832-H1834 PolarHBondContact O-N 2.93Å
1833	H	51.7	Low	54.3	Low	85 Å²	85	82.2 Å²	82.2	39%	0.394	41%	0.41	S	S	.	.			trans	-81.2	60.7	-171.8	-68.8	-98.2	0	0	0	112.2	N1835 Y2151 Q2157	H1833-N1835 PolarHBondContact O-N 3.37Å; H1833-N1835 VanDerWaalsContact O-N 3.14Å; H1833-Y2151 AromaticContact CE1-CD1 3.54Å; H1833-Y2151 AromaticContact CE1-CE1 3.48Å; H1833-Y2151 VanDerWaalsContact CE1-CE1 3.48Å; H1833-Y2151 WeakPolarHBondContact CE1-CE1 3.47Å; H1833-Y2151 AromaticContact ND1-CD1 3.59Å; H1833-Y2151 AromaticContact ND1-CE1 3.45Å; H1833-Y2151 WeakPolarHBondContact ND1-CE1 3.24Å; H1833-Y2151 AromaticContact ND1-CZ 3.96Å; H1833-Q2157 PolarHBondContact O-NE2 2.83Å
1834	H	56.1	Low	56.7	Low	103 Å²	103	76 Å²	76	48%	0.477	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-62.5	116.6	-175.2	-61	-70.2	0	0	0	112.4	P1824 H1832 Q2157	P1824-H1834 HydrophobicContact CG-CB 4.43Å; H1832-H1834 VanDerWaalsContact C-N 3.27Å; H1832-H1834 PolarHBondContact O-CD2 3.48Å; H1832-H1834 VanDerWaalsContact O-CD2 3.26Å; H1832-H1834 PolarHBondContact O-N 2.93Å; H1834-Q2157 PolarHBondContact O-OE1 2.82Å
1835	N	68.8	Low	59.4	Low	20 Å²	20	78.3 Å²	78.3	11%	0.107	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-54.5	124.2	174.5	-170.5	14.7	0	0	0	110.1	H1833 V1837 P2158 C2159 T2160	H1833-N1835 PolarHBondContact O-N 3.37Å; H1833-N1835 VanDerWaalsContact O-N 3.14Å; N1835-V1837 PolarHBondContact O-N 3.37Å; N1835-P2158 PolarHBondContact OD1-O 3.4Å; N1835-C2159 WeakPolarHBondContact OD1-CA 3.47Å; N1835-T2160 PolarHBondContact ND2-O 3Å; N1835-T2160 PolarHBondContact OD1-N 2.74Å
1836	P	72.6	Confident	62.3	Low	39 Å²	39	74.5 Å²	74.5	25%	0.253	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-60.5	137.7	-177.7	18.2	-29.1	0	0	0	112.8	P2158 C2159	P1836-P2158 VanDerWaalsContact CD-O 3.29Å; P1836-P2158 WeakPolarHBondContact CD-O 3.38Å; P1836-P2158 WeakPolarHBondContact CG-O 3.44Å; P1836-C2159 HydrophobicContact CG-CB 4.49Å; P1836-C2159 PolarHBondContact O-SG 2.97Å
1837	V	73.1	Confident	65	Low	50 Å²	50	74.3 Å²	74.3	30%	0.303	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-58.8	132.6	-171.8	178.9	0	0	0	0	111.7	I1821 Y1822 N1835	I1821-V1837 HydrophobicContact CG2-CG1 4.08Å; Y1822-V1837 WeakPolarHBondContact O-CG1 3.48Å; Y1822-V1837 WeakPolarHBondContact O-CG2 3.28Å; N1835-V1837 PolarHBondContact O-N 3.37Å
1838	F	83.9	Confident	67.8	Low	3 Å²	3	69.6 Å²	69.6	1%	0.013	36%	0.36	C	S	.	.			trans	-133.9	162.5	168.8	65.5	-85.9	0	0	0	109.5	Y1822 R1840 P1862 V1864 Y2049 I2161	Y1822-F1838 HydrophobicContact CD1-CZ 4.5Å; Y1822-F1838 HydrophobicContact CG-CZ 4.49Å; Y1822-F1838 PolarHBondContact N-O 3.33Å; F1838-R1840 HydrophobicContact CE2-CB 4.32Å; F1838-P1862 HydrophobicContact CB-CG 4.27Å; F1838-P1862 WeakPolarHBondContact CB-O 3.46Å; F1838-V1864 HydrophobicContact CD2-CG2 4.14Å; F1838-V1864 HydrophobicContact CE2-CG2 3.94Å; F1838-Y2049 HydrophobicContact CE1-CE2 4.25Å; F1838-Y2049 WeakPolarHBondContact CE2-OH 3.35Å; F1838-Y2049 AromaticContact CZ-CE2 3.63Å; F1838-Y2049 HydrophobicContact CZ-CE2 3.63Å; F1838-Y2049 AromaticContact CZ-CZ 3.76Å; F1838-Y2049 WeakPolarHBondContact CZ-OH 3.45Å; F1838-I2161 HydrophobicContact CD1-CG1 4.32Å; F1838-I2161 HydrophobicContact CD2-CD1 4.32Å; F1838-I2161 HydrophobicContact CD2-CG1 4.49Å; F1838-I2161 HydrophobicContact CE1-CG1 4.15Å; F1838-I2161 HydrophobicContact CE2-CG1 4.33Å; F1838-I2161 HydrophobicContact CG-CD1 4.35Å; F1838-I2161 HydrophobicContact CZ-CG1 4.19Å
1839	L	89.8	Confident	71	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	130.7	178.1	173	60.4	0	0	0	111.3	I1821 L1841 A1852 E1856 L1863 V1864	I1821-L1839 HydrophobicContact CG1-CD1 4.18Å; L1839-L1841 HydrophobicContact CD1-CD2 4.11Å; L1839-L1841 HydrophobicContact CD2-CD2 4.24Å; L1839-L1841 HydrophobicContact CD2-CG 4.47Å; L1839-L1841 HydrophobicContact CG-CD2 4.23Å; L1839-L1841 HydrophobicContact CG-CG 4.29Å; L1839-A1852 HydrophobicContact CD2-CB 3.9Å; L1839-A1852 WeakPolarHBondContact CD2-O 3.47Å; L1839-E1856 HydrophobicContact CB-CB 4.42Å; L1839-E1856 HydrophobicContact CB-CG 3.92Å; L1839-E1856 HydrophobicContact CD2-CB 4.43Å; L1839-E1856 HydrophobicContact CD2-CG 3.85Å; L1839-L1863 HydrophobicContact CB-CD2 3.87Å; L1839-L1863 HydrophobicContact CB-CG 4.19Å; L1839-L1863 HydrophobicContact CD2-CD2 3.73Å; L1839-L1863 HydrophobicContact CG-CD2 3.97Å; L1839-L1863 WeakPolarHBondContact O-CA 3.25Å; L1839-V1864 PolarHBondContact O-N 2.84Å
1840	R	90.5	Very high	74.1	Confident	14 Å²	14	59.5 Å²	59.5	5%	0.053	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125.6	170.9	-172.3	173.1	175.7	-145.8	-5.8	111	Y1822 F1838 V1864 S1866	Y1822-R1840 HydrophobicContact CD2-CB 3.9Å; Y1822-R1840 HydrophobicContact CE2-CB 3.65Å; Y1822-R1840 HydrophobicContact CE2-CG 4.3Å; Y1822-R1840 PolarHBondContact OH-NH1 3.04Å; F1838-R1840 HydrophobicContact CE2-CB 4.32Å; R1840-V1864 CarbonylContact C-O 3.53Å; R1840-V1864 VanDerWaalsContact CA-O 3.28Å; R1840-V1864 WeakPolarHBondContact CA-O 3.42Å; R1840-V1864 HydrophobicContact CG-CB 4.25Å; R1840-V1864 HydrophobicContact CG-CG1 4.47Å; R1840-S1866 PolarHBondContact NE-OG 3.35Å; R1840-S1866 PolarHBondContact NH2-OG 3.17Å
1841	L	91.5	Very high	77.2	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.3	175.3	-60.7	173.3	0	0	0	108.8	L1819 L1839 N1849 A1852 V1864 I1865 S1866	L1819-L1841 HydrophobicContact CD1-CD2 4.38Å; L1819-L1841 HydrophobicContact CG-CD2 4.19Å; L1839-L1841 HydrophobicContact CD1-CD2 4.11Å; L1839-L1841 HydrophobicContact CD2-CD2 4.24Å; L1839-L1841 HydrophobicContact CD2-CG 4.47Å; L1839-L1841 HydrophobicContact CG-CD2 4.23Å; L1839-L1841 HydrophobicContact CG-CG 4.29Å; L1841-N1849 HydrophobicContact CD1-CB 3.92Å; L1841-A1852 HydrophobicContact CD2-CB 4.37Å; L1841-V1864 PolarHBondContact N-O 3.25Å; L1841-I1865 HydrophobicContact CB-CG1 4.27Å; L1841-I1865 HydrophobicContact CB-CG2 4.48Å; L1841-I1865 HydrophobicContact CD1-CD1 4.04Å; L1841-I1865 HydrophobicContact CD1-CG1 4.19Å; L1841-S1866 PolarHBondContact O-N 2.95Å
1842	H	87.6	Confident	80.2	Confident	56 Å²	56	50.8 Å²	50.8	26%	0.259	28%	0.281	S	S	.	.	S	Bend	trans	-87.9	-13.6	-171	-71	-78	0	0	0	114.8
1843	C	86	Confident	83	Confident	37 Å²	37	44 Å²	44	25%	0.25	25%	0.25	C	C	.	.			trans	-133.2	127.1	176.9	179.7	0	0	0	0	108.7	D1845 N1849	C1843-D1845 VanDerWaalsContact C-N 3.29Å; C1843-D1845 PolarHBondContact O-N 3.48Å; C1843-N1849 PolarHBondContact O-ND2 2.76Å
1844	P	87.6	Confident	85.1	Confident	8 Å²	8	41 Å²	41	5%	0.052	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-25.5	-178	25	-30.6	0	0	0	113.6	N1849 I1865 P1958	P1844-N1849 PolarHBondContact O-ND2 2.87Å; P1844-N1849 VanDerWaalsContact O-ND2 3.15Å; P1844-I1865 HydrophobicContact CB-CG2 3.92Å; P1844-P1958 HydrophobicContact CB-CB 4.45Å
1845	D	86.5	Confident	86.8	Confident	100 Å²	100	38.7 Å²	38.7	54%	0.535	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	3.3	-171.5	-62.1	-67.6	0	0	0	115.1	C1843 V1847 K1871	C1843-D1845 VanDerWaalsContact C-N 3.29Å; C1843-D1845 PolarHBondContact O-N 3.48Å; D1845-V1847 PolarHBondContact O-N 3.32Å; D1845-K1871 WeakPolarHBondContact OD1-CE 3.5Å; D1845-K1871 IonicContact OD1-NZ 3.53Å; D1845-K1871 PolarHBondContact OD1-NZ 2.9Å; D1845-K1871 WeakPolarHBondContact OD2-CE 3.26Å; D1845-K1871 IonicContact OD2-NZ 3.55Å
1846	S	87.4	Confident	88	Confident	26 Å²	26	38.7 Å²	38.7	18%	0.182	23%	0.23	C	C	.	.			trans	-64.4	123.4	179.6	143.5	0	0	0	0	111.2	G1848 N1849	S1846-G1848 PolarHBondContact O-N 3.48Å; S1846-N1849 WeakPolarHBondContact CB-OD1 3.25Å; S1846-N1849 PolarHBondContact N-ND2 3.43Å; S1846-N1849 WeakPolarHBondContact O-CB 3.32Å; S1846-N1849 PolarHBondContact O-N 3.41Å; S1846-N1849 PolarHBondContact O-ND2 3.02Å; S1846-N1849 PolarHBondContact O-OD1 2.77Å; S1846-N1849 PolarHBondContact OG-OD1 3.41Å
1847	V	80.9	Confident	89.1	Confident	144 Å²	144	36.9 Å²	36.9	87%	0.873	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-34.9	-174.6	-177.3	0	0	0	0	112.5	D1845 N1849	D1845-V1847 PolarHBondContact O-N 3.32Å; V1847-N1849 PolarHBondContact O-N 2.95Å
1848	G	85.9	Confident	90	Very high	38 Å²	38	39.3 Å²	39.3	39%	0.392	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-10.6	177	0	0	0	0	0	114.9	S1846 L1850 L1851 A1852	S1846-G1848 PolarHBondContact O-N 3.48Å; G1848-L1850 VanDerWaalsContact C-N 3.3Å; G1848-L1850 PolarHBondContact O-N 3.48Å; G1848-L1851 PolarHBondContact O-N 3.3Å; G1848-A1852 PolarHBondContact O-N 2.62Å
1849	N	91.9	Very high	90.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-59.4	-37.8	-175.8	-72.8	-4	0	0	0	112.9	L1841 C1843 P1844 S1846 V1847 L1851 A1852 F1853 M1959	L1841-N1849 HydrophobicContact CD1-CB 3.92Å; C1843-N1849 PolarHBondContact O-ND2 2.76Å; P1844-N1849 PolarHBondContact O-ND2 2.87Å; P1844-N1849 VanDerWaalsContact O-ND2 3.15Å; S1846-N1849 WeakPolarHBondContact CB-OD1 3.25Å; S1846-N1849 PolarHBondContact N-ND2 3.43Å; S1846-N1849 WeakPolarHBondContact O-CB 3.32Å; S1846-N1849 PolarHBondContact O-N 3.41Å; S1846-N1849 PolarHBondContact O-ND2 3.02Å; S1846-N1849 PolarHBondContact O-OD1 2.77Å; S1846-N1849 PolarHBondContact OG-OD1 3.41Å; V1847-N1849 PolarHBondContact O-N 2.95Å; N1849-L1851 PolarHBondContact O-N 3.02Å; N1849-A1852 PolarHBondContact O-N 3.35Å; N1849-F1853 WeakPolarHBondContact O-CB 3.28Å; N1849-F1853 PolarHBondContact O-N 3.1Å; N1849-M1959 HydrophobicContact CB-CE 3.55Å; N1849-M1959 HydrophobicContact CB-SD 4.26Å
1850	L	91.6	Very high	90.7	Very high	54 Å²	54	46 Å²	46	28%	0.283	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-43.8	-174.6	-178.8	61.9	0	0	0	112.1	G1848 Q1854 Y1962	G1848-L1850 VanDerWaalsContact C-N 3.3Å; G1848-L1850 PolarHBondContact O-N 3.48Å; L1850-Q1854 HydrophobicContact CD1-CG 4.45Å; L1850-Q1854 VanDerWaalsContact O-CB 3.32Å; L1850-Q1854 WeakPolarHBondContact O-CB 3.45Å; L1850-Q1854 WeakPolarHBondContact O-CG 3.01Å; L1850-Q1854 PolarHBondContact O-N 2.83Å; L1850-Y1962 HydrophobicContact CD1-CD2 4.44Å; L1850-Y1962 HydrophobicContact CD1-CE2 3.86Å
1851	L	92.1	Very high	90.8	Very high	129 Å²	129	47.3 Å²	47.3	68%	0.675	26%	0.256	S	S	*	.	H	α-helix	trans	-71.1	-38.2	179.2	-63	175.8	0	0	0	111.6	G1848 N1849 Q1854 S1855	G1848-L1851 PolarHBondContact O-N 3.3Å; N1849-L1851 PolarHBondContact O-N 3.02Å; L1851-Q1854 PolarHBondContact O-N 3.24Å; L1851-S1855 WeakPolarHBondContact O-CB 3.41Å; L1851-S1855 PolarHBondContact O-N 2.98Å
1852	A	92.4	Very high	91	Very high	14 Å²	14	47.4 Å²	47.4	12%	0.116	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-44.3	176.5	0	0	0	0	0	111.6	L1819 L1839 L1841 G1848 N1849 S1855 E1856	L1819-A1852 HydrophobicContact CD2-CB 3.93Å; L1819-A1852 HydrophobicContact CG-CB 4.44Å; L1839-A1852 HydrophobicContact CD2-CB 3.9Å; L1839-A1852 WeakPolarHBondContact CD2-O 3.47Å; L1841-A1852 HydrophobicContact CD2-CB 4.37Å; G1848-A1852 PolarHBondContact O-N 2.62Å; N1849-A1852 PolarHBondContact O-N 3.35Å; A1852-S1855 PolarHBondContact O-N 3.3Å; A1852-E1856 PolarHBondContact O-N 3.07Å
1853	F	95.3	Very high	91.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-55.7	-56	171.6	179.9	-89	0	0	0	110.3	N1849 S1855 E1856 W1857 L1863 M1959 Y1962 F2170	N1849-F1853 WeakPolarHBondContact O-CB 3.28Å; N1849-F1853 PolarHBondContact O-N 3.1Å; F1853-S1855 VanDerWaalsContact C-N 3.29Å; F1853-S1855 PolarHBondContact O-N 2.9Å; F1853-E1856 PolarHBondContact O-N 2.99Å; F1853-W1857 HydrophobicContact CD1-CB 4.2Å; F1853-W1857 HydrophobicContact CD1-CG 4.4Å; F1853-W1857 HydrophobicContact CE1-CB 3.97Å; F1853-W1857 AromaticContact CE1-CD1 3.85Å; F1853-W1857 AromaticContact CE1-CD2 4Å; F1853-W1857 HydrophobicContact CE1-CD2 4Å; F1853-W1857 AromaticContact CE1-CG 3.68Å; F1853-W1857 HydrophobicContact CE1-CG 3.68Å; F1853-W1857 HydrophobicContact CE2-CD2 4.36Å; F1853-W1857 HydrophobicContact CE2-CE3 4.3Å; F1853-W1857 HydrophobicContact CZ-CB 4.36Å; F1853-W1857 AromaticContact CZ-CD2 3.64Å; F1853-W1857 HydrophobicContact CZ-CD2 3.64Å; F1853-W1857 AromaticContact CZ-CE2 3.9Å; F1853-W1857 HydrophobicContact CZ-CE3 4Å; F1853-W1857 AromaticContact CZ-CG 3.86Å; F1853-W1857 HydrophobicContact CZ-CG 3.86Å; F1853-W1857 HydrophobicContact CZ-CZ2 4.41Å; F1853-W1857 WeakPolarHBondContact O-CB 3.38Å; F1853-W1857 PolarHBondContact O-N 3.25Å; F1853-L1863 HydrophobicContact CB-CD2 4.5Å; F1853-L1863 HydrophobicContact CD2-CD1 4.34Å; F1853-L1863 HydrophobicContact CD2-CD2 3.87Å; F1853-L1863 HydrophobicContact CE2-CD1 4.26Å; F1853-L1863 HydrophobicContact CG-CD2 4.49Å; F1853-M1959 HydrophobicContact CB-SD 4.08Å; F1853-M1959 HydrophobicContact CD2-CG 3.8Å; F1853-M1959 HydrophobicContact CD2-SD 4.43Å; F1853-M1959 HydrophobicContact CE2-CG 4.15Å; F1853-M1959 HydrophobicContact CG-CG 4.05Å; F1853-M1959 HydrophobicContact CG-SD 4.19Å; F1853-Y1962 HydrophobicContact CD1-CD2 4.22Å; F1853-Y1962 AromaticContact CD1-CE2 3.93Å; F1853-Y1962 HydrophobicContact CD1-CE2 3.93Å; F1853-Y1962 HydrophobicContact CE1-CD1 4.17Å; F1853-Y1962 AromaticContact CE1-CD2 3.82Å; F1853-Y1962 HydrophobicContact CE1-CD2 3.82Å; F1853-Y1962 HydrophobicContact CE1-CE1 4.14Å; F1853-Y1962 AromaticContact CE1-CE2 3.8Å; F1853-Y1962 HydrophobicContact CE1-CE2 3.8Å; F1853-Y1962 HydrophobicContact CE1-CG 4.01Å; F1853-Y1962 AromaticContact CE1-CZ 3.96Å; F1853-F2170 HydrophobicContact CE2-CB 4.46Å; F1853-F2170 AromaticContact CE2-CD1 3.49Å; F1853-F2170 HydrophobicContact CE2-CD1 3.49Å; F1853-F2170 VanDerWaalsContact CE2-CD1 3.49Å; F1853-F2170 HydrophobicContact CE2-CD2 4.48Å; F1853-F2170 AromaticContact CE2-CE1 3.68Å; F1853-F2170 HydrophobicContact CE2-CE1 3.68Å; F1853-F2170 AromaticContact CE2-CG 3.91Å; F1853-F2170 HydrophobicContact CE2-CG 3.91Å; F1853-F2170 HydrophobicContact CE2-CZ 4.28Å; F1853-F2170 AromaticContact CZ-CD1 3.84Å; F1853-F2170 HydrophobicContact CZ-CD1 3.84Å; F1853-F2170 HydrophobicContact CZ-CE1 4Å
1854	Q	95.2	Very high	91.9	Very high	21 Å²	21	43 Å²	43	10%	0.098	23%	0.232	C	C	.	.	H	α-helix	trans	-58.6	-35.6	-179	-78.2	179.5	-20.8	0	0	114	Y1464 L1850 L1851 R1858 Y1962	Y1464-Q1854 HydrophobicContact CE2-CB 4.5Å; Y1464-Q1854 HydrophobicContact CE2-CG 4.18Å; Y1464-Q1854 VanDerWaalsContact CZ-CD 3.42Å; Y1464-Q1854 VanDerWaalsContact CZ-NE2 3.28Å; Y1464-Q1854 WeakPolarHBondContact OH-CB 3.43Å; Y1464-Q1854 VanDerWaalsContact OH-CG 3.31Å; Y1464-Q1854 WeakPolarHBondContact OH-CG 3.17Å; L1850-Q1854 HydrophobicContact CD1-CG 4.45Å; L1850-Q1854 VanDerWaalsContact O-CB 3.32Å; L1850-Q1854 WeakPolarHBondContact O-CB 3.45Å; L1850-Q1854 WeakPolarHBondContact O-CG 3.01Å; L1850-Q1854 PolarHBondContact O-N 2.83Å; L1851-Q1854 PolarHBondContact O-N 3.24Å; Q1854-R1858 WeakPolarHBondContact O-CB 3.49Å; Q1854-R1858 VanDerWaalsContact O-CG 3.22Å; Q1854-R1858 WeakPolarHBondContact O-CG 3.28Å; Q1854-R1858 PolarHBondContact O-N 3.3Å; Q1854-Y1962 HydrophobicContact CG-CE2 4.34Å; Q1854-Y1962 WeakPolarHBondContact CG-OH 3.29Å; Q1854-Y1962 PolarHBondContact NE2-OH 2.64Å
1855	S	92.5	Very high	92.3	Very high	54 Å²	54	42.6 Å²	42.6	38%	0.378	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-42.6	177.7	-170	0	0	0	0	112.3	L1851 A1852 F1853 R1859	L1851-S1855 WeakPolarHBondContact O-CB 3.41Å; L1851-S1855 PolarHBondContact O-N 2.98Å; A1852-S1855 PolarHBondContact O-N 3.3Å; F1853-S1855 VanDerWaalsContact C-N 3.29Å; F1853-S1855 PolarHBondContact O-N 2.9Å; S1855-R1859 PolarHBondContact O-NH1 3.48Å; S1855-R1859 PolarHBondContact OG-NH1 3.04Å
1856	E	93.2	Very high	92.6	Very high	21 Å²	21	38.1 Å²	38.1	10%	0.098	21%	0.206	C	C	.	.	H	α-helix	trans	-89.8	-31.2	-177.6	-64.2	-59.6	128.3	0	0	113.1	L1839 A1852 F1853 R1858 R1859 H1861 L1863	L1839-E1856 HydrophobicContact CB-CB 4.42Å; L1839-E1856 HydrophobicContact CB-CG 3.92Å; L1839-E1856 HydrophobicContact CD2-CB 4.43Å; L1839-E1856 HydrophobicContact CD2-CG 3.85Å; A1852-E1856 PolarHBondContact O-N 3.07Å; F1853-E1856 PolarHBondContact O-N 2.99Å; E1856-R1858 VanDerWaalsContact C-N 3.35Å; E1856-R1859 WeakPolarHBondContact O-CA 3.49Å; E1856-R1859 WeakPolarHBondContact O-CB 3.22Å; E1856-R1859 PolarHBondContact O-N 2.87Å; E1856-R1859 IonicContact OE1-CZ 2.7Å; E1856-R1859 IonicContact OE1-NH1 2.67Å; E1856-R1859 PolarHBondContact OE1-NH1 3.09Å; E1856-H1861 PolarHBondContact O-N 2.87Å; E1856-H1861 IonicContact OE2-CE1 3.1Å; E1856-H1861 IonicContact OE2-CG 3.63Å; E1856-H1861 IonicContact OE2-ND1 3.14Å; E1856-H1861 PolarHBondContact OE2-ND1 3.08Å; E1856-L1863 HydrophobicContact CB-CD2 4.32Å
1857	W	95.6	Very high	92.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-42.4	174.2	-159.1	-117.4	0	0	0	110.7	F1853 R1859 N1860 L1863 D2011 F2170 P2172 F2192 S2194 H2197	F1853-W1857 HydrophobicContact CD1-CB 4.2Å; F1853-W1857 HydrophobicContact CD1-CG 4.4Å; F1853-W1857 HydrophobicContact CE1-CB 3.97Å; F1853-W1857 AromaticContact CE1-CD1 3.85Å; F1853-W1857 AromaticContact CE1-CD2 4Å; F1853-W1857 HydrophobicContact CE1-CD2 4Å; F1853-W1857 AromaticContact CE1-CG 3.68Å; F1853-W1857 HydrophobicContact CE1-CG 3.68Å; F1853-W1857 HydrophobicContact CE2-CD2 4.36Å; F1853-W1857 HydrophobicContact CE2-CE3 4.3Å; F1853-W1857 HydrophobicContact CZ-CB 4.36Å; F1853-W1857 AromaticContact CZ-CD2 3.64Å; F1853-W1857 HydrophobicContact CZ-CD2 3.64Å; F1853-W1857 AromaticContact CZ-CE2 3.9Å; F1853-W1857 HydrophobicContact CZ-CE3 4Å; F1853-W1857 AromaticContact CZ-CG 3.86Å; F1853-W1857 HydrophobicContact CZ-CG 3.86Å; F1853-W1857 HydrophobicContact CZ-CZ2 4.41Å; F1853-W1857 WeakPolarHBondContact O-CB 3.38Å; F1853-W1857 PolarHBondContact O-N 3.25Å; W1857-R1859 PolarHBondContact O-N 3.41Å; W1857-N1860 PolarHBondContact O-N 3.17Å; W1857-L1863 HydrophobicContact CE3-CD1 3.48Å; W1857-L1863 VanDerWaalsContact CE3-CD1 3.48Å; W1857-L1863 HydrophobicContact CZ3-CD1 4.02Å; W1857-D2011 HydrophobicContact CH2-CB 4.42Å; W1857-D2011 HydrophobicContact CZ2-CB 3.8Å; W1857-D2011 WeakPolarHBondContact CZ2-OD1 3.42Å; W1857-F2170 HydrophobicContact CH2-CB 4.11Å; W1857-F2170 HydrophobicContact CH2-CD1 4.45Å; W1857-F2170 HydrophobicContact CZ3-CB 3.79Å; W1857-P2172 HydrophobicContact CE3-CG 4.23Å; W1857-P2172 HydrophobicContact CH2-CG 4.2Å; W1857-P2172 HydrophobicContact CZ3-CG 3.74Å; W1857-F2192 HydrophobicContact CH2-CZ 4.02Å; W1857-F2192 AromaticContact CZ2-CE2 3.74Å; W1857-F2192 HydrophobicContact CZ2-CE2 3.74Å; W1857-F2192 AromaticContact CZ2-CZ 3.52Å; W1857-F2192 HydrophobicContact CZ2-CZ 3.52Å; W1857-S2194 PolarHBondContact NE1-OG 3.14Å; W1857-H2197 AromaticContact CD1-CE1 3.85Å; W1857-H2197 AromaticContact CD2-CE1 3.42Å; W1857-H2197 VanDerWaalsContact CD2-CE1 3.42Å; W1857-H2197 AromaticContact CE2-CE1 3.25Å; W1857-H2197 AromaticContact CE2-ND1 3.46Å; W1857-H2197 AromaticContact CE3-CE1 3.87Å; W1857-H2197 AromaticContact CG-CE1 3.85Å; W1857-H2197 AromaticContact CZ2-CE1 3.63Å; W1857-H2197 AromaticContact CZ2-ND1 3.62Å; W1857-H2197 AromaticContact NE1-CE1 3.45Å; W1857-H2197 PolarHBondContact NE1-CE1 3.41Å; W1857-H2197 AromaticContact NE1-ND1 3.46Å; W1857-H2197 PolarHBondContact NE1-ND1 3.37Å; W1857-H2197 PolarHBondContact O-NE2 3.44Å
1858	R	93.4	Very high	93.5	Very high	101 Å²	101	30.3 Å²	30.3	38%	0.381	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-7.7	169.6	-73.7	177.9	174.7	-159.9	0.4	114.8	Y1464 E1467 C1468 Q1854 E1856 E2196	Y1464-R1858 VanDerWaalsContact CZ-NH2 3.27Å; Y1464-R1858 PolarHBondContact OH-NE 3.06Å; Y1464-R1858 PolarHBondContact OH-NH2 2.95Å; E1467-R1858 IonicContact OE1-CZ 2.68Å; E1467-R1858 IonicContact OE1-NH1 2.99Å; E1467-R1858 PolarHBondContact OE1-NH1 3.19Å; E1467-R1858 IonicContact OE1-NH2 2.79Å; E1467-R1858 PolarHBondContact OE1-NH2 3.38Å; E1467-R1858 VanDerWaalsContact OE1-NH2 3.1Å; E1467-R1858 IonicContact OE2-CZ 2.74Å; E1467-R1858 IonicContact OE2-NH1 2.67Å; E1467-R1858 IonicContact OE2-NH2 3.74Å; E1467-R1858 PolarHBondContact OE2-NH2 3.41Å; C1468-R1858 PolarHBondContact SG-NH2 3.43Å; Q1854-R1858 WeakPolarHBondContact O-CB 3.49Å; Q1854-R1858 VanDerWaalsContact O-CG 3.22Å; Q1854-R1858 WeakPolarHBondContact O-CG 3.28Å; Q1854-R1858 PolarHBondContact O-N 3.3Å; E1856-R1858 VanDerWaalsContact C-N 3.35Å; R1858-E2196 HydrophobicContact CG-CG 3.71Å
1859	R	93.1	Very high	93.7	Very high	124 Å²	124	29 Å²	29	47%	0.468	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	6.9	174.8	-62.4	179.2	174.6	95.7	25.8	113.2	S1855 E1856 W1857 H1861	S1855-R1859 PolarHBondContact O-NH1 3.48Å; S1855-R1859 PolarHBondContact OG-NH1 3.04Å; E1856-R1859 WeakPolarHBondContact O-CA 3.49Å; E1856-R1859 WeakPolarHBondContact O-CB 3.22Å; E1856-R1859 PolarHBondContact O-N 2.87Å; E1856-R1859 IonicContact OE1-CZ 2.7Å; E1856-R1859 IonicContact OE1-NH1 2.67Å; E1856-R1859 PolarHBondContact OE1-NH1 3.09Å; W1857-R1859 PolarHBondContact O-N 3.41Å; R1859-H1861 PolarHBondContact O-CD2 3.01Å; R1859-H1861 PolarHBondContact O-N 2.57Å
1860	N	93.6	Very high	93.7	Very high	23 Å²	23	35.5 Å²	35.5	12%	0.123	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	23.5	-174.4	-46	-26.8	0	0	0	113.4	W1857 P2106 E2107 P2172 H2197 Q2200	W1857-N1860 PolarHBondContact O-N 3.17Å; N1860-P2106 HydrophobicContact CB-CG 4.02Å; N1860-E2107 PolarHBondContact ND2-OE1 2.86Å; N1860-P2172 WeakPolarHBondContact O-CG 3.44Å; N1860-H2197 PolarHBondContact OD1-CD2 2.93Å; N1860-H2197 VanDerWaalsContact OD1-CD2 3.32Å; N1860-H2197 PolarHBondContact OD1-NE2 3.3Å; N1860-Q2200 PolarHBondContact ND2-NE2 2.97Å; N1860-Q2200 PolarHBondContact OD1-NE2 2.94Å
1861	H	94	Very high	93.7	Very high	43 Å²	43	35.7 Å²	35.7	20%	0.199	17%	0.165	C	C	.	.			trans	-84.3	142.9	178.3	-65.3	165.9	0	0	0	111.1	E1856 R1859 L1863 P2172	E1856-H1861 PolarHBondContact O-N 2.87Å; E1856-H1861 IonicContact OE2-CE1 3.1Å; E1856-H1861 IonicContact OE2-CG 3.63Å; E1856-H1861 IonicContact OE2-ND1 3.14Å; E1856-H1861 PolarHBondContact OE2-ND1 3.08Å; R1859-H1861 PolarHBondContact O-CD2 3.01Å; R1859-H1861 PolarHBondContact O-N 2.57Å; H1861-L1863 WeakPolarHBondContact O-CD1 3.36Å; H1861-P2172 WeakPolarHBondContact O-CG 3.34Å
1862	P	96.2	Very high	93.9	Very high	1 Å²	1	30 Å²	30	1%	0.006	14%	0.135	C	C	.	.			trans	-69.1	158.7	167	30.8	-34	0	0	0	111.1	F1838 I2103 C2159 I2161 F2170	F1838-P1862 HydrophobicContact CB-CG 4.27Å; F1838-P1862 WeakPolarHBondContact CB-O 3.46Å; P1862-I2103 HydrophobicContact CB-CD1 3.83Å; P1862-I2103 HydrophobicContact CB-CG2 4.3Å; P1862-I2103 HydrophobicContact CG-CB 4.49Å; P1862-I2103 HydrophobicContact CG-CD1 4.41Å; P1862-I2103 HydrophobicContact CG-CG2 4.28Å; P1862-C2159 HydrophobicContact CG-CB 4.01Å; P1862-I2161 HydrophobicContact CB-CD1 4.46Å; P1862-I2161 HydrophobicContact CG-CD1 4.49Å; P1862-F2170 WeakPolarHBondContact CA-O 3.43Å; P1862-F2170 WeakPolarHBondContact CB-O 3.2Å
1863	L	95.6	Very high	94	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	158	175.5	-64.3	93.5	0	0	0	111.7	L1839 F1853 E1856 W1857 H1861 V2169 F2170	L1839-L1863 HydrophobicContact CB-CD2 3.87Å; L1839-L1863 HydrophobicContact CB-CG 4.19Å; L1839-L1863 HydrophobicContact CD2-CD2 3.73Å; L1839-L1863 HydrophobicContact CG-CD2 3.97Å; L1839-L1863 WeakPolarHBondContact O-CA 3.25Å; F1853-L1863 HydrophobicContact CB-CD2 4.5Å; F1853-L1863 HydrophobicContact CD2-CD1 4.34Å; F1853-L1863 HydrophobicContact CD2-CD2 3.87Å; F1853-L1863 HydrophobicContact CE2-CD1 4.26Å; F1853-L1863 HydrophobicContact CG-CD2 4.49Å; E1856-L1863 HydrophobicContact CB-CD2 4.32Å; W1857-L1863 HydrophobicContact CE3-CD1 3.48Å; W1857-L1863 VanDerWaalsContact CE3-CD1 3.48Å; W1857-L1863 HydrophobicContact CZ3-CD1 4.02Å; H1861-L1863 WeakPolarHBondContact O-CD1 3.36Å; L1863-V2169 WeakPolarHBondContact O-CA 3.37Å; L1863-F2170 HydrophobicContact CB-CB 4.2Å; L1863-F2170 PolarHBondContact N-O 2.82Å; L1863-F2170 PolarHBondContact O-N 3.21Å
1864	V	96	Very high	93.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	124.6	171.2	-176.8	0	0	0	0	109.8	F1838 L1839 R1840 L1841 I2161 D2167 A2168 V2169	F1838-V1864 HydrophobicContact CD2-CG2 4.14Å; F1838-V1864 HydrophobicContact CE2-CG2 3.94Å; L1839-V1864 PolarHBondContact O-N 2.84Å; R1840-V1864 CarbonylContact C-O 3.53Å; R1840-V1864 VanDerWaalsContact CA-O 3.28Å; R1840-V1864 WeakPolarHBondContact CA-O 3.42Å; R1840-V1864 HydrophobicContact CG-CB 4.25Å; R1840-V1864 HydrophobicContact CG-CG1 4.47Å; L1841-V1864 PolarHBondContact N-O 3.25Å; V1864-I2161 HydrophobicContact CG2-CD1 3.99Å; V1864-I2161 HydrophobicContact CG2-CG1 4.42Å; V1864-I2161 HydrophobicContact CG2-CG2 3.85Å; V1864-D2167 HydrophobicContact CG1-CB 4.02Å; V1864-A2168 CarbonylContact C-O 3.57Å; V1864-A2168 WeakPolarHBondContact CA-O 3.37Å; V1864-V2169 HydrophobicContact CG2-CG2 4.48Å
1865	I	95.5	Very high	93.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	104.8	171.8	-54.1	-169	0	0	0	108	L1841 P1844 C1868 P1958 M1959 A2168 F2170	L1841-I1865 HydrophobicContact CB-CG1 4.27Å; L1841-I1865 HydrophobicContact CB-CG2 4.48Å; L1841-I1865 HydrophobicContact CD1-CD1 4.04Å; L1841-I1865 HydrophobicContact CD1-CG1 4.19Å; P1844-I1865 HydrophobicContact CB-CG2 3.92Å; I1865-C1868 PolarHBondContact O-SG 3.26Å; I1865-P1958 HydrophobicContact CB-CB 4.36Å; I1865-P1958 HydrophobicContact CD1-CB 4.07Å; I1865-P1958 HydrophobicContact CG2-CB 4.05Å; I1865-M1959 HydrophobicContact CD1-CE 4.38Å; I1865-M1959 HydrophobicContact CD1-CG 3.75Å; I1865-A2168 HydrophobicContact CB-CB 4.46Å; I1865-A2168 PolarHBondContact N-O 3.26Å; I1865-A2168 PolarHBondContact O-N 2.95Å; I1865-F2170 HydrophobicContact CB-CE2 4.39Å; I1865-F2170 HydrophobicContact CD1-CD2 4.3Å; I1865-F2170 HydrophobicContact CD1-CE2 3.6Å; I1865-F2170 HydrophobicContact CD1-CZ 4.12Å; I1865-F2170 HydrophobicContact CG1-CD2 4.2Å; I1865-F2170 HydrophobicContact CG1-CE2 3.83Å
1866	S	94	Very high	94	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.042	18%	0.177	C	C	.	.			trans	-81.8	159.1	-179.4	-67.8	0	0	0	0	112.1	R1840 L1841 D2167	R1840-S1866 PolarHBondContact NE-OG 3.35Å; R1840-S1866 PolarHBondContact NH2-OG 3.17Å; L1841-S1866 PolarHBondContact O-N 2.95Å; S1866-D2167 VanDerWaalsContact CA-OD1 3.22Å; S1866-D2167 WeakPolarHBondContact CA-OD1 3.32Å; S1866-D2167 WeakPolarHBondContact CB-OD1 3.48Å; S1866-D2167 PolarHBondContact OG-OD1 3.09Å
1867	G	91.4	Very high	94.1	Very high	6 Å²	6	38.5 Å²	38.5	6%	0.062	17%	0.173	C	C	.	.			trans	81.8	14	171.6	0	0	0	0	0	114.5	Q1869 R1870 G2166	G1867-Q1869 VanDerWaalsContact C-N 3.33Å; G1867-Q1869 PolarHBondContact O-N 3.45Å; G1867-R1870 PolarHBondContact O-NE 3.44Å; G1867-G2166 PolarHBondContact N-O 3.44Å
1868	C	94.1	Very high	94.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.007	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-68.3	-31	-178.9	-62	0	0	0	0	112.3	I1865 R1870 K1871 F1872 G2166	I1865-C1868 PolarHBondContact O-SG 3.26Å; C1868-R1870 PolarHBondContact O-N 3.08Å; C1868-K1871 WeakPolarHBondContact O-CB 3.45Å; C1868-K1871 PolarHBondContact O-N 3.08Å; C1868-F1872 HydrophobicContact CB-CE2 4.28Å; C1868-F1872 VanDerWaalsContact O-CD2 3.27Å; C1868-F1872 WeakPolarHBondContact O-CD2 3.44Å; C1868-G2166 VanDerWaalsContact CB-O 3.3Å; C1868-G2166 WeakPolarHBondContact CB-O 3.49Å; C1868-G2166 PolarHBondContact N-O 3.37Å
1869	Q	91.1	Very high	94.2	Very high	11 Å²	11	35.9 Å²	35.9	5%	0.051	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-52.5	-30.7	-179.4	74.8	-69.2	0.4	0	0	113.6	G1867 K1871 F1872 Q1874 E2094 G2166	G1867-Q1869 VanDerWaalsContact C-N 3.33Å; G1867-Q1869 PolarHBondContact O-N 3.45Å; Q1869-K1871 PolarHBondContact O-N 3.49Å; Q1869-K1871 VanDerWaalsContact O-N 3.1Å; Q1869-F1872 PolarHBondContact O-N 3.11Å; Q1869-F1872 VanDerWaalsContact O-N 3.14Å; Q1869-Q1874 PolarHBondContact O-NE2 3.17Å; Q1869-E2094 VanDerWaalsContact NE2-CG 3.3Å; Q1869-E2094 PolarHBondContact NE2-OE1 2.85Å; Q1869-G2166 VanDerWaalsContact OE1-CA 3.31Å
1870	R	91.5	Very high	94.3	Very high	136 Å²	136	35.3 Å²	35.3	51%	0.513	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-63	-14.4	178.5	-63.9	-176.6	-71	-121.4	8.8	114	G1867 C1868 E2094	G1867-R1870 PolarHBondContact O-NE 3.44Å; C1868-R1870 PolarHBondContact O-N 3.08Å; R1870-E2094 VanDerWaalsContact CD-OE1 3.3Å; R1870-E2094 WeakPolarHBondContact CD-OE1 3.21Å; R1870-E2094 IonicContact CZ-OE1 2.71Å; R1870-E2094 IonicContact NE-OE1 3.26Å; R1870-E2094 IonicContact NH1-OE1 2.73Å; R1870-E2094 PolarHBondContact NH1-OE1 3.26Å; R1870-E2094 IonicContact NH1-OE2 3.16Å; R1870-E2094 PolarHBondContact NH1-OE2 2.83Å
1871	K	92.8	Very high	94.4	Very high	58 Å²	58	35.1 Å²	35.1	25%	0.252	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-92.1	-28.7	175.2	-62.7	-168.3	168	-160	0	114.5	D1845 C1868 Q1869 N1956	D1845-K1871 WeakPolarHBondContact OD1-CE 3.5Å; D1845-K1871 IonicContact OD1-NZ 3.53Å; D1845-K1871 PolarHBondContact OD1-NZ 2.9Å; D1845-K1871 WeakPolarHBondContact OD2-CE 3.26Å; D1845-K1871 IonicContact OD2-NZ 3.55Å; C1868-K1871 WeakPolarHBondContact O-CB 3.45Å; C1868-K1871 PolarHBondContact O-N 3.08Å; Q1869-K1871 PolarHBondContact O-N 3.49Å; Q1869-K1871 VanDerWaalsContact O-N 3.1Å; K1871-N1956 HydrophobicContact CB-CB 3.8Å; K1871-N1956 HydrophobicContact CD-CB 4.34Å; K1871-N1956 PolarHBondContact O-ND2 3.39Å; K1871-N1956 VanDerWaalsContact O-ND2 3.09Å; K1871-N1956 PolarHBondContact O-OD1 3.01Å
1872	F	95.1	Very high	94.4	Very high	10 Å²	10	33.1 Å²	33.1	4%	0.044	16%	0.162	C	C	.	.	S	Bend	trans	-86.7	144.5	-169.1	-71.9	-104.6	0	0	0	111.5	C1868 Q1869 Q1874 W1877 D1952 L1953 N1956 V2015 L2017	C1868-F1872 HydrophobicContact CB-CE2 4.28Å; C1868-F1872 VanDerWaalsContact O-CD2 3.27Å; C1868-F1872 WeakPolarHBondContact O-CD2 3.44Å; Q1869-F1872 PolarHBondContact O-N 3.11Å; Q1869-F1872 VanDerWaalsContact O-N 3.14Å; F1872-Q1874 VanDerWaalsContact C-N 3.33Å; F1872-Q1874 PolarHBondContact O-N 2.91Å; F1872-W1877 HydrophobicContact CD1-CZ2 4.36Å; F1872-W1877 AromaticContact CD1-NE1 3.72Å; F1872-D1952 WeakPolarHBondContact CD1-OD2 3.49Å; F1872-L1953 HydrophobicContact CE1-CB 4.46Å; F1872-L1953 HydrophobicContact CE1-CD1 3.68Å; F1872-L1953 HydrophobicContact CZ-CD1 4.07Å; F1872-N1956 HydrophobicContact CD1-CB 4.31Å; F1872-N1956 HydrophobicContact CD2-CB 3.97Å; F1872-N1956 HydrophobicContact CE1-CB 4.11Å; F1872-N1956 HydrophobicContact CE2-CB 3.72Å; F1872-N1956 HydrophobicContact CG-CB 4.26Å; F1872-N1956 HydrophobicContact CZ-CB 3.8Å; F1872-V2015 HydrophobicContact CE2-CG1 4.24Å; F1872-V2015 HydrophobicContact CZ-CG1 4.1Å; F1872-L2017 HydrophobicContact CD1-CD2 3.5Å; F1872-L2017 VanDerWaalsContact CD1-CD2 3.5Å; F1872-L2017 HydrophobicContact CD2-CD2 4.35Å; F1872-L2017 HydrophobicContact CE1-CD2 3.37Å; F1872-L2017 HydrophobicContact CE2-CD2 4.3Å; F1872-L2017 HydrophobicContact CG-CD2 4Å; F1872-L2017 HydrophobicContact CZ-CD2 3.82Å
1873	T	95.1	Very high	94.3	Very high	71 Å²	71	33.5 Å²	33.5	44%	0.436	16%	0.164	S	C	.	.			trans	-71.6	87.2	174.6	-51.9	0	0	0	0	109.9	E1875 L1876 D1952	T1873-E1875 PolarHBondContact O-N 2.72Å; T1873-L1876 HydrophobicContact CG2-CD1 4.18Å; T1873-L1876 HydrophobicContact CG2-CG 3.93Å; T1873-L1876 WeakPolarHBondContact O-CB 3.42Å; T1873-L1876 PolarHBondContact O-N 3.48Å; T1873-D1952 VanDerWaalsContact CB-OD1 3.22Å; T1873-D1952 WeakPolarHBondContact CB-OD1 3.49Å; T1873-D1952 PolarHBondContact N-OD1 3.38Å; T1873-D1952 PolarHBondContact N-OD2 2.84Å; T1873-D1952 VanDerWaalsContact N-OD2 3.12Å; T1873-D1952 PolarHBondContact OG1-OD1 2.77Å
1874	Q	92.1	Very high	94.3	Very high	57 Å²	57	39 Å²	39	27%	0.266	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-49.5	-39	-168.8	-69.8	-59.1	-47	0	0	114.6	Q1869 F1872 L1876 W1877 H2165	Q1869-Q1874 PolarHBondContact O-NE2 3.17Å; F1872-Q1874 VanDerWaalsContact C-N 3.33Å; F1872-Q1874 PolarHBondContact O-N 2.91Å; Q1874-L1876 PolarHBondContact O-N 2.85Å; Q1874-W1877 PolarHBondContact O-N 2.87Å; Q1874-H2165 PolarHBondContact OE1-CE1 3.43Å
1875	E	93.9	Very high	94	Very high	125 Å²	125	43.5 Å²	43.5	58%	0.584	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-57	-31.6	178.6	-60.8	-176.7	177.5	0	0	113.6	T1873 W1877 T1878 S1881	T1873-E1875 PolarHBondContact O-N 2.72Å; E1875-W1877 VanDerWaalsContact C-N 3.29Å; E1875-W1877 PolarHBondContact O-N 3.47Å; E1875-T1878 PolarHBondContact O-OG1 2.97Å; E1875-S1881 WeakPolarHBondContact O-CB 3.44Å; E1875-S1881 PolarHBondContact O-OG 2.91Å; E1875-S1881 VanDerWaalsContact O-OG 3.05Å
1876	L	95.7	Very high	93.8	Very high	36 Å²	36	45.1 Å²	45.1	19%	0.188	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-68.6	-28.3	178.2	-61.1	-177.2	0	0	0	112.5	T1873 Q1874 S1881 K1948 R1949 D1952	T1873-L1876 HydrophobicContact CG2-CD1 4.18Å; T1873-L1876 HydrophobicContact CG2-CG 3.93Å; T1873-L1876 WeakPolarHBondContact O-CB 3.42Å; T1873-L1876 PolarHBondContact O-N 3.48Å; Q1874-L1876 PolarHBondContact O-N 2.85Å; L1876-S1881 PolarHBondContact O-OG 2.69Å; L1876-K1948 HydrophobicContact CD1-CB 4.45Å; L1876-R1949 HydrophobicContact CB-CG 4.16Å; L1876-R1949 PolarHBondContact O-NE 2.92Å; L1876-R1949 PolarHBondContact O-NH2 3.49Å; L1876-R1949 VanDerWaalsContact O-NH2 3.17Å; L1876-D1952 HydrophobicContact CD1-CB 3.93Å
1877	W	95.7	Very high	93.6	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-100.7	0.5	-168.2	-59.6	105.6	0	0	0	114.2	F1872 Q1874 E1875 F1882 F1942 R1949 D1952 L1953 L1988 L2017 I2186	F1872-W1877 HydrophobicContact CD1-CZ2 4.36Å; F1872-W1877 AromaticContact CD1-NE1 3.72Å; Q1874-W1877 PolarHBondContact O-N 2.87Å; E1875-W1877 VanDerWaalsContact C-N 3.29Å; E1875-W1877 PolarHBondContact O-N 3.47Å; W1877-F1882 HydrophobicContact CE3-CE2 4.26Å; W1877-F1882 AromaticContact CE3-CZ 3.81Å; W1877-F1882 HydrophobicContact CE3-CZ 3.81Å; W1877-F1882 HydrophobicContact CZ3-CZ 4.15Å; W1877-F1942 HydrophobicContact CH2-CE1 4.33Å; W1877-F1942 HydrophobicContact CH2-CZ 4.05Å; W1877-F1942 HydrophobicContact CZ3-CZ 4.12Å; W1877-R1949 HydrophobicContact CE3-CG 4.49Å; W1877-R1949 HydrophobicContact CH2-CB 3.59Å; W1877-R1949 HydrophobicContact CH2-CG 4.15Å; W1877-R1949 WeakPolarHBondContact CH2-O 3.39Å; W1877-R1949 HydrophobicContact CZ2-CB 3.92Å; W1877-R1949 HydrophobicContact CZ2-CG 4.31Å; W1877-R1949 WeakPolarHBondContact CZ2-O 3.49Å; W1877-R1949 HydrophobicContact CZ3-CB 4.03Å; W1877-R1949 HydrophobicContact CZ3-CG 4.22Å; W1877-D1952 PolarHBondContact NE1-OD2 2.79Å; W1877-L1953 HydrophobicContact CH2-CB 4.16Å; W1877-L1953 HydrophobicContact CZ2-CB 4.11Å; W1877-L1988 HydrophobicContact CZ3-CD1 4.11Å; W1877-L2017 HydrophobicContact CB-CB 4.28Å; W1877-L2017 HydrophobicContact CD2-CB 4.21Å; W1877-L2017 HydrophobicContact CD2-CD1 3.8Å; W1877-L2017 HydrophobicContact CD2-CG 4.44Å; W1877-L2017 HydrophobicContact CE3-CB 4.28Å; W1877-L2017 HydrophobicContact CE3-CD1 3.5Å; W1877-L2017 HydrophobicContact CE3-CG 4.46Å; W1877-L2017 HydrophobicContact CG-CB 4.22Å; W1877-L2017 HydrophobicContact CH2-CD1 3.7Å; W1877-L2017 HydrophobicContact CZ2-CD1 4.02Å; W1877-L2017 HydrophobicContact CZ3-CD1 3.45Å; W1877-L2017 VanDerWaalsContact CZ3-CD1 3.45Å; W1877-I2186 WeakPolarHBondContact O-CD1 3.32Å
1878	T	96	Very high	93.5	Very high	39 Å²	39	51.1 Å²	51.1	24%	0.239	26%	0.256	C	S	.	.	S	Bend	trans	-71.7	149.6	178.7	67	0	0	0	0	112.7	E1875 Q1880 S1881 F1882 Y2018	E1875-T1878 PolarHBondContact O-OG1 2.97Å; T1878-Q1880 PolarHBondContact O-N 3.5Å; T1878-S1881 VanDerWaalsContact O-CB 3.25Å; T1878-S1881 WeakPolarHBondContact O-CB 3.19Å; T1878-S1881 PolarHBondContact O-N 2.87Å; T1878-S1881 VanDerWaalsContact OG1-CB 3.29Å; T1878-S1881 WeakPolarHBondContact OG1-CB 3.46Å; T1878-S1881 PolarHBondContact OG1-N 3.03Å; T1878-F1882 WeakPolarHBondContact O-CD2 3.38Å; T1878-F1882 PolarHBondContact O-N 3.19Å; T1878-Y2018 HydrophobicContact CG2-CD2 4.44Å; T1878-Y2018 HydrophobicContact CG2-CE2 4.04Å
1879	P	95.7	Very high	93.2	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.039	27%	0.273	C	S	.	.	H	α-helix	trans	-54.5	-37.5	174.4	-27.3	35.2	0	0	0	113.1	F1882 S1883 W1911 F1914 E1915 Y2018 I2186	P1879-F1882 PolarHBondContact O-N 3.02Å; P1879-S1883 WeakPolarHBondContact O-CB 3.31Å; P1879-S1883 PolarHBondContact O-N 2.93Å; P1879-W1911 HydrophobicContact CB-CE3 3.85Å; P1879-W1911 HydrophobicContact CB-CZ3 4.22Å; P1879-F1914 HydrophobicContact CB-CD1 4.04Å; P1879-F1914 HydrophobicContact CB-CG 4.46Å; P1879-F1914 HydrophobicContact CG-CD1 3.52Å; P1879-F1914 HydrophobicContact CG-CE1 3.79Å; P1879-F1914 HydrophobicContact CG-CG 4.39Å; P1879-E1915 HydrophobicContact CG-CG 4.48Å; P1879-Y2018 VanDerWaalsContact CD-CZ 3.45Å; P1879-Y2018 HydrophobicContact CG-CD1 3.78Å; P1879-Y2018 HydrophobicContact CG-CE1 3.46Å; P1879-Y2018 VanDerWaalsContact CG-CE1 3.46Å; P1879-I2186 HydrophobicContact CG-CD1 4.2Å
1880	Q	95	Very high	93	Very high	112 Å²	112	61 Å²	61	52%	0.523	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-38	176.8	-169.4	62.8	54.6	0	0	112	T1878 S1883 N1884	T1878-Q1880 PolarHBondContact O-N 3.5Å; Q1880-S1883 PolarHBondContact O-N 3.25Å; Q1880-N1884 PolarHBondContact NE2-OD1 3.09Å; Q1880-N1884 WeakPolarHBondContact O-CB 3.45Å; Q1880-N1884 PolarHBondContact O-N 3.2Å; Q1880-N1884 PolarHBondContact O-OD1 3.45Å
1881	S	95.6	Very high	92.7	Very high	20 Å²	20	55.3 Å²	55.3	14%	0.14	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-46.2	175.8	-163	0	0	0	0	111.5	E1875 L1876 T1878 N1884 D1885 R1949	E1875-S1881 WeakPolarHBondContact O-CB 3.44Å; E1875-S1881 PolarHBondContact O-OG 2.91Å; E1875-S1881 VanDerWaalsContact O-OG 3.05Å; L1876-S1881 PolarHBondContact O-OG 2.69Å; T1878-S1881 VanDerWaalsContact O-CB 3.25Å; T1878-S1881 WeakPolarHBondContact O-CB 3.19Å; T1878-S1881 PolarHBondContact O-N 2.87Å; T1878-S1881 VanDerWaalsContact OG1-CB 3.29Å; T1878-S1881 WeakPolarHBondContact OG1-CB 3.46Å; T1878-S1881 PolarHBondContact OG1-N 3.03Å; S1881-N1884 PolarHBondContact O-N 3.27Å; S1881-D1885 PolarHBondContact O-N 3.27Å; S1881-D1885 VanDerWaalsContact O-N 3.11Å; S1881-R1949 PolarHBondContact OG-NH2 2.85Å
1882	F	94.6	Very high	92.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69	-32.4	173.6	-69.1	-81.1	0	0	0	113.6	W1877 T1878 P1879 F1886 W1911 W1936 L1988 I2186	W1877-F1882 HydrophobicContact CE3-CE2 4.26Å; W1877-F1882 AromaticContact CE3-CZ 3.81Å; W1877-F1882 HydrophobicContact CE3-CZ 3.81Å; W1877-F1882 HydrophobicContact CZ3-CZ 4.15Å; T1878-F1882 WeakPolarHBondContact O-CD2 3.38Å; T1878-F1882 PolarHBondContact O-N 3.19Å; P1879-F1882 PolarHBondContact O-N 3.02Å; F1882-F1886 HydrophobicContact CD1-CD2 4.38Å; F1882-F1886 WeakPolarHBondContact O-CB 3.31Å; F1882-F1886 PolarHBondContact O-N 3.15Å; F1882-W1911 HydrophobicContact CB-CD2 4.17Å; F1882-W1911 VanDerWaalsContact CB-CE2 3.43Å; F1882-W1911 HydrophobicContact CB-CH2 3.82Å; F1882-W1911 HydrophobicContact CB-CZ2 3.25Å; F1882-W1911 HydrophobicContact CD1-CZ2 4.25Å; F1882-W1911 AromaticContact CD2-CH2 3.94Å; F1882-W1911 HydrophobicContact CD2-CH2 3.94Å; F1882-W1911 HydrophobicContact CD2-CZ2 4.2Å; F1882-W1911 AromaticContact CG-CH2 3.92Å; F1882-W1911 HydrophobicContact CG-CH2 3.92Å; F1882-W1911 AromaticContact CG-CZ2 3.69Å; F1882-W1911 HydrophobicContact CG-CZ2 3.69Å; F1882-W1936 AromaticContact CD1-CH2 3.99Å; F1882-W1936 HydrophobicContact CD1-CH2 3.99Å; F1882-W1936 AromaticContact CD1-CZ3 3.91Å; F1882-W1936 HydrophobicContact CD1-CZ3 3.91Å; F1882-W1936 HydrophobicContact CE1-CH2 4.32Å; F1882-W1936 AromaticContact CE1-CZ3 3.89Å; F1882-W1936 HydrophobicContact CE1-CZ3 3.89Å; F1882-L1988 HydrophobicContact CE1-CD2 3.74Å; F1882-L1988 HydrophobicContact CZ-CD2 3.78Å; F1882-I2186 HydrophobicContact CD2-CD1 3.92Å; F1882-I2186 HydrophobicContact CE2-CD1 3.85Å; F1882-I2186 HydrophobicContact CE2-CG2 4.04Å; F1882-I2186 HydrophobicContact CZ-CG2 4.32Å
1883	S	94.7	Very high	92.5	Very high	9 Å²	9	53.8 Å²	53.8	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-69.3	-36.9	175.9	-160.3	0	0	0	0	112.4	P1879 Q1880 G1887	P1879-S1883 WeakPolarHBondContact O-CB 3.31Å; P1879-S1883 PolarHBondContact O-N 2.93Å; Q1880-S1883 PolarHBondContact O-N 3.25Å; S1883-G1887 WeakPolarHBondContact O-CA 3.28Å; S1883-G1887 PolarHBondContact O-N 3.23Å
1884	N	94.5	Very high	92.3	Very high	116 Å²	116	51.5 Å²	51.5	62%	0.62	26%	0.262	S	S	*	.	H	α-helix	trans	-68.4	-47.5	175.3	-68.7	-9.2	0	0	0	111.5	Q1880 S1881	Q1880-N1884 PolarHBondContact NE2-OD1 3.09Å; Q1880-N1884 WeakPolarHBondContact O-CB 3.45Å; Q1880-N1884 PolarHBondContact O-N 3.2Å; Q1880-N1884 PolarHBondContact O-OD1 3.45Å; S1881-N1884 PolarHBondContact O-N 3.27Å
1885	D	90.4	Very high	92.2	Very high	94 Å²	94	49.4 Å²	49.4	50%	0.503	25%	0.253	S	S	.	.	H	α-helix	trans	-76	-33.7	-175.6	-70.7	-12.2	0	0	0	113.3	S1881 R1949	S1881-D1885 PolarHBondContact O-N 3.27Å; S1881-D1885 VanDerWaalsContact O-N 3.11Å; D1885-R1949 IonicContact OD2-CZ 2.64Å; D1885-R1949 IonicContact OD2-NH1 3.79Å; D1885-R1949 PolarHBondContact OD2-NH1 3.38Å; D1885-R1949 IonicContact OD2-NH2 3.32Å; D1885-R1949 PolarHBondContact OD2-NH2 3.27Å
1886	F	90	Very high	92	Very high	35 Å²	35	44.3 Å²	44.3	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-131.5	4.3	-168.4	-56.1	-80	0	0	0	114.7	F1882 D1888 M1889 L1907 W1936 Q1946	F1882-F1886 HydrophobicContact CD1-CD2 4.38Å; F1882-F1886 WeakPolarHBondContact O-CB 3.31Å; F1882-F1886 PolarHBondContact O-N 3.15Å; F1886-D1888 VanDerWaalsContact C-N 3.31Å; F1886-D1888 PolarHBondContact O-N 2.92Å; F1886-M1889 HydrophobicContact CB-CE 4.16Å; F1886-M1889 HydrophobicContact CD1-CE 4Å; F1886-M1889 HydrophobicContact CG-CE 4.43Å; F1886-M1889 WeakPolarHBondContact O-CB 3.37Å; F1886-M1889 PolarHBondContact O-N 2.85Å; F1886-L1907 HydrophobicContact CB-CD1 4.07Å; F1886-W1936 HydrophobicContact CB-CZ2 4.27Å; F1886-W1936 HydrophobicContact CD1-CH2 4.41Å; F1886-W1936 HydrophobicContact CD1-CZ2 4.03Å; F1886-W1936 AromaticContact CD2-CH2 3.87Å; F1886-W1936 HydrophobicContact CD2-CH2 3.87Å; F1886-W1936 HydrophobicContact CD2-CZ2 4.25Å; F1886-W1936 HydrophobicContact CE2-CH2 4.25Å; F1886-W1936 AromaticContact CG-CH2 3.99Å; F1886-W1936 HydrophobicContact CG-CH2 3.99Å; F1886-W1936 AromaticContact CG-CZ2 3.89Å; F1886-W1936 HydrophobicContact CG-CZ2 3.89Å; F1886-Q1946 HydrophobicContact CE2-CG 4.46Å; F1886-Q1946 HydrophobicContact CZ-CG 3.99Å; F1886-Q1946 VanDerWaalsContact CZ-NE2 3.27Å
1887	G	90	Very high	91.4	Very high	3 Å²	3	45.4 Å²	45.4	3%	0.031	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-38.4	-170	0	0	0	0	0	114.9	S1883 M1889 T1906 L1907 K1908	S1883-G1887 WeakPolarHBondContact O-CA 3.28Å; S1883-G1887 PolarHBondContact O-N 3.23Å; G1887-M1889 VanDerWaalsContact C-N 3.3Å; G1887-M1889 PolarHBondContact O-N 2.9Å; G1887-T1906 VanDerWaalsContact O-CB 3.31Å; G1887-T1906 WeakPolarHBondContact O-CB 3.35Å; G1887-L1907 PolarHBondContact O-N 3.04Å; G1887-L1907 VanDerWaalsContact O-N 3.17Å; G1887-K1908 WeakPolarHBondContact O-CB 3.43Å; G1887-K1908 PolarHBondContact O-N 3.15Å
1888	D	90.3	Very high	90.9	Very high	134 Å²	134	50.1 Å²	50.1	72%	0.717	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-12	-177.5	-63.6	-37.1	0	0	0	113.7	F1886	F1886-D1888 VanDerWaalsContact C-N 3.31Å; F1886-D1888 PolarHBondContact O-N 2.92Å
1889	M	87.5	Confident	90.4	Very high	77 Å²	77	50.8 Å²	50.8	38%	0.379	29%	0.289	S	S	.	.			trans	-67.4	142.7	176.6	-177	166.2	55.4	0	0	111.3	F1886 G1887 T1906 L1907 W1936	F1886-M1889 HydrophobicContact CB-CE 4.16Å; F1886-M1889 HydrophobicContact CD1-CE 4Å; F1886-M1889 HydrophobicContact CG-CE 4.43Å; F1886-M1889 WeakPolarHBondContact O-CB 3.37Å; F1886-M1889 PolarHBondContact O-N 2.85Å; G1887-M1889 VanDerWaalsContact C-N 3.3Å; G1887-M1889 PolarHBondContact O-N 2.9Å; M1889-T1906 CarbonylContact O-C 3.59Å; M1889-T1906 WeakPolarHBondContact O-CA 3.24Å; M1889-L1907 HydrophobicContact CB-CD1 4.4Å; M1889-L1907 HydrophobicContact CE-CD1 3.75Å; M1889-L1907 PolarHBondContact O-N 2.93Å; M1889-W1936 HydrophobicContact CE-CZ2 3.7Å
1890	K	87	Confident	90.1	Very high	142 Å²	142	52.7 Å²	52.7	62%	0.617	31%	0.305	S	S	*	.			trans	-106.7	122.1	172.9	-61.9	-179.5	-177.3	175.5	0	109	T1906	K1890-T1906 HydrophobicContact CD-CG2 4.41Å; K1890-T1906 HydrophobicContact CG-CG2 3.86Å
1891	T	84.8	Confident	89.9	Confident	17 Å²	17	52.7 Å²	52.7	10%	0.104	31%	0.305	C	S	.	.			trans	-134	168	175.5	-174.5	0	0	0	0	109.8	L1893 L1907	T1891-L1893 PolarHBondContact O-N 3.07Å; T1891-L1907 HydrophobicContact CG2-CD1 4.16Å; T1891-L1907 HydrophobicContact CG2-CD2 3.57Å; T1891-L1907 HydrophobicContact CG2-CG 3.86Å
1892	T	90.2	Very high	89.7	Confident	35 Å²	35	52.4 Å²	52.4	22%	0.215	30%	0.302	C	S	.	.			trans	-74.4	115.4	177.4	-65.5	0	0	0	0	110.5	E1901 K1934	T1892-E1901 HydrophobicContact CG2-CB 3.74Å; T1892-E1901 HydrophobicContact CG2-CG 3.71Å; T1892-K1934 HydrophobicContact CG2-CB 4.11Å; T1892-K1934 HydrophobicContact CG2-CD 3.98Å; T1892-K1934 VanDerWaalsContact O-CB 3.25Å; T1892-K1934 WeakPolarHBondContact O-CB 3.43Å; T1892-K1934 PolarHBondContact O-N 3.46Å
1893	L	92.8	Very high	89.3	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	151.6	163.4	-53.2	176	0	0	0	109	T1891 E1901 I1902 L1907 F1910 I1921 L1931 K1932 L1933	T1891-L1893 PolarHBondContact O-N 3.07Å; L1893-E1901 CarbonylContact O-C 3.29Å; L1893-E1901 WeakPolarHBondContact O-CA 3.42Å; L1893-I1902 HydrophobicContact CB-CB 4.46Å; L1893-I1902 WeakPolarHBondContact CB-O 3.28Å; L1893-I1902 PolarHBondContact N-O 2.94Å; L1893-I1902 PolarHBondContact O-N 2.85Å; L1893-L1907 HydrophobicContact CD2-CD2 4.33Å; L1893-F1910 HydrophobicContact CD1-CB 4.07Å; L1893-F1910 HydrophobicContact CD1-CD2 4.23Å; L1893-F1910 HydrophobicContact CD2-CB 4.33Å; L1893-F1910 HydrophobicContact CD2-CD2 3.93Å; L1893-F1910 HydrophobicContact CD2-CG 4.19Å; L1893-I1921 HydrophobicContact CD1-CD1 4.25Å; L1893-L1931 HydrophobicContact CD1-CD1 4.12Å; L1893-K1932 CarbonylContact C-O 3.52Å; L1893-K1932 VanDerWaalsContact CA-O 3.32Å; L1893-K1932 WeakPolarHBondContact CA-O 3.49Å; L1893-L1933 HydrophobicContact CD2-CD1 3.7Å; L1893-L1933 HydrophobicContact CD2-CG 4.02Å
1894	I	92	Very high	89	Confident	23 Å²	23	62.7 Å²	62.7	12%	0.118	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.5	172.6	-65	162.9	0	0	0	108.6	C1896 A1900 E1901 L1931 K1932 K1934	I1894-C1896 PolarHBondContact O-N 2.83Å; I1894-A1900 WeakPolarHBondContact CA-O 3.44Å; I1894-E1901 HydrophobicContact CG1-CG 4.25Å; I1894-L1931 WeakPolarHBondContact O-CA 3.31Å; I1894-K1932 HydrophobicContact CB-CG 3.87Å; I1894-K1932 HydrophobicContact CG2-CG 4.45Å; I1894-K1932 PolarHBondContact N-O 3.02Å; I1894-K1932 PolarHBondContact O-N 3.29Å; I1894-K1934 HydrophobicContact CD1-CB 3.78Å; I1894-K1934 HydrophobicContact CD1-CD 4.02Å; I1894-K1934 HydrophobicContact CD1-CG 3.82Å; I1894-K1934 HydrophobicContact CG1-CB 4.17Å
1895	D	91	Very high	88.8	Confident	12 Å²	12	60.4 Å²	60.4	6%	0.064	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	110.9	163.4	169.9	30.6	0	0	0	110.3	A1897 T1898 G1899 A1900 I1902 L1931	D1895-A1897 PolarHBondContact O-N 2.88Å; D1895-A1897 VanDerWaalsContact O-N 3.16Å; D1895-A1897 WeakPolarHBondContact OD1-CB 3.36Å; D1895-A1897 PolarHBondContact OD1-N 3.48Å; D1895-T1898 PolarHBondContact O-N 3.15Å; D1895-T1898 WeakPolarHBondContact OD2-CB 3.34Å; D1895-T1898 VanDerWaalsContact OD2-CG2 3.28Å; D1895-T1898 WeakPolarHBondContact OD2-CG2 3.46Å; D1895-T1898 PolarHBondContact OD2-N 3.14Å; D1895-T1898 PolarHBondContact OD2-OG1 3.37Å; D1895-G1899 WeakPolarHBondContact O-CA 3.42Å; D1895-G1899 PolarHBondContact O-N 2.95Å; D1895-A1900 PolarHBondContact N-O 3.24Å; D1895-I1902 HydrophobicContact CB-CD1 4.36Å; D1895-L1931 HydrophobicContact CB-CD2 4.3Å
1896	C	89.1	Confident	88.9	Confident	18 Å²	18	57.6 Å²	57.6	12%	0.122	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24	180	-64.7	0	0	0	0	113.4	I1894 C1930 I2000 S2001	I1894-C1896 PolarHBondContact O-N 2.83Å; C1896-C1930 HydrophobicContact CB-CB 4.25Å; C1896-C1930 WeakPolarHBondContact CB-O 3.3Å; C1896-C1930 PolarHBondContact N-O 3.2Å; C1896-I2000 HydrophobicContact CB-CG2 3.77Å; C1896-S2001 WeakPolarHBondContact CB-O 3.43Å
1897	A	83.8	Confident	89	Confident	59 Å²	59	56 Å²	56	49%	0.488	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-20.9	-179.7	0	0	0	0	0	114.1	D1895 I2000	D1895-A1897 PolarHBondContact O-N 2.88Å; D1895-A1897 VanDerWaalsContact O-N 3.16Å; D1895-A1897 WeakPolarHBondContact OD1-CB 3.36Å; D1895-A1897 PolarHBondContact OD1-N 3.48Å; A1897-I2000 HydrophobicContact CB-CD1 3.98Å; A1897-I2000 HydrophobicContact CB-CG1 4.45Å
1898	T	85	Confident	89.2	Confident	99 Å²	99	60.5 Å²	60.5	61%	0.607	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	-12.8	-173.8	63.4	0	0	0	0	114.9	D1895 A1900	D1895-T1898 PolarHBondContact O-N 3.15Å; D1895-T1898 WeakPolarHBondContact OD2-CB 3.34Å; D1895-T1898 VanDerWaalsContact OD2-CG2 3.28Å; D1895-T1898 WeakPolarHBondContact OD2-CG2 3.46Å; D1895-T1898 PolarHBondContact OD2-N 3.14Å; D1895-T1898 PolarHBondContact OD2-OG1 3.37Å; T1898-A1900 PolarHBondContact O-N 2.8Å; T1898-A1900 VanDerWaalsContact OG1-CB 3.28Å; T1898-A1900 WeakPolarHBondContact OG1-CB 3.16Å; T1898-A1900 PolarHBondContact OG1-N 3.24Å
1899	G	85.5	Confident	89.3	Confident	54 Å²	54	56 Å²	56	56%	0.557	31%	0.312	S	S	*	.			trans	72	8.4	-170.1	0	0	0	0	0	113.9	D1895	D1895-G1899 WeakPolarHBondContact O-CA 3.42Å; D1895-G1899 PolarHBondContact O-N 2.95Å
1900	A	88.2	Confident	89.7	Confident	45 Å²	45	52.4 Å²	52.4	37%	0.372	29%	0.294	S	S	.	.			trans	-74.4	128.4	-176.3	0	0	0	0	0	112.2	I1894 D1895 T1898	I1894-A1900 WeakPolarHBondContact CA-O 3.44Å; D1895-A1900 PolarHBondContact N-O 3.24Å; T1898-A1900 PolarHBondContact O-N 2.8Å; T1898-A1900 VanDerWaalsContact OG1-CB 3.28Å; T1898-A1900 WeakPolarHBondContact OG1-CB 3.16Å; T1898-A1900 PolarHBondContact OG1-N 3.24Å
1901	E	91.6	Very high	90.1	Very high	112 Å²	112	46.1 Å²	46.1	52%	0.523	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	136.7	174.3	-69.6	-169.7	-177.6	0	0	112.2	T1892 L1893 I1894 K1934	T1892-E1901 HydrophobicContact CG2-CB 3.74Å; T1892-E1901 HydrophobicContact CG2-CG 3.71Å; L1893-E1901 CarbonylContact O-C 3.29Å; L1893-E1901 WeakPolarHBondContact O-CA 3.42Å; I1894-E1901 HydrophobicContact CG1-CG 4.25Å; E1901-K1934 IonicContact OE1-NZ 2.72Å; E1901-K1934 PolarHBondContact OE1-NZ 3.28Å
1902	I	90.3	Very high	90.6	Very high	14 Å²	14	47.9 Å²	47.9	7%	0.072	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	99	-173.7	-56.4	177	0	0	0	108.9	L1893 D1895 R1904 Y1905 L1929 L1931	L1893-I1902 HydrophobicContact CB-CB 4.46Å; L1893-I1902 WeakPolarHBondContact CB-O 3.28Å; L1893-I1902 PolarHBondContact N-O 2.94Å; L1893-I1902 PolarHBondContact O-N 2.85Å; D1895-I1902 HydrophobicContact CB-CD1 4.36Å; I1902-R1904 HydrophobicContact CG2-CG 4.11Å; I1902-Y1905 HydrophobicContact CG2-CD2 3.68Å; I1902-Y1905 HydrophobicContact CG2-CE2 3.8Å; I1902-L1929 HydrophobicContact CD1-CD1 3.66Å; I1902-L1931 HydrophobicContact CD1-CD2 4.17Å
1903	S	87.3	Confident	90.8	Very high	79 Å²	79	46.2 Å²	46.2	55%	0.552	27%	0.265	S	S	*	.			trans	-105.8	8.9	-179.3	53.6	0	0	0	0	114.4
1904	R	87.3	Confident	90.9	Very high	147 Å²	147	46.1 Å²	46.1	56%	0.555	26%	0.264	S	S	*	.	S	Bend	trans	-84.2	-16.5	-172.3	71.4	-177.1	-179.7	-96.2	-3.7	115.3	I1902	I1902-R1904 HydrophobicContact CG2-CG 4.11Å
1905	Y	89.8	Confident	91	Very high	68 Å²	68	47.3 Å²	47.3	27%	0.267	27%	0.269	S	S	.	.	S	Bend	trans	-102	161	-178.3	-59.8	-77	0	0	0	111.4	I1902 I1921	I1902-Y1905 HydrophobicContact CG2-CD2 3.68Å; I1902-Y1905 HydrophobicContact CG2-CE2 3.8Å; Y1905-I1921 HydrophobicContact CD1-CD1 4.2Å; Y1905-I1921 HydrophobicContact CD1-CG1 4.29Å; Y1905-I1921 HydrophobicContact CD2-CD1 3.59Å; Y1905-I1921 HydrophobicContact CD2-CG1 4.19Å; Y1905-I1921 HydrophobicContact CD2-CG2 4.05Å; Y1905-I1921 HydrophobicContact CE1-CG1 4.33Å; Y1905-I1921 HydrophobicContact CE1-CG2 4.34Å; Y1905-I1921 HydrophobicContact CE2-CB 4.43Å; Y1905-I1921 HydrophobicContact CE2-CD1 4.08Å; Y1905-I1921 HydrophobicContact CE2-CG1 4.22Å; Y1905-I1921 HydrophobicContact CE2-CG2 3.36Å; Y1905-I1921 HydrophobicContact CG-CD1 3.67Å; Y1905-I1921 HydrophobicContact CG-CG1 4.23Å
1906	T	92.5	Very high	91.1	Very high	34 Å²	34	50.4 Å²	50.4	21%	0.209	28%	0.282	C	S	.	.			trans	-84.1	160.2	167.5	59.2	0	0	0	0	110.3	G1887 M1889 K1890 K1908 S1909	G1887-T1906 VanDerWaalsContact O-CB 3.31Å; G1887-T1906 WeakPolarHBondContact O-CB 3.35Å; M1889-T1906 CarbonylContact O-C 3.59Å; M1889-T1906 WeakPolarHBondContact O-CA 3.24Å; K1890-T1906 HydrophobicContact CD-CG2 4.41Å; K1890-T1906 HydrophobicContact CG-CG2 3.86Å; T1906-K1908 PolarHBondContact O-N 2.95Å; T1906-S1909 PolarHBondContact O-N 3.49Å
1907	L	92.4	Very high	91	Very high	1 Å²	1	53 Å²	53	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-60.4	-28.9	175.4	-82.4	179.6	0	0	0	112.6	F1886 G1887 M1889 T1891 L1893 S1909 F1910 W1911 L1933 W1936	F1886-L1907 HydrophobicContact CB-CD1 4.07Å; G1887-L1907 PolarHBondContact O-N 3.04Å; G1887-L1907 VanDerWaalsContact O-N 3.17Å; M1889-L1907 HydrophobicContact CB-CD1 4.4Å; M1889-L1907 HydrophobicContact CE-CD1 3.75Å; M1889-L1907 PolarHBondContact O-N 2.93Å; T1891-L1907 HydrophobicContact CG2-CD1 4.16Å; T1891-L1907 HydrophobicContact CG2-CD2 3.57Å; T1891-L1907 HydrophobicContact CG2-CG 3.86Å; L1893-L1907 HydrophobicContact CD2-CD2 4.33Å; L1907-S1909 VanDerWaalsContact C-N 3.31Å; L1907-S1909 PolarHBondContact O-N 3.24Å; L1907-F1910 CarbonylContact O-C 3.58Å; L1907-F1910 WeakPolarHBondContact O-CA 3.41Å; L1907-F1910 WeakPolarHBondContact O-CB 3.36Å; L1907-F1910 PolarHBondContact O-N 2.98Å; L1907-W1911 PolarHBondContact O-N 3Å; L1907-L1933 HydrophobicContact CD2-CD1 4.07Å; L1907-L1933 HydrophobicContact CD2-CD2 3.86Å; L1907-L1933 HydrophobicContact CD2-CG 3.97Å; L1907-W1936 HydrophobicContact CD1-CZ2 4.34Å
1908	K	94.3	Very high	91.2	Very high	99 Å²	99	58.4 Å²	58.4	43%	0.43	30%	0.304	S	S	.	.	H	α-helix	trans	-56.3	-44.1	174.8	-172	164.4	-175.4	168.7	0	111.8	G1887 T1906 F1910 W1911 D1912	G1887-K1908 WeakPolarHBondContact O-CB 3.43Å; G1887-K1908 PolarHBondContact O-N 3.15Å; T1906-K1908 PolarHBondContact O-N 2.95Å; K1908-F1910 PolarHBondContact O-N 3.28Å; K1908-W1911 PolarHBondContact O-N 2.86Å; K1908-D1912 VanDerWaalsContact O-CB 3.24Å; K1908-D1912 WeakPolarHBondContact O-CB 3.44Å; K1908-D1912 PolarHBondContact O-N 3.29Å
1909	S	93.9	Very high	91.5	Very high	40 Å²	40	60.6 Å²	60.6	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-67	-18.3	174.8	-53.2	0	0	0	0	114.3	T1906 L1907	T1906-S1909 PolarHBondContact O-N 3.49Å; L1907-S1909 VanDerWaalsContact C-N 3.31Å; L1907-S1909 PolarHBondContact O-N 3.24Å
1910	F	95.4	Very high	91.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-83.5	-47.2	170.4	172.3	-85.7	0	0	0	110.9	L1893 L1907 K1908 G1913 F1914 L1931 L1933 V1990 Y1992	L1893-F1910 HydrophobicContact CD1-CB 4.07Å; L1893-F1910 HydrophobicContact CD1-CD2 4.23Å; L1893-F1910 HydrophobicContact CD2-CB 4.33Å; L1893-F1910 HydrophobicContact CD2-CD2 3.93Å; L1893-F1910 HydrophobicContact CD2-CG 4.19Å; L1907-F1910 CarbonylContact O-C 3.58Å; L1907-F1910 WeakPolarHBondContact O-CA 3.41Å; L1907-F1910 WeakPolarHBondContact O-CB 3.36Å; L1907-F1910 PolarHBondContact O-N 2.98Å; K1908-F1910 PolarHBondContact O-N 3.28Å; F1910-G1913 CarbonylContact O-C 3.03Å; F1910-G1913 PolarHBondContact O-N 2.96Å; F1910-F1914 AromaticContact CE1-CD2 3.59Å; F1910-F1914 HydrophobicContact CE1-CD2 3.59Å; F1910-F1914 AromaticContact CE1-CE2 3.98Å; F1910-F1914 HydrophobicContact CE1-CE2 3.98Å; F1910-F1914 AromaticContact CZ-CD2 3.81Å; F1910-F1914 HydrophobicContact CZ-CD2 3.81Å; F1910-F1914 HydrophobicContact CZ-CE2 4.03Å; F1910-F1914 PolarHBondContact O-N 3.08Å; F1910-F1914 VanDerWaalsContact O-N 3.11Å; F1910-L1931 HydrophobicContact CD2-CB 3.93Å; F1910-L1931 HydrophobicContact CD2-CD1 4.41Å; F1910-L1931 HydrophobicContact CE2-CB 3.79Å; F1910-L1933 HydrophobicContact CD1-CD1 3.56Å; F1910-L1933 HydrophobicContact CD2-CD1 3.96Å; F1910-L1933 HydrophobicContact CE1-CD1 3.36Å; F1910-L1933 HydrophobicContact CE2-CD1 3.76Å; F1910-L1933 HydrophobicContact CG-CD1 3.87Å; F1910-L1933 HydrophobicContact CZ-CD1 3.47Å; F1910-L1933 VanDerWaalsContact CZ-CD1 3.47Å; F1910-V1990 HydrophobicContact CE1-CG1 3.52Å; F1910-V1990 HydrophobicContact CZ-CG1 3.76Å; F1910-Y1992 WeakPolarHBondContact CA-OH 3.49Å; F1910-Y1992 HydrophobicContact CD1-CE1 4.4Å; F1910-Y1992 HydrophobicContact CD2-CD1 4.42Å; F1910-Y1992 AromaticContact CD2-CE1 3.57Å; F1910-Y1992 HydrophobicContact CD2-CE1 3.57Å; F1910-Y1992 AromaticContact CD2-CZ 3.74Å; F1910-Y1992 HydrophobicContact CE1-CE1 4.14Å; F1910-Y1992 AromaticContact CE2-CD1 3.69Å; F1910-Y1992 HydrophobicContact CE2-CD1 3.69Å; F1910-Y1992 AromaticContact CE2-CE1 3.28Å; F1910-Y1992 HydrophobicContact CE2-CE1 3.28Å; F1910-Y1992 AromaticContact CE2-CZ 3.82Å; F1910-Y1992 HydrophobicContact CG-CE1 4.14Å; F1910-Y1992 AromaticContact CZ-CD1 3.79Å; F1910-Y1992 HydrophobicContact CZ-CD1 3.79Å; F1910-Y1992 AromaticContact CZ-CE1 3.58Å; F1910-Y1992 HydrophobicContact CZ-CE1 3.58Å; F1910-Y1992 WeakPolarHBondContact O-CE1 3.48Å; F1910-Y1992 PolarHBondContact O-OH 3.35Å
1911	W	96	Very high	92.1	Very high	11 Å²	11	57.6 Å²	57.6	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-66.7	-40.7	-179.9	-65.5	124.1	0	0	0	112.7	P1879 F1882 L1907 K1908 G1913 F1914 V1990 I2186	P1879-W1911 HydrophobicContact CB-CE3 3.85Å; P1879-W1911 HydrophobicContact CB-CZ3 4.22Å; F1882-W1911 HydrophobicContact CB-CD2 4.17Å; F1882-W1911 VanDerWaalsContact CB-CE2 3.43Å; F1882-W1911 HydrophobicContact CB-CH2 3.82Å; F1882-W1911 HydrophobicContact CB-CZ2 3.25Å; F1882-W1911 HydrophobicContact CD1-CZ2 4.25Å; F1882-W1911 AromaticContact CD2-CH2 3.94Å; F1882-W1911 HydrophobicContact CD2-CH2 3.94Å; F1882-W1911 HydrophobicContact CD2-CZ2 4.2Å; F1882-W1911 AromaticContact CG-CH2 3.92Å; F1882-W1911 HydrophobicContact CG-CH2 3.92Å; F1882-W1911 AromaticContact CG-CZ2 3.69Å; F1882-W1911 HydrophobicContact CG-CZ2 3.69Å; L1907-W1911 PolarHBondContact O-N 3Å; K1908-W1911 PolarHBondContact O-N 2.86Å; W1911-G1913 PolarHBondContact O-N 2.96Å; W1911-F1914 HydrophobicContact CE3-CB 4.41Å; W1911-F1914 HydrophobicContact CE3-CD2 4.08Å; W1911-F1914 HydrophobicContact CE3-CG 4.21Å; W1911-F1914 HydrophobicContact CZ3-CD2 4.04Å; W1911-F1914 HydrophobicContact CZ3-CE2 4.06Å; W1911-F1914 HydrophobicContact CZ3-CG 4.41Å; W1911-F1914 HydrophobicContact CZ3-CZ 4.41Å; W1911-F1914 VanDerWaalsContact O-CB 3.24Å; W1911-F1914 WeakPolarHBondContact O-CB 3.41Å; W1911-F1914 PolarHBondContact O-N 2.91Å; W1911-V1990 HydrophobicContact CH2-CB 4.4Å; W1911-V1990 HydrophobicContact CH2-CG1 3.43Å; W1911-V1990 VanDerWaalsContact CH2-CG1 3.43Å; W1911-V1990 HydrophobicContact CH2-CG2 4.12Å; W1911-V1990 HydrophobicContact CZ2-CG1 4.28Å; W1911-V1990 HydrophobicContact CZ3-CG1 3.67Å; W1911-I2186 HydrophobicContact CH2-CD1 3.93Å; W1911-I2186 HydrophobicContact CH2-CG1 4.33Å; W1911-I2186 HydrophobicContact CZ3-CD1 3.74Å; W1911-I2186 HydrophobicContact CZ3-CG1 4.19Å
1912	D	94.7	Very high	92.1	Very high	54 Å²	54	55.7 Å²	55.7	29%	0.289	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.1	173.6	-77.2	-30.3	0	0	0	112.4	K1908 R1919	K1908-D1912 VanDerWaalsContact O-CB 3.24Å; K1908-D1912 WeakPolarHBondContact O-CB 3.44Å; K1908-D1912 PolarHBondContact O-N 3.29Å; D1912-R1919 VanDerWaalsContact O-CB 3.27Å; D1912-R1919 WeakPolarHBondContact O-CB 3.2Å; D1912-R1919 WeakPolarHBondContact O-CD 3.21Å
1913	G	94	Very high	91.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-1	178	0	0	0	0	0	115	F1910 W1911 K1916 R1920	F1910-G1913 CarbonylContact O-C 3.03Å; F1910-G1913 PolarHBondContact O-N 2.96Å; W1911-G1913 PolarHBondContact O-N 2.96Å; G1913-K1916 WeakPolarHBondContact CA-O 3.36Å; G1913-R1920 WeakPolarHBondContact O-CG 3.35Å; G1913-R1920 PolarHBondContact O-NE 3.43Å
1914	F	95.5	Very high	91.7	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-47.5	-174.1	-163.7	-101.5	0	0	0	111.3	P1879 F1910 W1911 R1920 V1990 Y1992 Y2018 S2184 I2186	P1879-F1914 HydrophobicContact CB-CD1 4.04Å; P1879-F1914 HydrophobicContact CB-CG 4.46Å; P1879-F1914 HydrophobicContact CG-CD1 3.52Å; P1879-F1914 HydrophobicContact CG-CE1 3.79Å; P1879-F1914 HydrophobicContact CG-CG 4.39Å; F1910-F1914 AromaticContact CE1-CD2 3.59Å; F1910-F1914 HydrophobicContact CE1-CD2 3.59Å; F1910-F1914 AromaticContact CE1-CE2 3.98Å; F1910-F1914 HydrophobicContact CE1-CE2 3.98Å; F1910-F1914 AromaticContact CZ-CD2 3.81Å; F1910-F1914 HydrophobicContact CZ-CD2 3.81Å; F1910-F1914 HydrophobicContact CZ-CE2 4.03Å; F1910-F1914 PolarHBondContact O-N 3.08Å; F1910-F1914 VanDerWaalsContact O-N 3.11Å; W1911-F1914 HydrophobicContact CE3-CB 4.41Å; W1911-F1914 HydrophobicContact CE3-CD2 4.08Å; W1911-F1914 HydrophobicContact CE3-CG 4.21Å; W1911-F1914 HydrophobicContact CZ3-CD2 4.04Å; W1911-F1914 HydrophobicContact CZ3-CE2 4.06Å; W1911-F1914 HydrophobicContact CZ3-CG 4.41Å; W1911-F1914 HydrophobicContact CZ3-CZ 4.41Å; W1911-F1914 VanDerWaalsContact O-CB 3.24Å; W1911-F1914 WeakPolarHBondContact O-CB 3.41Å; W1911-F1914 PolarHBondContact O-N 2.91Å; F1914-R1920 PolarHBondContact O-NH2 3.47Å; F1914-V1990 HydrophobicContact CE2-CG1 3.74Å; F1914-V1990 HydrophobicContact CZ-CG1 4.41Å; F1914-Y1992 HydrophobicContact CB-CE1 4.35Å; F1914-Y1992 AromaticContact CD2-CD1 3.85Å; F1914-Y1992 HydrophobicContact CD2-CD1 3.85Å; F1914-Y1992 HydrophobicContact CD2-CE1 4.01Å; F1914-Y1992 HydrophobicContact CE2-CD1 4.48Å; F1914-Y2018 HydrophobicContact CE1-CD1 4.33Å; F1914-S2184 VanDerWaalsContact CE1-CB 3.47Å; F1914-S2184 WeakPolarHBondContact O-CB 3.39Å; F1914-S2184 PolarHBondContact O-OG 3.25Å; F1914-I2186 HydrophobicContact CE1-CG1 4.21Å; F1914-I2186 HydrophobicContact CE2-CG1 4.49Å; F1914-I2186 HydrophobicContact CZ-CD1 4.39Å; F1914-I2186 HydrophobicContact CZ-CG1 3.72Å
1915	E	94.1	Very high	91.5	Very high	48 Å²	48	62.2 Å²	62.2	22%	0.224	29%	0.294	C	S	.	.	S	Bend	trans	-110	-5.1	-178.1	-53.5	-168.4	123.3	0	0	113.5	P1879 Y2018 G2020 P2022 T2023	P1879-E1915 HydrophobicContact CG-CG 4.48Å; E1915-Y2018 WeakPolarHBondContact OE1-CE1 3.24Å; E1915-Y2018 PolarHBondContact OE1-OH 3.03Å; E1915-G2020 WeakPolarHBondContact OE1-CA 3.49Å; E1915-P2022 CarbonylContact O-C 3.57Å; E1915-P2022 WeakPolarHBondContact O-CA 3.19Å; E1915-T2023 HydrophobicContact CB-CG2 4.2Å; E1915-T2023 PolarHBondContact O-N 2.9Å; E1915-T2023 PolarHBondContact O-OG1 3.14Å
1916	K	92	Very high	91.2	Very high	77 Å²	77	61.4 Å²	61.4	34%	0.335	31%	0.307	S	S	.	.			trans	-122.5	101.4	-179.9	-68.6	177.4	-179	174.8	0	109.7	G1913 E1918 R1919 T2023 D2024	G1913-K1916 WeakPolarHBondContact CA-O 3.36Å; K1916-E1918 PolarHBondContact O-N 2.89Å; K1916-R1919 HydrophobicContact CB-CB 4.15Å; K1916-R1919 HydrophobicContact CB-CG 4.08Å; K1916-R1919 PolarHBondContact O-N 2.85Å; K1916-T2023 WeakPolarHBondContact CE-OG1 3.23Å; K1916-T2023 WeakPolarHBondContact CG-OG1 3.36Å; K1916-D2024 VanDerWaalsContact CA-OD1 3.22Å; K1916-D2024 WeakPolarHBondContact CA-OD1 3.2Å; K1916-D2024 WeakPolarHBondContact CA-OD2 3.49Å
1917	R	86.9	Confident	90.8	Very high	73 Å²	73	67.8 Å²	67.8	28%	0.275	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-58.2	-36.8	-178.7	-166.7	-173.8	-49.8	-140.6	3.6	111.6	R1919 R1920 P1928 D2024 E2028	R1917-R1919 PolarHBondContact O-N 2.9Å; R1917-R1920 WeakPolarHBondContact O-CB 3.36Å; R1917-R1920 PolarHBondContact O-N 2.98Å; R1917-R1920 VanDerWaalsContact O-N 3.12Å; R1917-P1928 HydrophobicContact CG-CG 4.44Å; R1917-D2024 PolarHBondContact N-OD1 2.95Å; R1917-D2024 PolarHBondContact N-OD2 2.81Å; R1917-E2028 WeakPolarHBondContact CB-OE1 3.5Å; R1917-E2028 IonicContact CZ-OE1 3.49Å; R1917-E2028 IonicContact NE-OE1 2.66Å; R1917-E2028 PolarHBondContact NE-OE1 3.46Å; R1917-E2028 IonicContact NE-OE2 3.63Å; R1917-E2028 PolarHBondContact NE-OE2 3.18Å; R1917-E2028 VanDerWaalsContact NH2-CD 3.34Å; R1917-E2028 IonicContact NH2-OE1 2.93Å; R1917-E2028 PolarHBondContact NH2-OE1 3.3Å
1918	E	88.2	Confident	90.6	Very high	171 Å²	171	70.9 Å²	70.9	80%	0.799	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-60.7	-29.4	177.6	-66.6	-173.3	167	0	0	112.9	K1916 D2024	K1916-E1918 PolarHBondContact O-N 2.89Å; E1918-D2024 HydrophobicContact CG-CB 4.47Å; E1918-D2024 PolarHBondContact N-OD1 3.39Å
1919	R	92.6	Very high	90.4	Very high	145 Å²	145	67 Å²	67	55%	0.547	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-89.9	-1.2	-180	-64.4	-174.3	176.8	-156.8	-2.8	113.7	D1912 K1916 R1917 I1921	D1912-R1919 VanDerWaalsContact O-CB 3.27Å; D1912-R1919 WeakPolarHBondContact O-CB 3.2Å; D1912-R1919 WeakPolarHBondContact O-CD 3.21Å; K1916-R1919 HydrophobicContact CB-CB 4.15Å; K1916-R1919 HydrophobicContact CB-CG 4.08Å; K1916-R1919 PolarHBondContact O-N 2.85Å; R1917-R1919 PolarHBondContact O-N 2.9Å; R1919-I1921 PolarHBondContact O-N 3.27Å
1920	R	93.6	Very high	90.2	Very high	23 Å²	23	65.9 Å²	65.9	9%	0.087	32%	0.323	C	S	.	.	S	Bend	trans	-69.4	131.3	178.8	-70.4	-178.2	-179.1	-179.3	2.7	111.1	G1913 F1914 R1917 T1922 P1928 Y1992 S2184	G1913-R1920 WeakPolarHBondContact O-CG 3.35Å; G1913-R1920 PolarHBondContact O-NE 3.43Å; F1914-R1920 PolarHBondContact O-NH2 3.47Å; R1917-R1920 WeakPolarHBondContact O-CB 3.36Å; R1917-R1920 PolarHBondContact O-N 2.98Å; R1917-R1920 VanDerWaalsContact O-N 3.12Å; R1920-T1922 PolarHBondContact O-N 2.84Å; R1920-P1928 HydrophobicContact CB-CB 3.81Å; R1920-Y1992 HydrophobicContact CB-CE2 4.22Å; R1920-Y1992 HydrophobicContact CG-CD2 4.21Å; R1920-Y1992 HydrophobicContact CG-CE2 3.66Å; R1920-S2184 PolarHBondContact NH2-OG 2.89Å; R1920-S2184 VanDerWaalsContact NH2-OG 3.15Å
1921	I	92.3	Very high	90.1	Very high	14 Å²	14	65.9 Å²	65.9	7%	0.072	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-47.6	126.5	170	-65.3	156.6	0	0	0	110.1	L1893 Y1905 R1919 L1929 L1931	L1893-I1921 HydrophobicContact CD1-CD1 4.25Å; Y1905-I1921 HydrophobicContact CD1-CD1 4.2Å; Y1905-I1921 HydrophobicContact CD1-CG1 4.29Å; Y1905-I1921 HydrophobicContact CD2-CD1 3.59Å; Y1905-I1921 HydrophobicContact CD2-CG1 4.19Å; Y1905-I1921 HydrophobicContact CD2-CG2 4.05Å; Y1905-I1921 HydrophobicContact CE1-CG1 4.33Å; Y1905-I1921 HydrophobicContact CE1-CG2 4.34Å; Y1905-I1921 HydrophobicContact CE2-CB 4.43Å; Y1905-I1921 HydrophobicContact CE2-CD1 4.08Å; Y1905-I1921 HydrophobicContact CE2-CG1 4.22Å; Y1905-I1921 HydrophobicContact CE2-CG2 3.36Å; Y1905-I1921 HydrophobicContact CG-CD1 3.67Å; Y1905-I1921 HydrophobicContact CG-CG1 4.23Å; R1919-I1921 PolarHBondContact O-N 3.27Å; I1921-L1929 HydrophobicContact CG2-CD1 4.03Å; I1921-L1929 WeakPolarHBondContact O-CB 3.49Å; I1921-L1929 WeakPolarHBondContact O-CG 3.45Å; I1921-L1929 PolarHBondContact O-N 3.17Å; I1921-L1931 HydrophobicContact CB-CD1 4.1Å; I1921-L1931 HydrophobicContact CD1-CD1 3.74Å; I1921-L1931 HydrophobicContact CG1-CD1 4.47Å
1922	T	90.9	Very high	90	Very high	72 Å²	72	68 Å²	68	44%	0.442	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-94.7	155.1	-178.1	51.6	0	0	0	0	113.2	R1920 G1926 R1927	R1920-T1922 PolarHBondContact O-N 2.84Å; T1922-G1926 VanDerWaalsContact CG2-O 3.25Å; T1922-G1926 WeakPolarHBondContact CG2-O 3.39Å; T1922-R1927 CarbonylContact C-O 3.59Å; T1922-R1927 VanDerWaalsContact CA-O 3.31Å; T1922-R1927 WeakPolarHBondContact CA-O 3.4Å
1923	S	85.8	Confident	89.8	Confident	46 Å²	46	66 Å²	66	32%	0.322	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-73.1	169.8	167.7	-171	0	0	0	0	111.3	D1925 G1926 R1927	S1923-D1925 PolarHBondContact O-N 3.41Å; S1923-D1925 VanDerWaalsContact O-N 3.16Å; S1923-G1926 PolarHBondContact O-N 3.33Å; S1923-R1927 PolarHBondContact N-O 2.96Å
1924	K	83.5	Confident	89.3	Confident	213 Å²	213	69 Å²	69	93%	0.926	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.1	169.1	-63.1	-177.5	-180	-179.3	0	112.6	G1926	K1924-G1926 VanDerWaalsContact C-N 3.26Å; K1924-G1926 PolarHBondContact O-N 3.13Å
1925	D	83.9	Confident	88.3	Confident	117 Å²	117	74 Å²	74	63%	0.626	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	10.9	175.6	-58.4	-10	0	0	0	113.1	S1923 R1927	S1923-D1925 PolarHBondContact O-N 3.41Å; S1923-D1925 VanDerWaalsContact O-N 3.16Å; D1925-R1927 PolarHBondContact O-N 3.18Å; D1925-R1927 IonicContact OD2-NH1 2.73Å; D1925-R1927 PolarHBondContact OD2-NH1 3.4Å
1926	G	83.2	Confident	87.4	Confident	52 Å²	52	72 Å²	72	54%	0.536	35%	0.352	S	S	.	.	S	Bend	trans	73.9	-14.5	-179	0	0	0	0	0	116	T1922 S1923 K1924	T1922-G1926 VanDerWaalsContact CG2-O 3.25Å; T1922-G1926 WeakPolarHBondContact CG2-O 3.39Å; S1923-G1926 PolarHBondContact O-N 3.33Å; K1924-G1926 VanDerWaalsContact C-N 3.26Å; K1924-G1926 PolarHBondContact O-N 3.13Å
1927	R	83.7	Confident	86.4	Confident	167 Å²	167	68.8 Å²	68.8	63%	0.63	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-67.6	139.1	178.4	-59.6	-172.7	-176	99.5	6.2	112	T1922 S1923 D1925	T1922-R1927 CarbonylContact C-O 3.59Å; T1922-R1927 VanDerWaalsContact CA-O 3.31Å; T1922-R1927 WeakPolarHBondContact CA-O 3.4Å; S1923-R1927 PolarHBondContact N-O 2.96Å; D1925-R1927 PolarHBondContact O-N 3.18Å; D1925-R1927 IonicContact OD2-NH1 2.73Å; D1925-R1927 PolarHBondContact OD2-NH1 3.4Å
1928	P	88.2	Confident	85	Confident	66 Å²	66	68.9 Å²	68.9	43%	0.429	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-64	139.8	171.8	27.9	-34.5	0	0	0	110.8	R1917 R1920	R1917-P1928 HydrophobicContact CG-CG 4.44Å; R1920-P1928 HydrophobicContact CB-CB 3.81Å
1929	L	89.9	Confident	83.4	Confident	19 Å²	19	65.9 Å²	65.9	10%	0.099	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-82.5	149.4	178.9	-63.2	176.1	0	0	0	111.7	I1902 I1921 L1931 Y1992	I1902-L1929 HydrophobicContact CD1-CD1 3.66Å; I1921-L1929 HydrophobicContact CG2-CD1 4.03Å; I1921-L1929 WeakPolarHBondContact O-CB 3.49Å; I1921-L1929 WeakPolarHBondContact O-CG 3.45Å; I1921-L1929 PolarHBondContact O-N 3.17Å; L1929-L1931 HydrophobicContact CB-CD1 4.44Å; L1929-L1931 HydrophobicContact CB-CD2 3.73Å; L1929-L1931 HydrophobicContact CB-CG 3.87Å; L1929-L1931 HydrophobicContact CD1-CD2 4.05Å; L1929-Y1992 WeakPolarHBondContact O-CD2 3.49Å
1930	C	89.7	Confident	81.6	Confident	15 Å²	15	62.3 Å²	62.3	10%	0.101	33%	0.333	C	S	.	.			trans	-93.5	103.8	167.1	-173.4	0	0	0	0	107.9	C1896	C1896-C1930 HydrophobicContact CB-CB 4.25Å; C1896-C1930 WeakPolarHBondContact CB-O 3.3Å; C1896-C1930 PolarHBondContact N-O 3.2Å
1931	L	93.3	Very high	80.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	147.7	-170.7	-62	178.4	0	0	0	112.3	L1893 I1894 D1895 I1902 F1910 I1921 L1929 A1991 Y1992	L1893-L1931 HydrophobicContact CD1-CD1 4.12Å; I1894-L1931 WeakPolarHBondContact O-CA 3.31Å; D1895-L1931 HydrophobicContact CB-CD2 4.3Å; I1902-L1931 HydrophobicContact CD1-CD2 4.17Å; F1910-L1931 HydrophobicContact CD2-CB 3.93Å; F1910-L1931 HydrophobicContact CD2-CD1 4.41Å; F1910-L1931 HydrophobicContact CE2-CB 3.79Å; I1921-L1931 HydrophobicContact CB-CD1 4.1Å; I1921-L1931 HydrophobicContact CD1-CD1 3.74Å; I1921-L1931 HydrophobicContact CG1-CD1 4.47Å; L1929-L1931 HydrophobicContact CB-CD1 4.44Å; L1929-L1931 HydrophobicContact CB-CD2 3.73Å; L1929-L1931 HydrophobicContact CB-CG 3.87Å; L1929-L1931 HydrophobicContact CD1-CD2 4.05Å; L1931-A1991 WeakPolarHBondContact O-CA 3.47Å; L1931-Y1992 HydrophobicContact CB-CD2 4.05Å; L1931-Y1992 HydrophobicContact CB-CE2 3.83Å; L1931-Y1992 HydrophobicContact CD1-CE2 4.09Å; L1931-Y1992 HydrophobicContact CG-CD2 4.48Å; L1931-Y1992 HydrophobicContact CG-CE2 4.01Å; L1931-Y1992 PolarHBondContact O-N 3.1Å
1932	K	93.9	Very high	79.7	Confident	57 Å²	57	63.1 Å²	63.1	25%	0.248	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.2	163	67.1	177.4	176.3	175.3	0	111.6	L1893 I1894 V1990 A1991 T2002	L1893-K1932 CarbonylContact C-O 3.52Å; L1893-K1932 VanDerWaalsContact CA-O 3.32Å; L1893-K1932 WeakPolarHBondContact CA-O 3.49Å; I1894-K1932 HydrophobicContact CB-CG 3.87Å; I1894-K1932 HydrophobicContact CG2-CG 4.45Å; I1894-K1932 PolarHBondContact N-O 3.02Å; I1894-K1932 PolarHBondContact O-N 3.29Å; K1932-V1990 WeakPolarHBondContact CA-O 3.44Å; K1932-A1991 HydrophobicContact CB-CB 3.49Å; K1932-A1991 VanDerWaalsContact CB-CB 3.49Å; K1932-T2002 WeakPolarHBondContact CD-O 2.99Å; K1932-T2002 PolarHBondContact NZ-O 3.38Å
1933	L	91.5	Very high	79.3	Confident	10 Å²	10	60.9 Å²	60.9	5%	0.052	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	140	165	-84.9	62.7	0	0	0	108.8	L1893 L1907 F1910 W1936 V1990	L1893-L1933 HydrophobicContact CD2-CD1 3.7Å; L1893-L1933 HydrophobicContact CD2-CG 4.02Å; L1907-L1933 HydrophobicContact CD2-CD1 4.07Å; L1907-L1933 HydrophobicContact CD2-CD2 3.86Å; L1907-L1933 HydrophobicContact CD2-CG 3.97Å; F1910-L1933 HydrophobicContact CD1-CD1 3.56Å; F1910-L1933 HydrophobicContact CD2-CD1 3.96Å; F1910-L1933 HydrophobicContact CE1-CD1 3.36Å; F1910-L1933 HydrophobicContact CE2-CD1 3.76Å; F1910-L1933 HydrophobicContact CG-CD1 3.87Å; F1910-L1933 HydrophobicContact CZ-CD1 3.47Å; F1910-L1933 VanDerWaalsContact CZ-CD1 3.47Å; L1933-W1936 HydrophobicContact CB-CB 4.15Å; L1933-W1936 HydrophobicContact CD2-CB 3.98Å; L1933-W1936 HydrophobicContact CD2-CD2 3.94Å; L1933-W1936 HydrophobicContact CD2-CE3 4.11Å; L1933-W1936 HydrophobicContact CD2-CG 3.89Å; L1933-V1990 HydrophobicContact CB-CB 4.38Å; L1933-V1990 HydrophobicContact CD1-CB 4.17Å; L1933-V1990 HydrophobicContact CD1-CG1 4.05Å; L1933-V1990 HydrophobicContact CD2-CB 4.26Å; L1933-V1990 HydrophobicContact CD2-CG2 4.48Å; L1933-V1990 PolarHBondContact N-O 2.92Å
1934	K	83.6	Confident	79	Confident	63 Å²	63	65.3 Å²	65.3	27%	0.274	34%	0.343	S	S	.	.	S	Bend	trans	-84.9	123.7	170.3	-174.6	174.6	-173.1	179.1	0	110	T1892 I1894 E1901 W1936 T1938	T1892-K1934 HydrophobicContact CG2-CB 4.11Å; T1892-K1934 HydrophobicContact CG2-CD 3.98Å; T1892-K1934 VanDerWaalsContact O-CB 3.25Å; T1892-K1934 WeakPolarHBondContact O-CB 3.43Å; T1892-K1934 PolarHBondContact O-N 3.46Å; I1894-K1934 HydrophobicContact CD1-CB 3.78Å; I1894-K1934 HydrophobicContact CD1-CD 4.02Å; I1894-K1934 HydrophobicContact CD1-CG 3.82Å; I1894-K1934 HydrophobicContact CG1-CB 4.17Å; E1901-K1934 IonicContact OE1-NZ 2.72Å; E1901-K1934 PolarHBondContact OE1-NZ 3.28Å; K1934-W1936 VanDerWaalsContact C-N 3.28Å; K1934-W1936 PolarHBondContact O-N 3.26Å; K1934-T1938 WeakPolarHBondContact O-CG2 3.45Å
1935	D	72.9	Confident	78.9	Confident	106 Å²	106	58.6 Å²	58.6	57%	0.567	32%	0.317	S	S	*	.	S	Bend	trans	43.6	45.4	163	-45.9	-28.8	0	0	0	114.3	P1937 T1938	D1935-P1937 CarbonylContact O-C 3.46Å; D1935-P1937 VanDerWaalsContact O-O 3.05Å; D1935-T1938 WeakPolarHBondContact O-CA 3.47Å; D1935-T1938 WeakPolarHBondContact O-CG2 3.45Å; D1935-T1938 PolarHBondContact O-N 3.21Å
1936	W	75.2	Confident	79	Confident	5 Å²	5	53.2 Å²	53.2	2%	0.019	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-94.5	134	-168	-166.1	74.2	0	0	0	112.7	F1882 F1886 M1889 L1907 L1933 K1934 Q1946 L1988	F1882-W1936 AromaticContact CD1-CH2 3.99Å; F1882-W1936 HydrophobicContact CD1-CH2 3.99Å; F1882-W1936 AromaticContact CD1-CZ3 3.91Å; F1882-W1936 HydrophobicContact CD1-CZ3 3.91Å; F1882-W1936 HydrophobicContact CE1-CH2 4.32Å; F1882-W1936 AromaticContact CE1-CZ3 3.89Å; F1882-W1936 HydrophobicContact CE1-CZ3 3.89Å; F1886-W1936 HydrophobicContact CB-CZ2 4.27Å; F1886-W1936 HydrophobicContact CD1-CH2 4.41Å; F1886-W1936 HydrophobicContact CD1-CZ2 4.03Å; F1886-W1936 AromaticContact CD2-CH2 3.87Å; F1886-W1936 HydrophobicContact CD2-CH2 3.87Å; F1886-W1936 HydrophobicContact CD2-CZ2 4.25Å; F1886-W1936 HydrophobicContact CE2-CH2 4.25Å; F1886-W1936 AromaticContact CG-CH2 3.99Å; F1886-W1936 HydrophobicContact CG-CH2 3.99Å; F1886-W1936 AromaticContact CG-CZ2 3.89Å; F1886-W1936 HydrophobicContact CG-CZ2 3.89Å; M1889-W1936 HydrophobicContact CE-CZ2 3.7Å; L1907-W1936 HydrophobicContact CD1-CZ2 4.34Å; L1933-W1936 HydrophobicContact CB-CB 4.15Å; L1933-W1936 HydrophobicContact CD2-CB 3.98Å; L1933-W1936 HydrophobicContact CD2-CD2 3.94Å; L1933-W1936 HydrophobicContact CD2-CE3 4.11Å; L1933-W1936 HydrophobicContact CD2-CG 3.89Å; K1934-W1936 VanDerWaalsContact C-N 3.28Å; K1934-W1936 PolarHBondContact O-N 3.26Å; W1936-Q1946 VanDerWaalsContact CH2-NE2 3.35Å; W1936-L1988 HydrophobicContact CE3-CB 4.38Å; W1936-L1988 HydrophobicContact CE3-CD2 3.76Å; W1936-L1988 HydrophobicContact CZ3-CD2 3.67Å; W1936-L1988 WeakPolarHBondContact O-CB 3.39Å; W1936-L1988 PolarHBondContact O-N 3.19Å; W1936-L1988 VanDerWaalsContact O-N 3.12Å
1937	P	71.9	Confident	79.3	Confident	10 Å²	10	54 Å²	54	7%	0.065	28%	0.284	C	S	.	.	S	Bend	cis	-71.3	142.4	-5.8	-17.5	32.2	0	0	0	114.3	D1935 F1942 L1945	D1935-P1937 CarbonylContact O-C 3.46Å; D1935-P1937 VanDerWaalsContact O-O 3.05Å; P1937-F1942 HydrophobicContact CG-CD2 3.96Å; P1937-L1945 HydrophobicContact CB-CD1 3.48Å; P1937-L1945 VanDerWaalsContact CB-CD1 3.48Å; P1937-L1945 HydrophobicContact CG-CD1 4.1Å
1938	T	58.2	Low	79.8	Confident	76 Å²	76	53.7 Å²	53.7	47%	0.466	29%	0.287	S	S	.	.			trans	-85	-15	-163.3	47.2	0	0	0	0	116.3	K1934 D1935	K1934-T1938 WeakPolarHBondContact O-CG2 3.45Å; D1935-T1938 WeakPolarHBondContact O-CA 3.47Å; D1935-T1938 WeakPolarHBondContact O-CG2 3.45Å; D1935-T1938 PolarHBondContact O-N 3.21Å
1939	T	53.2	Low	80.1	Confident	107 Å²	107	51 Å²	51	66%	0.656	27%	0.268	S	S	*	.	S	Bend	trans	-145.4	-21.3	-161.6	31.6	0	0	0	0	115.6
1940	D	56	Low	80.2	Confident	70 Å²	70	51.3 Å²	51.3	37%	0.374	27%	0.269	S	S	.	.	S	Bend	trans	-137.9	153.2	-164.6	-37	-83.5	0	0	0	108.5	F1942 L1945	D1940-F1942 PolarHBondContact O-N 2.94Å; D1940-L1945 HydrophobicContact CB-CD1 3.76Å; D1940-L1945 HydrophobicContact CB-CG 3.95Å
1941	D	66.7	Low	80.4	Confident	52 Å²	52	54.8 Å²	54.8	28%	0.278	29%	0.287	S	S	.	.			trans	-62.7	140.4	-177	-168.5	-14.4	0	0	0	109.6	A1943 E1944 L1945 R1965	D1941-A1943 HydrophobicContact CB-CB 4.35Å; D1941-A1943 PolarHBondContact O-N 2.87Å; D1941-A1943 PolarHBondContact OD1-N 3.16Å; D1941-E1944 HydrophobicContact CB-CB 4.49Å; D1941-E1944 HydrophobicContact CB-CG 4.16Å; D1941-E1944 PolarHBondContact O-N 2.85Å; D1941-L1945 PolarHBondContact O-N 3.16Å; D1941-R1965 IonicContact OD1-NH2 3.15Å; D1941-R1965 PolarHBondContact OD1-NH2 3.1Å; D1941-R1965 IonicContact OD2-CZ 3.16Å; D1941-R1965 IonicContact OD2-NH1 2.69Å; D1941-R1965 PolarHBondContact OD2-NH1 3.17Å; D1941-R1965 VanDerWaalsContact OD2-NH1 3.14Å; D1941-R1965 IonicContact OD2-NH2 3.56Å; D1941-R1965 PolarHBondContact OD2-NH2 3.16Å; D1941-R1965 VanDerWaalsContact OD2-NH2 3.1Å
1942	F	79.1	Confident	80.5	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.013	29%	0.29	C	S	.	.	H	α-helix	trans	-55.4	-30.8	170.3	-167.7	-87.4	0	0	0	111.1	W1877 P1937 D1940 Q1946 R1949 F1950 P1986 L1988	W1877-F1942 HydrophobicContact CH2-CE1 4.33Å; W1877-F1942 HydrophobicContact CH2-CZ 4.05Å; W1877-F1942 HydrophobicContact CZ3-CZ 4.12Å; P1937-F1942 HydrophobicContact CG-CD2 3.96Å; D1940-F1942 PolarHBondContact O-N 2.94Å; F1942-Q1946 HydrophobicContact CD1-CB 4.44Å; F1942-Q1946 HydrophobicContact CE1-CB 4.28Å; F1942-Q1946 HydrophobicContact CE2-CG 4.48Å; F1942-Q1946 HydrophobicContact CZ-CB 4.35Å; F1942-Q1946 CarbonylContact O-C 3.56Å; F1942-Q1946 WeakPolarHBondContact O-CA 3.27Å; F1942-Q1946 PolarHBondContact O-N 2.82Å; F1942-R1949 HydrophobicContact CE1-CB 3.97Å; F1942-R1949 HydrophobicContact CZ-CB 4.09Å; F1942-F1950 HydrophobicContact CD1-CB 3.83Å; F1942-F1950 HydrophobicContact CD1-CD2 4.07Å; F1942-F1950 HydrophobicContact CD1-CG 4.45Å; F1942-F1950 HydrophobicContact CE1-CB 4.25Å; F1942-P1986 HydrophobicContact CB-CG 3.86Å; F1942-P1986 HydrophobicContact CD1-CG 3.63Å; F1942-P1986 HydrophobicContact CE1-CG 4.33Å; F1942-P1986 HydrophobicContact CG-CG 3.81Å; F1942-L1988 HydrophobicContact CE2-CB 4.12Å; F1942-L1988 HydrophobicContact CE2-CD1 4.24Å; F1942-L1988 HydrophobicContact CZ-CD1 4.43Å
1943	A	81.3	Confident	80.5	Confident	24 Å²	24	52.7 Å²	52.7	20%	0.198	28%	0.278	C	S	.	.	H	α-helix	trans	-63.2	-34.2	170.8	0	0	0	0	0	114.1	D1941 P1947 F1950	D1941-A1943 HydrophobicContact CB-CB 4.35Å; D1941-A1943 PolarHBondContact O-N 2.87Å; D1941-A1943 PolarHBondContact OD1-N 3.16Å; A1943-P1947 WeakPolarHBondContact O-CA 3.47Å; A1943-P1947 WeakPolarHBondContact O-CB 3.29Å; A1943-F1950 HydrophobicContact CB-CB 4.4Å; A1943-F1950 HydrophobicContact CB-CD1 3.69Å; A1943-F1950 HydrophobicContact CB-CD2 3.79Å; A1943-F1950 HydrophobicContact CB-CE1 3.82Å; A1943-F1950 HydrophobicContact CB-CE2 3.92Å; A1943-F1950 HydrophobicContact CB-CG 3.67Å; A1943-F1950 HydrophobicContact CB-CZ 3.94Å
1944	E	80.3	Confident	80.6	Confident	140 Å²	140	53.2 Å²	53.2	65%	0.654	28%	0.281	S	S	*	.	H	α-helix	trans	-84.3	-44.4	-178.8	-67.6	178.2	152.4	0	0	111.7	D1941	D1941-E1944 HydrophobicContact CB-CB 4.49Å; D1941-E1944 HydrophobicContact CB-CG 4.16Å; D1941-E1944 PolarHBondContact O-N 2.85Å
1945	L	80.4	Confident	81.1	Confident	72 Å²	72	55.8 Å²	55.8	38%	0.377	30%	0.297	S	S	.	.	H	α-helix	trans	-79.4	-31.9	-179.5	-78.8	173.5	0	0	0	114.1	P1937 D1940 D1941 P1947	P1937-L1945 HydrophobicContact CB-CD1 3.48Å; P1937-L1945 VanDerWaalsContact CB-CD1 3.48Å; P1937-L1945 HydrophobicContact CG-CD1 4.1Å; D1940-L1945 HydrophobicContact CB-CD1 3.76Å; D1940-L1945 HydrophobicContact CB-CG 3.95Å; D1941-L1945 PolarHBondContact O-N 3.16Å; L1945-P1947 VanDerWaalsContact C-CD 3.48Å
1946	Q	86.7	Confident	82.2	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.019	28%	0.277	C	S	.	.			trans	-132.5	48.3	-173.7	-49.1	-150.6	-62.4	0	0	113.4	F1886 W1936 F1942 K1948 R1949 F1950	F1886-Q1946 HydrophobicContact CE2-CG 4.46Å; F1886-Q1946 HydrophobicContact CZ-CG 3.99Å; F1886-Q1946 VanDerWaalsContact CZ-NE2 3.27Å; W1936-Q1946 VanDerWaalsContact CH2-NE2 3.35Å; F1942-Q1946 HydrophobicContact CD1-CB 4.44Å; F1942-Q1946 HydrophobicContact CE1-CB 4.28Å; F1942-Q1946 HydrophobicContact CE2-CG 4.48Å; F1942-Q1946 HydrophobicContact CZ-CB 4.35Å; F1942-Q1946 CarbonylContact O-C 3.56Å; F1942-Q1946 WeakPolarHBondContact O-CA 3.27Å; F1942-Q1946 PolarHBondContact O-N 2.82Å; Q1946-K1948 VanDerWaalsContact C-N 3.27Å; Q1946-K1948 PolarHBondContact O-N 2.79Å; Q1946-R1949 HydrophobicContact CB-CB 4.07Å; Q1946-R1949 CarbonylContact O-C 3.55Å; Q1946-R1949 WeakPolarHBondContact O-CA 3.4Å; Q1946-R1949 PolarHBondContact O-N 3.46Å; Q1946-F1950 PolarHBondContact O-N 3.37Å
1947	P	89.9	Confident	83.1	Confident	68 Å²	68	52 Å²	52	44%	0.442	28%	0.277	S	S	.	.	H	α-helix	trans	-53.1	-36.6	-168.7	18	-32.2	0	0	0	114.8	A1943 L1945 F1950 N1951	A1943-P1947 WeakPolarHBondContact O-CA 3.47Å; A1943-P1947 WeakPolarHBondContact O-CB 3.29Å; L1945-P1947 VanDerWaalsContact C-CD 3.48Å; P1947-F1950 PolarHBondContact O-N 3.11Å; P1947-N1951 WeakPolarHBondContact O-CB 3.21Å; P1947-N1951 VanDerWaalsContact O-CG 3.23Å; P1947-N1951 PolarHBondContact O-N 2.97Å; P1947-N1951 PolarHBondContact O-OD1 3.19Å
1948	K	93.4	Very high	84.2	Confident	161 Å²	161	51.6 Å²	51.6	70%	0.7	27%	0.274	S	S	*	.	H	α-helix	trans	-61.9	-47.1	174.5	-66.7	-177.5	-179.4	176.9	0	112.4	L1876 Q1946 D1952	L1876-K1948 HydrophobicContact CD1-CB 4.45Å; Q1946-K1948 VanDerWaalsContact C-N 3.27Å; Q1946-K1948 PolarHBondContact O-N 2.79Å; K1948-D1952 WeakPolarHBondContact O-CB 3.28Å; K1948-D1952 PolarHBondContact O-N 2.86Å
1949	R	94.1	Very high	86	Confident	9 Å²	9	48.7 Å²	48.7	3%	0.034	26%	0.255	C	S	.	.	H	α-helix	trans	-72.4	-33.7	178.7	-70	-178.8	-173.9	86.5	5.4	111.6	L1876 W1877 S1881 D1885 F1942 Q1946 L1953	L1876-R1949 HydrophobicContact CB-CG 4.16Å; L1876-R1949 PolarHBondContact O-NE 2.92Å; L1876-R1949 PolarHBondContact O-NH2 3.49Å; L1876-R1949 VanDerWaalsContact O-NH2 3.17Å; W1877-R1949 HydrophobicContact CE3-CG 4.49Å; W1877-R1949 HydrophobicContact CH2-CB 3.59Å; W1877-R1949 HydrophobicContact CH2-CG 4.15Å; W1877-R1949 WeakPolarHBondContact CH2-O 3.39Å; W1877-R1949 HydrophobicContact CZ2-CB 3.92Å; W1877-R1949 HydrophobicContact CZ2-CG 4.31Å; W1877-R1949 WeakPolarHBondContact CZ2-O 3.49Å; W1877-R1949 HydrophobicContact CZ3-CB 4.03Å; W1877-R1949 HydrophobicContact CZ3-CG 4.22Å; S1881-R1949 PolarHBondContact OG-NH2 2.85Å; D1885-R1949 IonicContact OD2-CZ 2.64Å; D1885-R1949 IonicContact OD2-NH1 3.79Å; D1885-R1949 PolarHBondContact OD2-NH1 3.38Å; D1885-R1949 IonicContact OD2-NH2 3.32Å; D1885-R1949 PolarHBondContact OD2-NH2 3.27Å; F1942-R1949 HydrophobicContact CE1-CB 3.97Å; F1942-R1949 HydrophobicContact CZ-CB 4.09Å; Q1946-R1949 HydrophobicContact CB-CB 4.07Å; Q1946-R1949 CarbonylContact O-C 3.55Å; Q1946-R1949 WeakPolarHBondContact O-CA 3.4Å; Q1946-R1949 PolarHBondContact O-N 3.46Å; R1949-L1953 WeakPolarHBondContact O-CB 3.47Å; R1949-L1953 PolarHBondContact O-N 2.6Å
1950	F	92.5	Very high	87.9	Confident	26 Å²	26	46.1 Å²	46.1	11%	0.114	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-49.9	173	177.5	-102.1	0	0	0	111.1	F1942 A1943 Q1946 P1947 L1953 M1954 P1986	F1942-F1950 HydrophobicContact CD1-CB 3.83Å; F1942-F1950 HydrophobicContact CD1-CD2 4.07Å; F1942-F1950 HydrophobicContact CD1-CG 4.45Å; F1942-F1950 HydrophobicContact CE1-CB 4.25Å; A1943-F1950 HydrophobicContact CB-CB 4.4Å; A1943-F1950 HydrophobicContact CB-CD1 3.69Å; A1943-F1950 HydrophobicContact CB-CD2 3.79Å; A1943-F1950 HydrophobicContact CB-CE1 3.82Å; A1943-F1950 HydrophobicContact CB-CE2 3.92Å; A1943-F1950 HydrophobicContact CB-CG 3.67Å; A1943-F1950 HydrophobicContact CB-CZ 3.94Å; Q1946-F1950 PolarHBondContact O-N 3.37Å; P1947-F1950 PolarHBondContact O-N 3.11Å; F1950-L1953 PolarHBondContact O-N 3.16Å; F1950-M1954 HydrophobicContact CD1-CG 4.22Å; F1950-M1954 HydrophobicContact CD2-CG 4.02Å; F1950-M1954 HydrophobicContact CE1-CG 3.81Å; F1950-M1954 HydrophobicContact CE2-CE 4.26Å; F1950-M1954 HydrophobicContact CE2-CG 3.59Å; F1950-M1954 HydrophobicContact CE2-SD 3.82Å; F1950-M1954 HydrophobicContact CG-CG 4.32Å; F1950-M1954 HydrophobicContact CZ-CG 3.48Å; F1950-M1954 VanDerWaalsContact CZ-CG 3.48Å; F1950-M1954 HydrophobicContact CZ-SD 3.95Å; F1950-M1954 VanDerWaalsContact O-CG 3.31Å; F1950-M1954 WeakPolarHBondContact O-CG 3.34Å; F1950-M1954 PolarHBondContact O-N 3.41Å; F1950-P1986 HydrophobicContact CD2-CG 3.88Å; F1950-P1986 HydrophobicContact CE2-CG 4.16Å
1951	N	93.6	Very high	89.7	Confident	88 Å²	88	45.3 Å²	45.3	47%	0.471	24%	0.236	S	C	.	.	H	α-helix	trans	-63.7	-47.5	178.5	-68.8	-6.5	0	0	0	111.6	P1947 L1953 M1954 L1955	P1947-N1951 WeakPolarHBondContact O-CB 3.21Å; P1947-N1951 VanDerWaalsContact O-CG 3.23Å; P1947-N1951 PolarHBondContact O-N 2.97Å; P1947-N1951 PolarHBondContact O-OD1 3.19Å; N1951-L1953 PolarHBondContact O-N 2.89Å; N1951-M1954 PolarHBondContact O-N 3.43Å; N1951-L1955 WeakPolarHBondContact O-CB 3.31Å; N1951-L1955 VanDerWaalsContact O-CG 3.25Å; N1951-L1955 WeakPolarHBondContact O-CG 3.25Å; N1951-L1955 PolarHBondContact O-N 2.74Å
1952	D	95.9	Very high	91.1	Very high	13 Å²	13	42.8 Å²	42.8	7%	0.07	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-30.7	176.5	-170.9	78.3	0	0	0	112.5	F1872 T1873 L1876 W1877 K1948 N1956	F1872-D1952 WeakPolarHBondContact CD1-OD2 3.49Å; T1873-D1952 VanDerWaalsContact CB-OD1 3.22Å; T1873-D1952 WeakPolarHBondContact CB-OD1 3.49Å; T1873-D1952 PolarHBondContact N-OD1 3.38Å; T1873-D1952 PolarHBondContact N-OD2 2.84Å; T1873-D1952 VanDerWaalsContact N-OD2 3.12Å; T1873-D1952 PolarHBondContact OG1-OD1 2.77Å; L1876-D1952 HydrophobicContact CD1-CB 3.93Å; W1877-D1952 PolarHBondContact NE1-OD2 2.79Å; K1948-D1952 WeakPolarHBondContact O-CB 3.28Å; K1948-D1952 PolarHBondContact O-N 2.86Å; D1952-N1956 WeakPolarHBondContact O-CB 3.39Å; D1952-N1956 PolarHBondContact O-ND2 2.67Å
1953	L	95.1	Very high	91.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-73.4	-57.4	172.5	179.9	59.6	0	0	0	112.1	F1872 W1877 R1949 F1950 N1951 L1955 N1956 L1957 P1986 A2188 V2190	F1872-L1953 HydrophobicContact CE1-CB 4.46Å; F1872-L1953 HydrophobicContact CE1-CD1 3.68Å; F1872-L1953 HydrophobicContact CZ-CD1 4.07Å; W1877-L1953 HydrophobicContact CH2-CB 4.16Å; W1877-L1953 HydrophobicContact CZ2-CB 4.11Å; R1949-L1953 WeakPolarHBondContact O-CB 3.47Å; R1949-L1953 PolarHBondContact O-N 2.6Å; F1950-L1953 PolarHBondContact O-N 3.16Å; N1951-L1953 PolarHBondContact O-N 2.89Å; L1953-L1955 VanDerWaalsContact C-N 3.3Å; L1953-L1955 PolarHBondContact O-N 3.06Å; L1953-N1956 PolarHBondContact O-N 3.19Å; L1953-N1956 VanDerWaalsContact O-N 3.11Å; L1953-L1957 HydrophobicContact CD1-CD2 3.73Å; L1953-L1957 HydrophobicContact CG-CD2 4.28Å; L1953-L1957 WeakPolarHBondContact O-CG 3.31Å; L1953-L1957 PolarHBondContact O-N 2.74Å; L1953-P1986 HydrophobicContact CD2-CB 3.55Å; L1953-P1986 HydrophobicContact CD2-CG 3.88Å; L1953-A2188 HydrophobicContact CD1-CB 4.1Å; L1953-A2188 HydrophobicContact CD2-CB 3.65Å; L1953-V2190 HydrophobicContact CD2-CG2 4.3Å
1954	M	93.1	Very high	92.4	Very high	21 Å²	21	43.7 Å²	43.7	10%	0.103	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-37.3	-174.7	-66.3	-65.4	97.8	0	0	113	F1950 N1951 N1956 L1957 Q1964 R1965 P1986 V2190	F1950-M1954 HydrophobicContact CD1-CG 4.22Å; F1950-M1954 HydrophobicContact CD2-CG 4.02Å; F1950-M1954 HydrophobicContact CE1-CG 3.81Å; F1950-M1954 HydrophobicContact CE2-CE 4.26Å; F1950-M1954 HydrophobicContact CE2-CG 3.59Å; F1950-M1954 HydrophobicContact CE2-SD 3.82Å; F1950-M1954 HydrophobicContact CG-CG 4.32Å; F1950-M1954 HydrophobicContact CZ-CG 3.48Å; F1950-M1954 VanDerWaalsContact CZ-CG 3.48Å; F1950-M1954 HydrophobicContact CZ-SD 3.95Å; F1950-M1954 VanDerWaalsContact O-CG 3.31Å; F1950-M1954 WeakPolarHBondContact O-CG 3.34Å; F1950-M1954 PolarHBondContact O-N 3.41Å; N1951-M1954 PolarHBondContact O-N 3.43Å; M1954-N1956 VanDerWaalsContact C-N 3.33Å; M1954-L1957 HydrophobicContact CE-CD1 3.94Å; M1954-L1957 HydrophobicContact SD-CD1 4.5Å; M1954-Q1964 PolarHBondContact O-NE2 3.14Å; M1954-R1965 HydrophobicContact SD-CG 4.18Å; M1954-P1986 HydrophobicContact CE-CB 4.43Å; M1954-P1986 HydrophobicContact CE-CG 4.04Å; M1954-V2190 HydrophobicContact CE-CG2 3.67Å
1955	L	93.6	Very high	92.8	Very high	117 Å²	117	42.1 Å²	42.1	61%	0.613	21%	0.211	S	C	*	.	H	α-helix	trans	-69.7	-29.5	178.7	-69.2	170.5	0	0	0	112.8	N1951 L1953	N1951-L1955 WeakPolarHBondContact O-CB 3.31Å; N1951-L1955 VanDerWaalsContact O-CG 3.25Å; N1951-L1955 WeakPolarHBondContact O-CG 3.25Å; N1951-L1955 PolarHBondContact O-N 2.74Å; L1953-L1955 VanDerWaalsContact C-N 3.3Å; L1953-L1955 PolarHBondContact O-N 3.06Å
1956	N	95.4	Very high	93.2	Very high	29 Å²	29	43 Å²	43	16%	0.155	22%	0.216	C	C	.	.	H	α-helix	trans	-107.3	3.3	-169.3	-66.3	-45.9	0	0	0	114.7	K1871 F1872 D1952 L1953 M1954	K1871-N1956 HydrophobicContact CB-CB 3.8Å; K1871-N1956 HydrophobicContact CD-CB 4.34Å; K1871-N1956 PolarHBondContact O-ND2 3.39Å; K1871-N1956 VanDerWaalsContact O-ND2 3.09Å; K1871-N1956 PolarHBondContact O-OD1 3.01Å; F1872-N1956 HydrophobicContact CD1-CB 4.31Å; F1872-N1956 HydrophobicContact CD2-CB 3.97Å; F1872-N1956 HydrophobicContact CE1-CB 4.11Å; F1872-N1956 HydrophobicContact CE2-CB 3.72Å; F1872-N1956 HydrophobicContact CG-CB 4.26Å; F1872-N1956 HydrophobicContact CZ-CB 3.8Å; D1952-N1956 WeakPolarHBondContact O-CB 3.39Å; D1952-N1956 PolarHBondContact O-ND2 2.67Å; L1953-N1956 PolarHBondContact O-N 3.19Å; L1953-N1956 VanDerWaalsContact O-N 3.11Å; M1954-N1956 VanDerWaalsContact C-N 3.33Å
1957	L	95.1	Very high	93.5	Very high	2 Å²	2	43 Å²	43	1%	0.01	22%	0.217	C	C	.	.			trans	-57.4	133.9	174.1	-68.3	176.4	0	0	0	111.5	L1953 M1954 T1963 V2013 V2015 V2190	L1953-L1957 HydrophobicContact CD1-CD2 3.73Å; L1953-L1957 HydrophobicContact CG-CD2 4.28Å; L1953-L1957 WeakPolarHBondContact O-CG 3.31Å; L1953-L1957 PolarHBondContact O-N 2.74Å; M1954-L1957 HydrophobicContact CE-CD1 3.94Å; M1954-L1957 HydrophobicContact SD-CD1 4.5Å; L1957-T1963 WeakPolarHBondContact CB-OG1 3.36Å; L1957-T1963 VanDerWaalsContact CD1-O 3.28Å; L1957-T1963 WeakPolarHBondContact CD1-O 3.25Å; L1957-V2013 HydrophobicContact CD2-CG1 4.38Å; L1957-V2015 HydrophobicContact CD2-CG2 4.36Å; L1957-V2190 HydrophobicContact CD1-CB 4.35Å; L1957-V2190 HydrophobicContact CD1-CG1 4.17Å; L1957-V2190 HydrophobicContact CD1-CG2 4.05Å; L1957-V2190 HydrophobicContact CD2-CG2 4.07Å
1958	P	95.5	Very high	93.7	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	21%	0.206	C	C	.	.	S	Bend	trans	-71.7	155.9	170.5	31.3	-34.4	0	0	0	111	P1844 I1865 T1963 V2013 A2168 F2170	P1844-P1958 HydrophobicContact CB-CB 4.45Å; I1865-P1958 HydrophobicContact CB-CB 4.36Å; I1865-P1958 HydrophobicContact CD1-CB 4.07Å; I1865-P1958 HydrophobicContact CG2-CB 4.05Å; P1958-T1963 VanDerWaalsContact O-CG2 3.26Å; P1958-T1963 WeakPolarHBondContact O-CG2 3.36Å; P1958-T1963 PolarHBondContact O-OG1 3.24Å; P1958-V2013 HydrophobicContact CG-CG2 4.44Å; P1958-A2168 HydrophobicContact CG-CB 3.69Å; P1958-F2170 HydrophobicContact CB-CE2 4.45Å; P1958-F2170 HydrophobicContact CB-CZ 4.41Å; P1958-F2170 HydrophobicContact CG-CE2 3.87Å; P1958-F2170 HydrophobicContact CG-CZ 3.94Å
1959	M	95.1	Very high	93.8	Very high	15 Å²	15	34.4 Å²	34.4	7%	0.074	17%	0.174	C	C	.	.	S	Bend	trans	50.1	55.9	-173.5	-60.6	-60.8	96.9	0	0	113.6	N1849 F1853 I1865 N1961 Y1962 T1963 F2170	N1849-M1959 HydrophobicContact CB-CE 3.55Å; N1849-M1959 HydrophobicContact CB-SD 4.26Å; F1853-M1959 HydrophobicContact CB-SD 4.08Å; F1853-M1959 HydrophobicContact CD2-CG 3.8Å; F1853-M1959 HydrophobicContact CD2-SD 4.43Å; F1853-M1959 HydrophobicContact CE2-CG 4.15Å; F1853-M1959 HydrophobicContact CG-CG 4.05Å; F1853-M1959 HydrophobicContact CG-SD 4.19Å; I1865-M1959 HydrophobicContact CD1-CE 4.38Å; I1865-M1959 HydrophobicContact CD1-CG 3.75Å; M1959-N1961 PolarHBondContact O-N 3.46Å; M1959-Y1962 PolarHBondContact O-N 3.03Å; M1959-T1963 PolarHBondContact O-N 3.07Å; M1959-T1963 VanDerWaalsContact O-N 3.11Å; M1959-T1963 PolarHBondContact O-OG1 3.13Å; M1959-T1963 VanDerWaalsContact O-OG1 3.1Å; M1959-F2170 HydrophobicContact CB-CE1 4.28Å; M1959-F2170 HydrophobicContact CB-CZ 4.06Å; M1959-F2170 HydrophobicContact CG-CZ 4.14Å
1960	P	94.1	Very high	93.9	Very high	53 Å²	53	34.2 Å²	34.2	34%	0.344	17%	0.173	S	C	.	.	H	α-helix	trans	-54.9	-32.1	-171.9	19.7	-33	0	0	0	114.6	Y1962 T1963 Q1964 G1967	P1960-Y1962 PolarHBondContact O-N 3.12Å; P1960-Y1962 VanDerWaalsContact O-N 3.09Å; P1960-T1963 PolarHBondContact O-N 3.49Å; P1960-Q1964 VanDerWaalsContact CB-CD 3.43Å; P1960-Q1964 HydrophobicContact CB-CG 3.89Å; P1960-Q1964 WeakPolarHBondContact O-CB 3.45Å; P1960-Q1964 PolarHBondContact O-N 2.96Å; P1960-Q1964 VanDerWaalsContact O-N 3.14Å; P1960-G1967 WeakPolarHBondContact O-CA 3.33Å
1961	N	93.2	Very high	93.9	Very high	53 Å²	53	33 Å²	33	28%	0.283	17%	0.168	S	C	.	.	H	α-helix	trans	-54.5	-26.5	173.5	-74.3	-27.3	0	0	0	114	M1959 G1967 Q1968 L1969 N1970	M1959-N1961 PolarHBondContact O-N 3.46Å; N1961-G1967 CarbonylContact O-C 3.49Å; N1961-Q1968 PolarHBondContact O-N 2.83Å; N1961-Q1968 VanDerWaalsContact O-N 3.15Å; N1961-L1969 WeakPolarHBondContact O-CA 3.26Å; N1961-L1969 PolarHBondContact O-N 3.45Å; N1961-N1970 PolarHBondContact O-N 2.94Å
1962	Y	96	Very high	93.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-103.9	-39.6	176.7	-73.3	-92.1	0	0	0	112.6	L1850 F1853 Q1854 M1959 P1960 L1969 N1970 F2192 E2196	L1850-Y1962 HydrophobicContact CD1-CD2 4.44Å; L1850-Y1962 HydrophobicContact CD1-CE2 3.86Å; F1853-Y1962 HydrophobicContact CD1-CD2 4.22Å; F1853-Y1962 AromaticContact CD1-CE2 3.93Å; F1853-Y1962 HydrophobicContact CD1-CE2 3.93Å; F1853-Y1962 HydrophobicContact CE1-CD1 4.17Å; F1853-Y1962 AromaticContact CE1-CD2 3.82Å; F1853-Y1962 HydrophobicContact CE1-CD2 3.82Å; F1853-Y1962 HydrophobicContact CE1-CE1 4.14Å; F1853-Y1962 AromaticContact CE1-CE2 3.8Å; F1853-Y1962 HydrophobicContact CE1-CE2 3.8Å; F1853-Y1962 HydrophobicContact CE1-CG 4.01Å; F1853-Y1962 AromaticContact CE1-CZ 3.96Å; Q1854-Y1962 HydrophobicContact CG-CE2 4.34Å; Q1854-Y1962 WeakPolarHBondContact CG-OH 3.29Å; Q1854-Y1962 PolarHBondContact NE2-OH 2.64Å; M1959-Y1962 PolarHBondContact O-N 3.03Å; P1960-Y1962 PolarHBondContact O-N 3.12Å; P1960-Y1962 VanDerWaalsContact O-N 3.09Å; Y1962-L1969 HydrophobicContact CD1-CB 4.23Å; Y1962-L1969 HydrophobicContact CD2-CD1 4.47Å; Y1962-L1969 HydrophobicContact CE1-CB 4.09Å; Y1962-L1969 HydrophobicContact CE1-CD1 4.2Å; Y1962-L1969 HydrophobicContact CE2-CD1 3.69Å; Y1962-L1969 WeakPolarHBondContact OH-CD1 3.33Å; Y1962-N1970 WeakPolarHBondContact O-CB 3.33Å; Y1962-F2192 HydrophobicContact CD1-CD2 4.47Å; Y1962-F2192 HydrophobicContact CD1-CE2 4.12Å; Y1962-F2192 HydrophobicContact CG-CE2 4.44Å; Y1962-F2192 WeakPolarHBondContact O-CB 3.45Å; Y1962-F2192 WeakPolarHBondContact O-CD2 3.49Å; Y1962-F2192 WeakPolarHBondContact O-CG 3.44Å; Y1962-E2196 WeakPolarHBondContact CE1-OE1 3.2Å; Y1962-E2196 PolarHBondContact OH-OE1 3.44Å
1963	T	95.3	Very high	93.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-97.1	-20.6	-162.5	56.2	0	0	0	0	114.9	L1957 P1958 M1959 P1960 V2013 F2170 F2192	L1957-T1963 WeakPolarHBondContact CB-OG1 3.36Å; L1957-T1963 VanDerWaalsContact CD1-O 3.28Å; L1957-T1963 WeakPolarHBondContact CD1-O 3.25Å; P1958-T1963 VanDerWaalsContact O-CG2 3.26Å; P1958-T1963 WeakPolarHBondContact O-CG2 3.36Å; P1958-T1963 PolarHBondContact O-OG1 3.24Å; M1959-T1963 PolarHBondContact O-N 3.07Å; M1959-T1963 VanDerWaalsContact O-N 3.11Å; M1959-T1963 PolarHBondContact O-OG1 3.13Å; M1959-T1963 VanDerWaalsContact O-OG1 3.1Å; P1960-T1963 PolarHBondContact O-N 3.49Å; T1963-V2013 HydrophobicContact CG2-CB 4.18Å; T1963-V2013 HydrophobicContact CG2-CG1 3.71Å; T1963-F2170 HydrophobicContact CG2-CE1 3.53Å; T1963-F2170 HydrophobicContact CG2-CZ 3.9Å; T1963-F2192 HydrophobicContact CG2-CD1 4.19Å; T1963-F2192 HydrophobicContact CG2-CE1 4.02Å; T1963-F2192 HydrophobicContact CG2-CZ 4.47Å
1964	Q	91.9	Very high	93.3	Very high	45 Å²	45	29.6 Å²	29.6	21%	0.21	15%	0.153	C	C	.	.	S	Bend	trans	-77.5	153	177.4	-71.3	179.9	-35.9	0	0	111.9	M1954 P1960 D1966 G1967 N1970	M1954-Q1964 PolarHBondContact O-NE2 3.14Å; P1960-Q1964 VanDerWaalsContact CB-CD 3.43Å; P1960-Q1964 HydrophobicContact CB-CG 3.89Å; P1960-Q1964 WeakPolarHBondContact O-CB 3.45Å; P1960-Q1964 PolarHBondContact O-N 2.96Å; P1960-Q1964 VanDerWaalsContact O-N 3.14Å; Q1964-D1966 PolarHBondContact O-N 3.28Å; Q1964-D1966 VanDerWaalsContact O-N 3.15Å; Q1964-G1967 PolarHBondContact O-N 3.04Å; Q1964-N1970 PolarHBondContact O-ND2 3Å
1965	R	88.2	Confident	92.9	Very high	107 Å²	107	29 Å²	29	40%	0.404	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.5	178.2	-76.4	-174	174.7	-178	-0.9	112.7	D1941 M1954 A1973 G1985	D1941-R1965 IonicContact OD1-NH2 3.15Å; D1941-R1965 PolarHBondContact OD1-NH2 3.1Å; D1941-R1965 IonicContact OD2-CZ 3.16Å; D1941-R1965 IonicContact OD2-NH1 2.69Å; D1941-R1965 PolarHBondContact OD2-NH1 3.17Å; D1941-R1965 VanDerWaalsContact OD2-NH1 3.14Å; D1941-R1965 IonicContact OD2-NH2 3.56Å; D1941-R1965 PolarHBondContact OD2-NH2 3.16Å; D1941-R1965 VanDerWaalsContact OD2-NH2 3.1Å; M1954-R1965 HydrophobicContact SD-CG 4.18Å; R1965-A1973 WeakPolarHBondContact O-CB 3.35Å; R1965-G1985 PolarHBondContact NH2-O 3.19Å
1966	D	89.6	Confident	92.1	Very high	92 Å²	92	23.7 Å²	23.7	49%	0.492	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	7.8	176.3	61.1	-33.9	0	0	0	113.9	P1455 Q1964	P1455-D1966 HydrophobicContact CB-CB 4.09Å; P1455-D1966 HydrophobicContact CG-CB 3.82Å; Q1964-D1966 PolarHBondContact O-N 3.28Å; Q1964-D1966 VanDerWaalsContact O-N 3.15Å
1967	G	92.7	Very high	91.1	Very high	4 Å²	4	26.4 Å²	26.4	4%	0.041	15%	0.145	C	C	.	.			trans	-56.3	135.3	-178	0	0	0	0	0	113	P1960 N1961 Q1964 L1969 N1970	P1960-G1967 WeakPolarHBondContact O-CA 3.33Å; N1961-G1967 CarbonylContact O-C 3.49Å; Q1964-G1967 PolarHBondContact O-N 3.04Å; G1967-L1969 PolarHBondContact O-N 3.43Å; G1967-L1969 VanDerWaalsContact O-N 3.07Å; G1967-N1970 WeakPolarHBondContact O-CB 3.31Å; G1967-N1970 PolarHBondContact O-N 3.32Å
1968	Q	94.4	Very high	90	Very high	42 Å²	42	26.8 Å²	26.8	20%	0.196	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.6	-167.8	-68.1	-173.4	57.6	0	0	114.8	S1458 A1461 N1961 R1974	S1458-Q1968 VanDerWaalsContact CB-OE1 3.32Å; S1458-Q1968 PolarHBondContact OG-OE1 3.25Å; A1461-Q1968 HydrophobicContact CB-CB 4.28Å; N1961-Q1968 PolarHBondContact O-N 2.83Å; N1961-Q1968 VanDerWaalsContact O-N 3.15Å; Q1968-R1974 PolarHBondContact O-NE 3.11Å; Q1968-R1974 PolarHBondContact O-NH2 3.05Å
1969	L	95.7	Very high	89.1	Confident	6 Å²	6	28.3 Å²	28.3	3%	0.031	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-0.5	-179.6	-60.4	175.5	0	0	0	112.7	A1461 Y1464 N1961 Y1962 G1967 L1971 P2195	A1461-L1969 HydrophobicContact CB-CD2 3.95Å; Y1464-L1969 HydrophobicContact CD1-CD1 4.19Å; Y1464-L1969 HydrophobicContact CD1-CD2 4.12Å; Y1464-L1969 HydrophobicContact CE1-CD1 4.43Å; N1961-L1969 WeakPolarHBondContact O-CA 3.26Å; N1961-L1969 PolarHBondContact O-N 3.45Å; Y1962-L1969 HydrophobicContact CD1-CB 4.23Å; Y1962-L1969 HydrophobicContact CD2-CD1 4.47Å; Y1962-L1969 HydrophobicContact CE1-CB 4.09Å; Y1962-L1969 HydrophobicContact CE1-CD1 4.2Å; Y1962-L1969 HydrophobicContact CE2-CD1 3.69Å; Y1962-L1969 WeakPolarHBondContact OH-CD1 3.33Å; G1967-L1969 PolarHBondContact O-N 3.43Å; G1967-L1969 VanDerWaalsContact O-N 3.07Å; L1969-L1971 PolarHBondContact O-N 2.76Å; L1969-P2195 WeakPolarHBondContact O-CD 3.34Å
1970	N	95.2	Very high	88.2	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.021	17%	0.168	C	C	.	.			trans	-75.9	107.8	168.3	-168.2	-9.5	0	0	0	109.4	N1961 Y1962 Q1964 G1967 A1972 A1973 V2193	N1961-N1970 PolarHBondContact O-N 2.94Å; Y1962-N1970 WeakPolarHBondContact O-CB 3.33Å; Q1964-N1970 PolarHBondContact O-ND2 3Å; G1967-N1970 WeakPolarHBondContact O-CB 3.31Å; G1967-N1970 PolarHBondContact O-N 3.32Å; N1970-A1972 PolarHBondContact O-N 3.18Å; N1970-A1972 VanDerWaalsContact O-N 3.09Å; N1970-A1972 WeakPolarHBondContact OD1-CB 3.44Å; N1970-A1972 PolarHBondContact OD1-N 2.94Å; N1970-A1973 VanDerWaalsContact O-CB 3.31Å; N1970-A1973 WeakPolarHBondContact O-CB 3.45Å; N1970-A1973 PolarHBondContact O-N 2.73Å; N1970-V2193 PolarHBondContact OD1-N 3.03Å
1971	L	94.2	Very high	87.5	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-11.9	-177.3	-62.8	177.4	0	0	0	113.3	L1465 L1969 R1974 V2193 P2195 L2198 M2227	L1465-L1971 HydrophobicContact CD1-CD2 3.81Å; L1465-L1971 HydrophobicContact CD2-CD2 4.42Å; L1465-L1971 HydrophobicContact CG-CD2 4.18Å; L1969-L1971 PolarHBondContact O-N 2.76Å; L1971-R1974 HydrophobicContact CD2-CG 4.33Å; L1971-R1974 PolarHBondContact O-N 3.12Å; L1971-V2193 HydrophobicContact CB-CB 4.37Å; L1971-V2193 HydrophobicContact CB-CG1 4.29Å; L1971-V2193 WeakPolarHBondContact CB-O 3.41Å; L1971-V2193 HydrophobicContact CD1-CG1 4.37Å; L1971-V2193 WeakPolarHBondContact CG-O 3.35Å; L1971-V2193 PolarHBondContact N-O 3.11Å; L1971-P2195 HydrophobicContact CD1-CB 4.25Å; L1971-L2198 HydrophobicContact CD1-CD1 3.68Å; L1971-L2198 HydrophobicContact CD1-CD2 3.78Å; L1971-L2198 HydrophobicContact CD1-CG 3.89Å; L1971-M2227 VanDerWaalsContact C-CE 3.48Å; L1971-M2227 HydrophobicContact CB-CB 4.36Å; L1971-M2227 HydrophobicContact CB-CE 4.04Å
1972	A	91.1	Very high	86.8	Confident	16 Å²	16	29.7 Å²	29.7	13%	0.132	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-37.1	170	0	0	0	0	0	112.5	N1970 R1974 L1975 L1984 M2227	N1970-A1972 PolarHBondContact O-N 3.18Å; N1970-A1972 VanDerWaalsContact O-N 3.09Å; N1970-A1972 WeakPolarHBondContact OD1-CB 3.44Å; N1970-A1972 PolarHBondContact OD1-N 2.94Å; A1972-R1974 PolarHBondContact O-N 2.97Å; A1972-R1974 VanDerWaalsContact O-N 3.17Å; A1972-L1975 PolarHBondContact O-N 3.3Å; A1972-L1984 HydrophobicContact CB-CD1 3.48Å; A1972-L1984 VanDerWaalsContact CB-CD1 3.48Å; A1972-M2227 HydrophobicContact CB-CE 4.04Å
1973	A	89.7	Confident	86	Confident	11 Å²	11	34.9 Å²	34.9	9%	0.091	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.6	175	0	0	0	0	0	112.5	S1454 P1455 R1965 N1970	S1454-A1973 VanDerWaalsContact CB-O 3.3Å; S1454-A1973 WeakPolarHBondContact CB-O 3.31Å; P1455-A1973 WeakPolarHBondContact CD-O 3.26Å; P1455-A1973 HydrophobicContact CG-CB 4.31Å; R1965-A1973 WeakPolarHBondContact O-CB 3.35Å; N1970-A1973 VanDerWaalsContact O-CB 3.31Å; N1970-A1973 WeakPolarHBondContact O-CB 3.45Å; N1970-A1973 PolarHBondContact O-N 2.73Å
1974	R	89.6	Confident	85.6	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.008	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-10.5	-176.1	-56.7	-67.7	162.3	-150.7	-4.4	114	S1454 P1455 F1456 Q1968 L1971 A1972 S1976 H2230	S1454-R1974 PolarHBondContact OG-NH1 3.02Å; P1455-R1974 PolarHBondContact O-NH1 2.83Å; F1456-R1974 PolarHBondContact O-NH2 2.82Å; Q1968-R1974 PolarHBondContact O-NE 3.11Å; Q1968-R1974 PolarHBondContact O-NH2 3.05Å; L1971-R1974 HydrophobicContact CD2-CG 4.33Å; L1971-R1974 PolarHBondContact O-N 3.12Å; A1972-R1974 PolarHBondContact O-N 2.97Å; A1972-R1974 VanDerWaalsContact O-N 3.17Å; R1974-S1976 PolarHBondContact O-N 3.38Å; R1974-H2230 WeakPolarHBondContact O-CB 3.35Å
1975	L	85.8	Confident	85	Confident	9 Å²	9	33.7 Å²	33.7	5%	0.047	19%	0.189	C	C	.	.	S	Bend	trans	-72.2	120.5	173.3	-72.1	177.2	0	0	0	110.7	A1972 C1981 N2226 M2227	A1972-L1975 PolarHBondContact O-N 3.3Å; L1975-C1981 HydrophobicContact CD1-CB 4.47Å; L1975-N2226 HydrophobicContact CD2-CB 3.84Å; L1975-M2227 HydrophobicContact CD1-CG 3.81Å; L1975-M2227 HydrophobicContact CD2-CB 4.44Å; L1975-M2227 HydrophobicContact CD2-CG 3.92Å; L1975-M2227 HydrophobicContact CG-CG 3.88Å
1976	S	77.3	Confident	85	Confident	5 Å²	5	28.7 Å²	28.7	4%	0.035	17%	0.17	C	C	.	.			trans	-60.1	139.7	171.6	175.2	0	0	0	0	110.9	R1974 F1978 F1979	R1974-S1976 PolarHBondContact O-N 3.38Å; S1976-F1978 PolarHBondContact O-N 3.3Å; S1976-F1979 PolarHBondContact O-N 2.86Å
1977	S	73.6	Confident	84.8	Confident	87 Å²	87	27.5 Å²	27.5	61%	0.608	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	2.7	176.4	62.1	0	0	0	0	115.5
1978	F	71.5	Confident	84.7	Confident	10 Å²	10	27.5 Å²	27.5	4%	0.044	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-34.1	161.8	-167.4	-87.1	0	0	0	112.2	L1262 L1446 P1529 K1531 G1532 S1976	L1262-F1978 HydrophobicContact CB-CD2 4.25Å; L1262-F1978 HydrophobicContact CD1-CB 4.21Å; L1262-F1978 HydrophobicContact CD2-CB 4.33Å; L1262-F1978 HydrophobicContact CD2-CD2 4.1Å; L1446-F1978 HydrophobicContact CD1-CB 3.98Å; L1446-F1978 HydrophobicContact CD1-CD1 4.39Å; L1446-F1978 HydrophobicContact CD1-CD2 4.24Å; L1446-F1978 HydrophobicContact CD1-CG 3.94Å; L1446-F1978 HydrophobicContact CD2-CD1 4.08Å; L1446-F1978 HydrophobicContact CD2-CE1 4.19Å; L1446-F1978 HydrophobicContact CD2-CG 4.4Å; P1529-F1978 HydrophobicContact CB-CE1 3.92Å; P1529-F1978 HydrophobicContact CG-CE1 4.02Å; P1529-F1978 HydrophobicContact CG-CZ 4.38Å; K1531-F1978 WeakPolarHBondContact CA-O 3.35Å; K1531-F1978 HydrophobicContact CB-CD2 4.01Å; K1531-F1978 HydrophobicContact CB-CE1 4.38Å; K1531-F1978 HydrophobicContact CB-CE2 3.75Å; K1531-F1978 HydrophobicContact CB-CG 4.46Å; K1531-F1978 HydrophobicContact CB-CZ 3.95Å; K1531-F1978 HydrophobicContact CD-CD2 4.26Å; K1531-F1978 HydrophobicContact CG-CD2 4.19Å; K1531-F1978 HydrophobicContact CG-CE2 4.4Å; G1532-F1978 PolarHBondContact N-O 2.8Å; S1976-F1978 PolarHBondContact O-N 3.3Å
1979	F	76.7	Confident	84.5	Confident	32 Å²	32	30.1 Å²	30.1	14%	0.14	17%	0.168	C	C	.	.	S	Bend	trans	-92.8	167.6	-179.8	-60.7	-88.8	0	0	0	111.2	L1446 W1447 S1976 H2230	L1446-F1979 HydrophobicContact CD2-CE2 4.36Å; L1446-F1979 HydrophobicContact CD2-CZ 4.2Å; L1446-F1979 HydrophobicContact CG-CE2 4.49Å; W1447-F1979 HydrophobicContact CH2-CE1 4.2Å; W1447-F1979 AromaticContact CH2-CZ 3.83Å; W1447-F1979 HydrophobicContact CH2-CZ 3.83Å; W1447-F1979 HydrophobicContact CZ2-CZ 4.35Å; W1447-F1979 HydrophobicContact CZ3-CZ 4.17Å; S1976-F1979 PolarHBondContact O-N 2.86Å; F1979-H2230 AromaticContact CD2-NE2 3.92Å; F1979-H2230 AromaticContact CE2-CE1 3.74Å; F1979-H2230 AromaticContact CE2-NE2 3.27Å; F1979-H2230 VanDerWaalsContact CE2-NE2 3.27Å; F1979-H2230 WeakPolarHBondContact CE2-NE2 3.27Å; F1979-H2230 AromaticContact CZ-NE2 3.69Å
1980	V	76.8	Confident	84.5	Confident	65 Å²	65	29.9 Å²	29.9	39%	0.394	17%	0.167	S	C	.	.			trans	-89.5	112.9	172.9	-177.1	0	0	0	0	107.8	G1532 Q2223	G1532-V1980 VanDerWaalsContact C-CG2 3.49Å; G1532-V1980 VanDerWaalsContact O-CG2 3.29Å; G1532-V1980 WeakPolarHBondContact O-CG2 3.41Å; V1980-Q2223 PolarHBondContact O-NE2 2.79Å
1981	C	78.5	Confident	84.5	Confident	64 Å²	64	30 Å²	30	43%	0.432	17%	0.168	S	C	.	.			trans	-67.4	148.2	171.7	-57.4	0	0	0	0	110.7	L1975	L1975-C1981 HydrophobicContact CD1-CB 4.47Å
1982	P	80	Confident	84.6	Confident	22 Å²	22	29.9 Å²	29.9	14%	0.143	17%	0.168	C	C	.	.			trans	-67.7	147.8	172.9	28.9	-33.7	0	0	0	111.5	L1984 L2222	P1982-L1984 HydrophobicContact CB-CD2 4.23Å; P1982-L1984 HydrophobicContact CB-CG 4.33Å; P1982-L1984 HydrophobicContact CG-CD1 4.29Å; P1982-L1984 HydrophobicContact CG-CD2 4.24Å; P1982-L1984 HydrophobicContact CG-CG 4.07Å; P1982-L1984 PolarHBondContact O-N 3.25Å; P1982-L2222 HydrophobicContact CB-CD2 4.14Å; P1982-L2222 HydrophobicContact CG-CD2 4.46Å
1983	D	79.3	Confident	84.6	Confident	108 Å²	108	29.3 Å²	29.3	58%	0.578	16%	0.164	S	C	*	.			trans	-74.7	113.1	163	172	20.7	0	0	0	108.3	G1985 K1987	D1983-G1985 PolarHBondContact OD1-N 3.08Å; D1983-K1987 IonicContact OD1-NZ 2.65Å; D1983-K1987 PolarHBondContact OD1-NZ 3.41Å; D1983-K1987 IonicContact OD2-NZ 3.12Å; D1983-K1987 PolarHBondContact OD2-NZ 3.16Å
1984	L	85.1	Confident	84.3	Confident	18 Å²	18	29.1 Å²	29.1	9%	0.094	16%	0.161	C	C	.	.			trans	-111.2	21.8	177.7	-65	-174.8	0	0	0	111.7	A1972 P1982 A2010 D2191 L2222	A1972-L1984 HydrophobicContact CB-CD1 3.48Å; A1972-L1984 VanDerWaalsContact CB-CD1 3.48Å; P1982-L1984 HydrophobicContact CB-CD2 4.23Å; P1982-L1984 HydrophobicContact CB-CG 4.33Å; P1982-L1984 HydrophobicContact CG-CD1 4.29Å; P1982-L1984 HydrophobicContact CG-CD2 4.24Å; P1982-L1984 HydrophobicContact CG-CG 4.07Å; P1982-L1984 PolarHBondContact O-N 3.25Å; L1984-A2010 HydrophobicContact CD2-CB 4.49Å; L1984-D2191 HydrophobicContact CB-CB 3.92Å; L1984-D2191 WeakPolarHBondContact CB-O 3.24Å; L1984-D2191 HydrophobicContact CD2-CB 3.95Å; L1984-D2191 HydrophobicContact CG-CB 4.44Å; L1984-D2191 PolarHBondContact O-N 2.87Å; L1984-L2222 HydrophobicContact CD2-CD2 3.63Å
1985	G	79.6	Confident	83.3	Confident	3 Å²	3	30.4 Å²	30.4	3%	0.031	17%	0.169	C	C	.	.			trans	78.4	-159.8	-176.6	0	0	0	0	0	113.8	R1965 D1983	R1965-G1985 PolarHBondContact NH2-O 3.19Å; D1983-G1985 PolarHBondContact OD1-N 3.08Å
1986	P	87.8	Confident	82.2	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	19%	0.187	C	C	.	.			cis	-67.2	159.1	14.5	25	-34.3	0	0	0	115.2	F1942 F1950 L1953 M1954 A2189 V2190	F1942-P1986 HydrophobicContact CB-CG 3.86Å; F1942-P1986 HydrophobicContact CD1-CG 3.63Å; F1942-P1986 HydrophobicContact CE1-CG 4.33Å; F1942-P1986 HydrophobicContact CG-CG 3.81Å; F1950-P1986 HydrophobicContact CD2-CG 3.88Å; F1950-P1986 HydrophobicContact CE2-CG 4.16Å; L1953-P1986 HydrophobicContact CD2-CB 3.55Å; L1953-P1986 HydrophobicContact CD2-CG 3.88Å; M1954-P1986 HydrophobicContact CE-CB 4.43Å; M1954-P1986 HydrophobicContact CE-CG 4.04Å; P1986-A2189 CarbonylContact C-O 3.41Å; P1986-A2189 WeakPolarHBondContact CA-O 3.22Å; P1986-A2189 WeakPolarHBondContact CB-O 3.1Å; P1986-V2190 HydrophobicContact CB-CG2 3.87Å
1987	K	85.5	Confident	81.7	Confident	68 Å²	68	34.1 Å²	34.1	30%	0.296	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.2	168.9	-53.9	-61.3	175.4	-157.1	0	109.9	D1983 Y1989 A2188 A2189	D1983-K1987 IonicContact OD1-NZ 2.65Å; D1983-K1987 PolarHBondContact OD1-NZ 3.41Å; D1983-K1987 IonicContact OD2-NZ 3.12Å; D1983-K1987 PolarHBondContact OD2-NZ 3.16Å; K1987-Y1989 HydrophobicContact CB-CE2 3.83Å; K1987-A2188 WeakPolarHBondContact O-CA 3.23Å; K1987-A2189 PolarHBondContact N-O 3.02Å; K1987-A2189 PolarHBondContact O-N 3.23Å
1988	L	90.6	Very high	81.1	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.9	-179	-156.3	77.3	0	0	0	111.7	W1877 F1882 W1936 F1942 V1990 I2186 K2187 A2188	W1877-L1988 HydrophobicContact CZ3-CD1 4.11Å; F1882-L1988 HydrophobicContact CE1-CD2 3.74Å; F1882-L1988 HydrophobicContact CZ-CD2 3.78Å; W1936-L1988 HydrophobicContact CE3-CB 4.38Å; W1936-L1988 HydrophobicContact CE3-CD2 3.76Å; W1936-L1988 HydrophobicContact CZ3-CD2 3.67Å; W1936-L1988 WeakPolarHBondContact O-CB 3.39Å; W1936-L1988 PolarHBondContact O-N 3.19Å; W1936-L1988 VanDerWaalsContact O-N 3.12Å; F1942-L1988 HydrophobicContact CE2-CB 4.12Å; F1942-L1988 HydrophobicContact CE2-CD1 4.24Å; F1942-L1988 HydrophobicContact CZ-CD1 4.43Å; L1988-V1990 HydrophobicContact CD2-CG2 3.55Å; L1988-V1990 HydrophobicContact CG-CG2 3.8Å; L1988-I2186 HydrophobicContact CD1-CG2 4.14Å; L1988-I2186 HydrophobicContact CD2-CG2 4.25Å; L1988-I2186 HydrophobicContact CG-CG2 4.34Å; L1988-K2187 WeakPolarHBondContact CD1-O 3.24Å; L1988-A2188 HydrophobicContact CD1-CB 4.04Å
1989	Y	91.7	Very high	81	Confident	96 Å²	96	37 Å²	37	38%	0.376	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	98	-178.4	-63.8	-89.4	0	0	0	109.8	K1987 K2187 A2189	K1987-Y1989 HydrophobicContact CB-CE2 3.83Å; Y1989-K2187 PolarHBondContact N-O 3.46Å; Y1989-K2187 PolarHBondContact O-N 3.37Å; Y1989-A2189 HydrophobicContact CD2-CB 4.15Å; Y1989-A2189 HydrophobicContact CE2-CB 3.65Å
1990	V	95.3	Very high	81	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.3	-175	-176.6	0	0	0	0	110.2	F1910 W1911 F1914 K1932 L1933 L1988 C2185 I2186	F1910-V1990 HydrophobicContact CE1-CG1 3.52Å; F1910-V1990 HydrophobicContact CZ-CG1 3.76Å; W1911-V1990 HydrophobicContact CH2-CB 4.4Å; W1911-V1990 HydrophobicContact CH2-CG1 3.43Å; W1911-V1990 VanDerWaalsContact CH2-CG1 3.43Å; W1911-V1990 HydrophobicContact CH2-CG2 4.12Å; W1911-V1990 HydrophobicContact CZ2-CG1 4.28Å; W1911-V1990 HydrophobicContact CZ3-CG1 3.67Å; F1914-V1990 HydrophobicContact CE2-CG1 3.74Å; F1914-V1990 HydrophobicContact CZ-CG1 4.41Å; K1932-V1990 WeakPolarHBondContact CA-O 3.44Å; L1933-V1990 HydrophobicContact CB-CB 4.38Å; L1933-V1990 HydrophobicContact CD1-CB 4.17Å; L1933-V1990 HydrophobicContact CD1-CG1 4.05Å; L1933-V1990 HydrophobicContact CD2-CB 4.26Å; L1933-V1990 HydrophobicContact CD2-CG2 4.48Å; L1933-V1990 PolarHBondContact N-O 2.92Å; L1988-V1990 HydrophobicContact CD2-CG2 3.55Å; L1988-V1990 HydrophobicContact CG-CG2 3.8Å; V1990-C2185 WeakPolarHBondContact CA-O 3.14Å; V1990-I2186 HydrophobicContact CG1-CG1 4.35Å; V1990-I2186 HydrophobicContact CG2-CG2 4.21Å
1991	A	95.2	Very high	81.3	Confident	5 Å²	5	34.3 Å²	34.3	4%	0.041	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	153.6	179.6	0	0	0	0	0	113.5	L1931 K1932 T2002 N2181 S2184 C2185	L1931-A1991 WeakPolarHBondContact O-CA 3.47Å; K1932-A1991 HydrophobicContact CB-CB 3.49Å; K1932-A1991 VanDerWaalsContact CB-CB 3.49Å; A1991-T2002 HydrophobicContact CB-CG2 3.72Å; A1991-N2181 WeakPolarHBondContact CB-ND2 3.41Å; A1991-N2181 PolarHBondContact O-ND2 3.18Å; A1991-S2184 WeakPolarHBondContact O-CA 3.45Å; A1991-C2185 PolarHBondContact N-O 3.24Å; A1991-C2185 VanDerWaalsContact N-O 3.14Å; A1991-C2185 PolarHBondContact O-N 2.74Å
1992	Y	95.3	Very high	81.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.189	C	C	.	.			trans	-67.6	160.4	173.7	-63.2	-11.5	0	0	0	112.8	F1910 F1914 R1920 L1929 L1931 N2181 S2184	F1910-Y1992 WeakPolarHBondContact CA-OH 3.49Å; F1910-Y1992 HydrophobicContact CD1-CE1 4.4Å; F1910-Y1992 HydrophobicContact CD2-CD1 4.42Å; F1910-Y1992 AromaticContact CD2-CE1 3.57Å; F1910-Y1992 HydrophobicContact CD2-CE1 3.57Å; F1910-Y1992 AromaticContact CD2-CZ 3.74Å; F1910-Y1992 HydrophobicContact CE1-CE1 4.14Å; F1910-Y1992 AromaticContact CE2-CD1 3.69Å; F1910-Y1992 HydrophobicContact CE2-CD1 3.69Å; F1910-Y1992 AromaticContact CE2-CE1 3.28Å; F1910-Y1992 HydrophobicContact CE2-CE1 3.28Å; F1910-Y1992 AromaticContact CE2-CZ 3.82Å; F1910-Y1992 HydrophobicContact CG-CE1 4.14Å; F1910-Y1992 AromaticContact CZ-CD1 3.79Å; F1910-Y1992 HydrophobicContact CZ-CD1 3.79Å; F1910-Y1992 AromaticContact CZ-CE1 3.58Å; F1910-Y1992 HydrophobicContact CZ-CE1 3.58Å; F1910-Y1992 WeakPolarHBondContact O-CE1 3.48Å; F1910-Y1992 PolarHBondContact O-OH 3.35Å; F1914-Y1992 HydrophobicContact CB-CE1 4.35Å; F1914-Y1992 AromaticContact CD2-CD1 3.85Å; F1914-Y1992 HydrophobicContact CD2-CD1 3.85Å; F1914-Y1992 HydrophobicContact CD2-CE1 4.01Å; F1914-Y1992 HydrophobicContact CE2-CD1 4.48Å; R1920-Y1992 HydrophobicContact CB-CE2 4.22Å; R1920-Y1992 HydrophobicContact CG-CD2 4.21Å; R1920-Y1992 HydrophobicContact CG-CE2 3.66Å; L1929-Y1992 WeakPolarHBondContact O-CD2 3.49Å; L1931-Y1992 HydrophobicContact CB-CD2 4.05Å; L1931-Y1992 HydrophobicContact CB-CE2 3.83Å; L1931-Y1992 HydrophobicContact CD1-CE2 4.09Å; L1931-Y1992 HydrophobicContact CG-CD2 4.48Å; L1931-Y1992 HydrophobicContact CG-CE2 4.01Å; L1931-Y1992 PolarHBondContact O-N 3.1Å; Y1992-N2181 WeakPolarHBondContact O-CB 3.41Å; Y1992-N2181 PolarHBondContact O-ND2 3.14Å; Y1992-S2184 WeakPolarHBondContact CA-OG 3.37Å
1993	G	92.1	Very high	82.1	Confident	4 Å²	4	31.8 Å²	31.8	4%	0.041	19%	0.191	C	C	.	.			trans	-71.7	144.5	168.5	0	0	0	0	0	113.4	L2182 N2183 S2184	G1993-L2182 VanDerWaalsContact CA-O 3.26Å; G1993-L2182 WeakPolarHBondContact CA-O 3.5Å; G1993-N2183 VanDerWaalsContact CA-O 3.27Å; G1993-N2183 WeakPolarHBondContact CA-O 3.49Å; G1993-S2184 PolarHBondContact N-OG 2.88Å
1994	T	83.9	Confident	82.7	Confident	6 Å²	6	29 Å²	29	4%	0.037	18%	0.176	C	C	.	.			trans	-92.8	-4.3	-174.8	64.2	0	0	0	0	115	G1996 S1997 I2000 T2002 R2180 N2181 L2182	T1994-G1996 PolarHBondContact O-N 2.9Å; T1994-S1997 WeakPolarHBondContact O-CB 3.45Å; T1994-S1997 PolarHBondContact O-N 3.09Å; T1994-S1997 PolarHBondContact O-OG 2.87Å; T1994-I2000 HydrophobicContact CG2-CB 4.28Å; T1994-I2000 HydrophobicContact CG2-CG2 3.96Å; T1994-T2002 HydrophobicContact CG2-CG2 4.45Å; T1994-R2180 HydrophobicContact CG2-CG 4.2Å; T1994-R2180 WeakPolarHBondContact OG1-CG 3.48Å; T1994-R2180 PolarHBondContact OG1-NE 3.05Å; T1994-N2181 WeakPolarHBondContact CB-O 3.33Å; T1994-N2181 WeakPolarHBondContact CG2-O 3.3Å; T1994-N2181 PolarHBondContact N-O 3.35Å; T1994-N2181 PolarHBondContact OG1-O 3.15Å; T1994-L2182 PolarHBondContact N-O 3.11Å
1995	V	67.6	Low	83.1	Confident	29 Å²	29	28.1 Å²	28.1	18%	0.176	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	24	90.8	171.1	-161.5	0	0	0	0	115	S1997 N2032	V1995-S1997 PolarHBondContact O-N 3.39Å; V1995-N2032 HydrophobicContact CG1-CB 4.37Å; V1995-N2032 WeakPolarHBondContact CG1-OD1 3.41Å; V1995-N2032 WeakPolarHBondContact CG2-OD1 3.29Å
1996	G	62	Low	83.8	Confident	40 Å²	40	28.9 Å²	28.9	41%	0.412	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	-14.9	176.4	0	0	0	0	0	116.7	T1994 C1998 S2035	T1994-G1996 PolarHBondContact O-N 2.9Å; G1996-C1998 PolarHBondContact O-N 3.25Å; G1996-S2035 VanDerWaalsContact CA-OG 3.27Å; G1996-S2035 WeakPolarHBondContact CA-OG 3.46Å; G1996-S2035 PolarHBondContact N-OG 3.36Å
1997	S	68.4	Low	84.1	Confident	52 Å²	52	29.3 Å²	29.3	36%	0.364	18%	0.177	S	C	.	.			trans	-77.7	89.6	-178.2	-55.7	0	0	0	0	111.5	T1994 V1995 S1999 I2000 R2180	T1994-S1997 WeakPolarHBondContact O-CB 3.45Å; T1994-S1997 PolarHBondContact O-N 3.09Å; T1994-S1997 PolarHBondContact O-OG 2.87Å; V1995-S1997 PolarHBondContact O-N 3.39Å; S1997-S1999 VanDerWaalsContact C-N 3.27Å; S1997-S1999 PolarHBondContact O-N 3.15Å; S1997-S1999 VanDerWaalsContact O-N 3.15Å; S1997-I2000 PolarHBondContact O-N 3.4Å; S1997-R2180 PolarHBondContact O-NE 3.27Å; S1997-R2180 PolarHBondContact O-NH2 3.32Å
1998	C	59.9	Low	84.3	Confident	67 Å²	67	28.2 Å²	28.2	45%	0.453	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-37.4	-170	-163.9	0	0	0	0	114.7	G1996	G1996-C1998 PolarHBondContact O-N 3.25Å
1999	S	68.9	Low	84.3	Confident	91 Å²	91	29.3 Å²	29.3	64%	0.636	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	16.3	-172.7	72.4	0	0	0	0	115.2	S1997	S1997-S1999 VanDerWaalsContact C-N 3.27Å; S1997-S1999 PolarHBondContact O-N 3.15Å; S1997-S1999 VanDerWaalsContact O-N 3.15Å
2000	I	78.7	Confident	84.4	Confident	27 Å²	27	24.8 Å²	24.8	14%	0.138	16%	0.162	C	C	.	.			trans	-108.2	116.1	178.1	-58.4	-179.6	0	0	0	109.2	C1896 A1897 T1994 S1997 R2180	C1896-I2000 HydrophobicContact CB-CG2 3.77Å; A1897-I2000 HydrophobicContact CB-CD1 3.98Å; A1897-I2000 HydrophobicContact CB-CG1 4.45Å; T1994-I2000 HydrophobicContact CG2-CB 4.28Å; T1994-I2000 HydrophobicContact CG2-CG2 3.96Å; S1997-I2000 PolarHBondContact O-N 3.4Å; I2000-R2180 WeakPolarHBondContact O-CD 3.46Å; I2000-R2180 WeakPolarHBondContact O-CG 3.34Å
2001	S	82.7	Confident	84.5	Confident	14 Å²	14	24.7 Å²	24.7	10%	0.098	16%	0.162	C	C	.	.			trans	-83.9	162	170.5	66.9	0	0	0	0	111.2	C1896 N2004 Y2141	C1896-S2001 WeakPolarHBondContact CB-O 3.43Å; S2001-N2004 PolarHBondContact OG-OD1 3.01Å; S2001-Y2141 VanDerWaalsContact CB-CD2 3.45Å
2002	T	85.4	Confident	84.5	Confident	4 Å²	4	24.7 Å²	24.7	3%	0.025	16%	0.162	C	C	.	.	S	Bend	trans	-103.7	-35.7	158.7	34.2	0	0	0	0	111.2	K1932 A1991 T1994 V2179 R2180 N2181	K1932-T2002 WeakPolarHBondContact CD-O 2.99Å; K1932-T2002 PolarHBondContact NZ-O 3.38Å; A1991-T2002 HydrophobicContact CB-CG2 3.72Å; T1994-T2002 HydrophobicContact CG2-CG2 4.45Å; T2002-V2179 PolarHBondContact N-O 3.05Å; T2002-V2179 PolarHBondContact OG1-O 3.43Å; T2002-R2180 WeakPolarHBondContact OG1-CA 3.37Å; T2002-N2181 HydrophobicContact CG2-CB 3.74Å; T2002-N2181 PolarHBondContact OG1-N 3.46Å
2003	T	88.7	Confident	84.6	Confident	29 Å²	29	24.7 Å²	24.7	18%	0.178	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	128.9	170.1	-46.7	0	0	0	0	108.1	H2006 V2179	T2003-H2006 WeakPolarHBondContact CG2-CE1 3.32Å; T2003-V2179 PolarHBondContact N-O 3.04Å; T2003-V2179 PolarHBondContact O-N 3.41Å
2004	N	91.8	Very high	84.9	Confident	49 Å²	49	25 Å²	25	26%	0.262	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	172.1	176.9	-81.5	5.9	0	0	0	111.4	S2001 H2006 Q2138 F2140	S2001-N2004 PolarHBondContact OG-OD1 3.01Å; N2004-H2006 PolarHBondContact O-N 3.41Å; N2004-H2006 PolarHBondContact O-ND1 3.04Å; N2004-Q2138 HydrophobicContact CB-CB 4.48Å; N2004-Q2138 WeakPolarHBondContact CB-O 3.28Å; N2004-Q2138 PolarHBondContact ND2-O 3.19Å; N2004-F2140 WeakPolarHBondContact CB-O 3.49Å
2005	L	94.7	Very high	85.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	123.2	168.4	-174.1	77.9	0	0	0	109.7	F2104 L2112 L2116 I2135 Q2138 F2140 M2142 A2176 H2177 Q2178	L2005-F2104 HydrophobicContact CD1-CD2 3.96Å; L2005-F2104 HydrophobicContact CD1-CE2 3.96Å; L2005-L2112 HydrophobicContact CD1-CD2 4.41Å; L2005-L2112 HydrophobicContact CD2-CD1 4.37Å; L2005-L2112 HydrophobicContact CD2-CD2 4Å; L2005-L2112 HydrophobicContact CD2-CG 4.25Å; L2005-L2116 HydrophobicContact CD2-CD1 3.46Å; L2005-L2116 VanDerWaalsContact CD2-CD1 3.46Å; L2005-I2135 HydrophobicContact CD2-CG1 4.16Å; L2005-Q2138 WeakPolarHBondContact O-CA 3.48Å; L2005-F2140 WeakPolarHBondContact CB-O 3.38Å; L2005-F2140 PolarHBondContact N-O 2.9Å; L2005-M2142 HydrophobicContact CD1-CE 3.94Å; L2005-M2142 HydrophobicContact CD2-CE 3.88Å; L2005-M2142 HydrophobicContact CG-CE 4.42Å; L2005-A2176 HydrophobicContact CD1-CB 4.28Å; L2005-H2177 WeakPolarHBondContact CA-O 3.29Å; L2005-Q2178 HydrophobicContact CB-CB 4.32Å; L2005-Q2178 HydrophobicContact CD1-CB 4.41Å
2006	H	93.6	Very high	86.9	Confident	19 Å²	19	23.4 Å²	23.4	9%	0.088	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	177.6	177.3	66.2	-55.3	0	0	0	109.8	T2003 N2004 D2008 Q2138 A2176 H2177	T2003-H2006 WeakPolarHBondContact CG2-CE1 3.32Å; N2004-H2006 PolarHBondContact O-N 3.41Å; N2004-H2006 PolarHBondContact O-ND1 3.04Å; H2006-D2008 IonicContact CD2-OD1 3.8Å; H2006-Q2138 HydrophobicContact CB-CB 4.43Å; H2006-Q2138 HydrophobicContact CB-CG 3.66Å; H2006-A2176 CarbonylContact O-C 3.54Å; H2006-A2176 WeakPolarHBondContact O-CA 3.47Å; H2006-H2177 AromaticContact CE1-CD2 3.75Å; H2006-H2177 AromaticContact CE1-CE1 3.47Å; H2006-H2177 PolarHBondContact CE1-CE1 3.07Å; H2006-H2177 VanDerWaalsContact CE1-CE1 3.47Å; H2006-H2177 AromaticContact CE1-NE2 3.11Å; H2006-H2177 PolarHBondContact CE1-NE2 3.11Å; H2006-H2177 PolarHBondContact N-O 3.26Å; H2006-H2177 VanDerWaalsContact N-O 3.07Å; H2006-H2177 AromaticContact ND1-NE2 3.97Å; H2006-H2177 PolarHBondContact ND1-O 3.48Å; H2006-H2177 VanDerWaalsContact ND1-O 3.15Å; H2006-H2177 AromaticContact NE2-CE1 3.68Å; H2006-H2177 AromaticContact NE2-NE2 3.6Å; H2006-H2177 PolarHBondContact O-N 3.18Å
2007	V	93.4	Very high	88.6	Confident	10 Å²	10	21.7 Å²	21.7	6%	0.061	13%	0.134	C	C	.	.			trans	-138.5	137.3	176.9	64.4	0	0	0	0	110.2	I2135 H2136 G2174 A2176 L2204	V2007-I2135 HydrophobicContact CB-CG2 4.1Å; V2007-I2135 HydrophobicContact CG1-CG2 3.94Å; V2007-H2136 VanDerWaalsContact CG1-CE1 3.47Å; V2007-H2136 WeakPolarHBondContact CG1-CE1 3.48Å; V2007-H2136 WeakPolarHBondContact CG1-ND1 3.44Å; V2007-G2174 WeakPolarHBondContact CG2-O 3.18Å; V2007-A2176 HydrophobicContact CB-CB 4.41Å; V2007-L2204 HydrophobicContact CG1-CD2 4.27Å; V2007-L2204 HydrophobicContact CG2-CD2 4.17Å
2008	D	90.5	Very high	89.9	Confident	45 Å²	45	21.6 Å²	21.6	24%	0.241	13%	0.126	C	C	.	.			trans	-95.1	145	179.4	-67.4	-39.9	0	0	0	112	H2006 A2010 G2174 H2177 L2204	H2006-D2008 IonicContact CD2-OD1 3.8Å; D2008-A2010 VanDerWaalsContact C-N 3.34Å; D2008-G2174 PolarHBondContact O-N 3.06Å; D2008-G2174 VanDerWaalsContact O-N 3.13Å; D2008-H2177 IonicContact OD2-CE1 2.83Å; D2008-H2177 PolarHBondContact OD2-CE1 2.79Å; D2008-L2204 WeakPolarHBondContact O-CD1 3.41Å
2009	I	89.6	Confident	91.7	Very high	26 Å²	26	18.9 Å²	18.9	13%	0.133	11%	0.107	C	C	.	.	S	Bend	trans	-79.4	-19.2	-179.1	-166.4	173.2	0	0	0	113	C2201 L2204 F2208 L2222	I2009-C2201 PolarHBondContact O-SG 2.84Å; I2009-C2201 VanDerWaalsContact O-SG 3.4Å; I2009-L2204 HydrophobicContact CG1-CB 4.26Å; I2009-F2208 HydrophobicContact CB-CE2 3.83Å; I2009-F2208 HydrophobicContact CD1-CD2 3.81Å; I2009-F2208 HydrophobicContact CD1-CE2 4Å; I2009-F2208 HydrophobicContact CG1-CD2 4.23Å; I2009-F2208 HydrophobicContact CG1-CE2 3.98Å; I2009-L2222 HydrophobicContact CB-CD1 4.34Å; I2009-L2222 HydrophobicContact CD1-CD1 4.37Å; I2009-L2222 HydrophobicContact CD1-CG 4.32Å; I2009-L2222 HydrophobicContact CG1-CD1 3.9Å; I2009-L2222 HydrophobicContact CG1-CG 4.34Å; I2009-L2222 HydrophobicContact CG2-CD1 3.93Å; I2009-L2222 HydrophobicContact CG2-CD2 4.39Å; I2009-L2222 HydrophobicContact CG2-CG 4.02Å; I2009-L2222 WeakPolarHBondContact O-CD1 3.34Å
2010	A	94.3	Very high	92.9	Very high	2 Å²	2	14.6 Å²	14.6	2%	0.017	8%	0.077	C	C	.	.	S	Bend	trans	-118.4	171.2	179.3	0	0	0	0	0	109.1	L1984 D2008 A2173 D2191 F2192 V2193 L2222	L1984-A2010 HydrophobicContact CD2-CB 4.49Å; D2008-A2010 VanDerWaalsContact C-N 3.34Å; A2010-A2173 WeakPolarHBondContact O-CA 3.25Å; A2010-D2191 HydrophobicContact CB-CB 4.17Å; A2010-F2192 WeakPolarHBondContact CB-O 3.31Å; A2010-V2193 HydrophobicContact CB-CG2 4.24Å; A2010-L2222 HydrophobicContact CB-CD1 4.04Å; A2010-L2222 HydrophobicContact CB-CD2 4.42Å
2011	D	97.4	Very high	93.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	151.1	166.2	-60.9	-56.5	0	0	0	109.8	W1857 A2173 D2191 F2192 S2194 H2197	W1857-D2011 HydrophobicContact CH2-CB 4.42Å; W1857-D2011 HydrophobicContact CZ2-CB 3.8Å; W1857-D2011 WeakPolarHBondContact CZ2-OD1 3.42Å; D2011-A2173 PolarHBondContact OD1-N 3.25Å; D2011-D2191 CarbonylContact O-C 3.5Å; D2011-D2191 WeakPolarHBondContact O-CA 3.48Å; D2011-F2192 HydrophobicContact CB-CD1 4.03Å; D2011-F2192 HydrophobicContact CB-CD2 3.68Å; D2011-F2192 HydrophobicContact CB-CE1 3.85Å; D2011-F2192 HydrophobicContact CB-CE2 3.49Å; D2011-F2192 VanDerWaalsContact CB-CE2 3.49Å; D2011-F2192 HydrophobicContact CB-CG 3.95Å; D2011-F2192 HydrophobicContact CB-CZ 3.57Å; D2011-F2192 WeakPolarHBondContact CB-O 3.31Å; D2011-F2192 PolarHBondContact N-O 2.91Å; D2011-F2192 PolarHBondContact O-N 2.89Å; D2011-S2194 WeakPolarHBondContact OD2-CB 3.43Å; D2011-S2194 PolarHBondContact OD2-N 2.96Å; D2011-S2194 PolarHBondContact OD2-OG 3.44Å; D2011-H2197 IonicContact OD1-CE1 2.65Å; D2011-H2197 IonicContact OD1-CG 2.71Å; D2011-H2197 IonicContact OD1-ND1 3.19Å; D2011-H2197 PolarHBondContact OD1-ND1 2.94Å; D2011-H2197 IonicContact OD2-ND1 3.07Å
2012	A	96.6	Very high	93.9	Very high	4 Å²	4	14.5 Å²	14.5	3%	0.033	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.2	176.6	0	0	0	0	0	112.8	F2170 I2171	A2012-F2170 WeakPolarHBondContact O-CA 3.39Å; A2012-I2171 HydrophobicContact CB-CB 4.37Å; A2012-I2171 HydrophobicContact CB-CD1 4.42Å; A2012-I2171 PolarHBondContact N-O 3Å; A2012-I2171 PolarHBondContact O-N 3.21Å
2013	V	97.5	Very high	94.2	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.006	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.8	164.4	60.4	0	0	0	0	109.5	L1957 P1958 T1963 V2015 A2168 V2169 F2170 A2189 V2190 F2192	L1957-V2013 HydrophobicContact CD2-CG1 4.38Å; P1958-V2013 HydrophobicContact CG-CG2 4.44Å; T1963-V2013 HydrophobicContact CG2-CB 4.18Å; T1963-V2013 HydrophobicContact CG2-CG1 3.71Å; V2013-V2015 HydrophobicContact CG2-CG2 4.37Å; V2013-A2168 HydrophobicContact CG2-CB 4.16Å; V2013-V2169 CarbonylContact C-O 2.96Å; V2013-V2169 WeakPolarHBondContact CA-O 3.37Å; V2013-F2170 HydrophobicContact CB-CD1 4.1Å; V2013-F2170 HydrophobicContact CB-CE1 3.95Å; V2013-F2170 HydrophobicContact CB-CE2 4.44Å; V2013-F2170 HydrophobicContact CB-CG 4.44Å; V2013-F2170 HydrophobicContact CB-CZ 4.13Å; V2013-F2170 HydrophobicContact CG2-CD1 4.25Å; V2013-F2170 HydrophobicContact CG2-CD2 3.94Å; V2013-F2170 HydrophobicContact CG2-CE1 3.97Å; V2013-F2170 HydrophobicContact CG2-CE2 3.59Å; V2013-F2170 HydrophobicContact CG2-CG 4.26Å; V2013-F2170 HydrophobicContact CG2-CZ 3.62Å; V2013-A2189 VanDerWaalsContact O-CA 3.24Å; V2013-A2189 WeakPolarHBondContact O-CA 3.15Å; V2013-V2190 HydrophobicContact CG1-CB 4Å; V2013-V2190 PolarHBondContact N-O 2.53Å; V2013-V2190 PolarHBondContact O-N 2.74Å; V2013-F2192 HydrophobicContact CB-CE1 4.25Å; V2013-F2192 HydrophobicContact CG1-CE1 4.42Å
2014	N	97.4	Very high	94.2	Very high	10 Å²	10	16.9 Å²	16.9	5%	0.053	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.3	-178.7	-170	-75.3	0	0	0	110.8	W2101 Q2163 A2168 V2169 K2187 A2188	N2014-W2101 HydrophobicContact CB-CH2 3.87Å; N2014-W2101 HydrophobicContact CB-CZ2 4.07Å; N2014-Q2163 PolarHBondContact O-NE2 3.23Å; N2014-Q2163 PolarHBondContact OD1-NE2 3.44Å; N2014-A2168 CarbonylContact O-C 3.45Å; N2014-A2168 WeakPolarHBondContact O-CA 3.28Å; N2014-V2169 PolarHBondContact N-O 2.82Å; N2014-V2169 PolarHBondContact O-N 2.99Å; N2014-K2187 WeakPolarHBondContact OD1-CD 3.17Å; N2014-A2188 CarbonylContact C-O 3.59Å; N2014-A2188 WeakPolarHBondContact CA-O 3.44Å
2015	V	97.2	Very high	94.1	Very high	2 Å²	2	17 Å²	17	1%	0.012	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.7	-177.8	-168.8	0	0	0	0	110.3	F1872 L1957 V2013 L2017 A2168 K2187 A2188	F1872-V2015 HydrophobicContact CE2-CG1 4.24Å; F1872-V2015 HydrophobicContact CZ-CG1 4.1Å; L1957-V2015 HydrophobicContact CD2-CG2 4.36Å; V2013-V2015 HydrophobicContact CG2-CG2 4.37Å; V2015-L2017 HydrophobicContact CB-CD2 4.16Å; V2015-L2017 HydrophobicContact CB-CG 4.42Å; V2015-L2017 HydrophobicContact CG1-CD2 3.63Å; V2015-L2017 HydrophobicContact CG1-CG 4.28Å; V2015-L2017 PolarHBondContact O-N 3.12Å; V2015-A2168 HydrophobicContact CG2-CB 4.04Å; V2015-K2187 VanDerWaalsContact O-CA 3.23Å; V2015-K2187 WeakPolarHBondContact O-CA 3.3Å; V2015-K2187 WeakPolarHBondContact O-CB 3.48Å; V2015-A2188 PolarHBondContact N-O 2.85Å; V2015-A2188 PolarHBondContact O-N 3.15Å
2016	M	97.4	Very high	93.8	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	96	172.5	-177	71	72.3	0	0	110.6	V2019 A2099 Q2163 F2164 G2166 D2167 C2185 K2187	M2016-V2019 HydrophobicContact CE-CG2 4.45Å; M2016-V2019 HydrophobicContact CG-CG2 3.54Å; M2016-V2019 HydrophobicContact SD-CG2 3.62Å; M2016-A2099 HydrophobicContact CE-CB 3.94Å; M2016-Q2163 HydrophobicContact CB-CG 3.97Å; M2016-Q2163 HydrophobicContact CE-CB 4.28Å; M2016-Q2163 HydrophobicContact CE-CG 3.94Å; M2016-F2164 VanDerWaalsContact CB-O 3.22Å; M2016-F2164 WeakPolarHBondContact CB-O 3.48Å; M2016-F2164 WeakPolarHBondContact CG-O 3.44Å; M2016-G2166 WeakPolarHBondContact O-CA 3.23Å; M2016-G2166 PolarHBondContact O-N 3.07Å; M2016-D2167 PolarHBondContact N-O 2.98Å; M2016-C2185 HydrophobicContact CE-CB 4.14Å; M2016-C2185 HydrophobicContact SD-CB 3.67Å; M2016-K2187 HydrophobicContact CE-CD 3.93Å; M2016-K2187 VanDerWaalsContact CE-CE 3.43Å; M2016-K2187 HydrophobicContact CE-CG 4.23Å; M2016-K2187 HydrophobicContact SD-CD 4.28Å; M2016-K2187 HydrophobicContact SD-CG 3.92Å
2017	L	96.2	Very high	93.6	Very high	3 Å²	3	23 Å²	23	2%	0.016	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-30	-173.1	-62	172.9	0	0	0	112.9	F1872 W1877 V2015 H2165 I2186 A2188	F1872-L2017 HydrophobicContact CD1-CD2 3.5Å; F1872-L2017 VanDerWaalsContact CD1-CD2 3.5Å; F1872-L2017 HydrophobicContact CD2-CD2 4.35Å; F1872-L2017 HydrophobicContact CE1-CD2 3.37Å; F1872-L2017 HydrophobicContact CE2-CD2 4.3Å; F1872-L2017 HydrophobicContact CG-CD2 4Å; F1872-L2017 HydrophobicContact CZ-CD2 3.82Å; W1877-L2017 HydrophobicContact CB-CB 4.28Å; W1877-L2017 HydrophobicContact CD2-CB 4.21Å; W1877-L2017 HydrophobicContact CD2-CD1 3.8Å; W1877-L2017 HydrophobicContact CD2-CG 4.44Å; W1877-L2017 HydrophobicContact CE3-CB 4.28Å; W1877-L2017 HydrophobicContact CE3-CD1 3.5Å; W1877-L2017 HydrophobicContact CE3-CG 4.46Å; W1877-L2017 HydrophobicContact CG-CB 4.22Å; W1877-L2017 HydrophobicContact CH2-CD1 3.7Å; W1877-L2017 HydrophobicContact CZ2-CD1 4.02Å; W1877-L2017 HydrophobicContact CZ3-CD1 3.45Å; W1877-L2017 VanDerWaalsContact CZ3-CD1 3.45Å; V2015-L2017 HydrophobicContact CB-CD2 4.16Å; V2015-L2017 HydrophobicContact CB-CG 4.42Å; V2015-L2017 HydrophobicContact CG1-CD2 3.63Å; V2015-L2017 HydrophobicContact CG1-CG 4.28Å; V2015-L2017 PolarHBondContact O-N 3.12Å; L2017-H2165 PolarHBondContact O-CE1 3.2Å; L2017-H2165 VanDerWaalsContact O-CE1 3.3Å; L2017-H2165 PolarHBondContact O-ND1 3.46Å; L2017-I2186 PolarHBondContact N-O 3.46Å; L2017-A2188 HydrophobicContact CD1-CB 3.58Å
2018	Y	96.9	Very high	93.4	Very high	51 Å²	51	24.2 Å²	24.2	20%	0.2	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	143.7	175.7	-167.5	-91.6	0	0	0	112.3	T1878 P1879 F1914 E1915 C2185 I2186	T1878-Y2018 HydrophobicContact CG2-CD2 4.44Å; T1878-Y2018 HydrophobicContact CG2-CE2 4.04Å; P1879-Y2018 VanDerWaalsContact CD-CZ 3.45Å; P1879-Y2018 HydrophobicContact CG-CD1 3.78Å; P1879-Y2018 HydrophobicContact CG-CE1 3.46Å; P1879-Y2018 VanDerWaalsContact CG-CE1 3.46Å; F1914-Y2018 HydrophobicContact CE1-CD1 4.33Å; E1915-Y2018 WeakPolarHBondContact OE1-CE1 3.24Å; E1915-Y2018 PolarHBondContact OE1-OH 3.03Å; Y2018-C2185 WeakPolarHBondContact O-CA 3.31Å; Y2018-I2186 HydrophobicContact CD1-CD1 4.38Å; Y2018-I2186 HydrophobicContact CG-CD1 4.43Å; Y2018-I2186 PolarHBondContact N-O 2.78Å; Y2018-I2186 VanDerWaalsContact N-O 3.11Å; Y2018-I2186 PolarHBondContact O-N 2.74Å
2019	V	97.2	Very high	93.3	Very high	9 Å²	9	24.2 Å²	24.2	6%	0.055	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	105.3	174	-175.3	0	0	0	0	109.9	M2016 I2096 H2165 N2183 S2184	M2016-V2019 HydrophobicContact CE-CG2 4.45Å; M2016-V2019 HydrophobicContact CG-CG2 3.54Å; M2016-V2019 HydrophobicContact SD-CG2 3.62Å; V2019-I2096 HydrophobicContact CB-CG2 4.02Å; V2019-I2096 HydrophobicContact CG1-CG2 3.59Å; V2019-H2165 HydrophobicContact CB-CB 4.41Å; V2019-H2165 HydrophobicContact CG2-CB 3.85Å; V2019-N2183 HydrophobicContact CG1-CB 3.47Å; V2019-N2183 VanDerWaalsContact CG1-CB 3.47Å; V2019-S2184 CarbonylContact C-O 2.89Å; V2019-S2184 WeakPolarHBondContact CA-O 3.44Å
2020	G	94.5	Very high	93.4	Very high	1 Å²	1	24 Å²	24	1%	0.01	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120.1	176.8	0	0	0	0	0	111.8	E1915 S2184	E1915-G2020 WeakPolarHBondContact OE1-CA 3.49Å; G2020-S2184 PolarHBondContact N-O 3.11Å; G2020-S2184 WeakPolarHBondContact O-CB 3.37Å; G2020-S2184 PolarHBondContact O-N 3.46Å
2021	Q	91.7	Very high	93.3	Very high	34 Å²	34	28.3 Å²	28.3	16%	0.159	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-87.5	162	173.3	-58.6	-177.2	42.4	0	0	110.3	W2056 I2096	Q2021-W2056 HydrophobicContact CG-CZ2 4.43Å; Q2021-I2096 HydrophobicContact CG-CG2 4.04Å
2022	P	90.9	Very high	93	Very high	6 Å²	6	28.3 Å²	28.3	4%	0.039	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-64.2	133.8	168.6	-20.2	33.7	0	0	0	111.9	E1915 E2028 M2029 N2032	E1915-P2022 CarbonylContact O-C 3.57Å; E1915-P2022 WeakPolarHBondContact O-CA 3.19Å; P2022-E2028 HydrophobicContact CB-CG 4.25Å; P2022-E2028 VanDerWaalsContact CB-OE1 3.32Å; P2022-E2028 WeakPolarHBondContact CB-OE1 3.45Å; P2022-M2029 WeakPolarHBondContact O-CE 3.44Å; P2022-N2032 WeakPolarHBondContact CD-ND2 3.39Å; P2022-N2032 HydrophobicContact CG-CB 3.86Å
2023	T	90	Very high	92.8	Very high	43 Å²	43	28.1 Å²	28.1	26%	0.264	15%	0.154	S	C	.	.			trans	-118.2	1.3	-176.5	56.9	0	0	0	0	113.2	E1915 K1916 S2025	E1915-T2023 HydrophobicContact CB-CG2 4.2Å; E1915-T2023 PolarHBondContact O-N 2.9Å; E1915-T2023 PolarHBondContact O-OG1 3.14Å; K1916-T2023 WeakPolarHBondContact CE-OG1 3.23Å; K1916-T2023 WeakPolarHBondContact CG-OG1 3.36Å; T2023-S2025 PolarHBondContact O-N 2.91Å
2024	D	89	Confident	92.6	Very high	39 Å²	39	31.6 Å²	31.6	21%	0.209	17%	0.169	C	C	.	.	S	Bend	trans	-64.6	-39	-177.4	-47.6	-102.7	0	0	0	111.9	K1916 R1917 E1918	K1916-D2024 VanDerWaalsContact CA-OD1 3.22Å; K1916-D2024 WeakPolarHBondContact CA-OD1 3.2Å; K1916-D2024 WeakPolarHBondContact CA-OD2 3.49Å; R1917-D2024 PolarHBondContact N-OD1 2.95Å; R1917-D2024 PolarHBondContact N-OD2 2.81Å; E1918-D2024 HydrophobicContact CG-CB 4.47Å; E1918-D2024 PolarHBondContact N-OD1 3.39Å
2025	S	90.2	Very high	92.4	Very high	51 Å²	51	32.5 Å²	32.5	36%	0.357	18%	0.177	S	C	.	.			trans	-161.3	159	169.1	65.6	0	0	0	0	112.4	T2023 N2027 E2028 M2029	T2023-S2025 PolarHBondContact O-N 2.91Å; S2025-N2027 VanDerWaalsContact C-N 3.27Å; S2025-N2027 PolarHBondContact O-N 2.81Å; S2025-E2028 PolarHBondContact O-N 2.9Å; S2025-E2028 VanDerWaalsContact O-N 3.14Å; S2025-E2028 PolarHBondContact OG-N 2.84Å; S2025-E2028 VanDerWaalsContact OG-N 3.11Å; S2025-M2029 PolarHBondContact O-N 3.36Å
2026	L	89.2	Confident	92.2	Very high	39 Å²	39	32.5 Å²	32.5	20%	0.204	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-37.8	173.2	-177.6	62.4	0	0	0	112	E2028 M2029 L2030 I2060 Q2064	L2026-E2028 PolarHBondContact O-N 2.7Å; L2026-M2029 HydrophobicContact CD1-SD 4.44Å; L2026-M2029 PolarHBondContact O-N 3.26Å; L2026-L2030 WeakPolarHBondContact O-CB 3.35Å; L2026-L2030 PolarHBondContact O-N 3.01Å; L2026-I2060 HydrophobicContact CD1-CG2 4.32Å; L2026-Q2064 HydrophobicContact CD2-CB 4.06Å; L2026-Q2064 HydrophobicContact CD2-CG 4.15Å
2027	N	89.7	Confident	92	Very high	106 Å²	106	33.1 Å²	33.1	57%	0.567	18%	0.181	S	C	*	.	H	α-helix	trans	-63.9	-38.5	175.7	-72.7	-21.7	0	0	0	112.1	S2025 T2031	S2025-N2027 VanDerWaalsContact C-N 3.27Å; S2025-N2027 PolarHBondContact O-N 2.81Å; N2027-T2031 VanDerWaalsContact O-CB 3.32Å; N2027-T2031 WeakPolarHBondContact O-CB 3.31Å; N2027-T2031 PolarHBondContact O-N 2.59Å; N2027-T2031 PolarHBondContact O-OG1 3.26Å
2028	E	87.4	Confident	91.8	Very high	37 Å²	37	38 Å²	38	17%	0.173	21%	0.206	C	C	.	.	H	α-helix	trans	-69.6	-43.5	174.3	-167.5	-177	129.9	0	0	111.6	R1917 P2022 S2025 L2026 L2030 T2031 N2032	R1917-E2028 WeakPolarHBondContact CB-OE1 3.5Å; R1917-E2028 IonicContact CZ-OE1 3.49Å; R1917-E2028 IonicContact NE-OE1 2.66Å; R1917-E2028 PolarHBondContact NE-OE1 3.46Å; R1917-E2028 IonicContact NE-OE2 3.63Å; R1917-E2028 PolarHBondContact NE-OE2 3.18Å; R1917-E2028 VanDerWaalsContact NH2-CD 3.34Å; R1917-E2028 IonicContact NH2-OE1 2.93Å; R1917-E2028 PolarHBondContact NH2-OE1 3.3Å; P2022-E2028 HydrophobicContact CB-CG 4.25Å; P2022-E2028 VanDerWaalsContact CB-OE1 3.32Å; P2022-E2028 WeakPolarHBondContact CB-OE1 3.45Å; S2025-E2028 PolarHBondContact O-N 2.9Å; S2025-E2028 VanDerWaalsContact O-N 3.14Å; S2025-E2028 PolarHBondContact OG-N 2.84Å; S2025-E2028 VanDerWaalsContact OG-N 3.11Å; L2026-E2028 PolarHBondContact O-N 2.7Å; E2028-L2030 VanDerWaalsContact C-N 3.31Å; E2028-L2030 PolarHBondContact O-N 3.11Å; E2028-T2031 PolarHBondContact O-N 3.05Å; E2028-N2032 WeakPolarHBondContact O-CB 3.33Å; E2028-N2032 PolarHBondContact O-N 3.45Å
2029	M	89.9	Confident	91.5	Very high	45 Å²	45	36.5 Å²	36.5	22%	0.222	20%	0.203	C	C	.	.	H	α-helix	trans	-56.6	-45.2	176.1	-174.4	-172.3	-67	0	0	111.3	P2022 S2025 L2026 N2032 A2033 I2060	P2022-M2029 WeakPolarHBondContact O-CE 3.44Å; S2025-M2029 PolarHBondContact O-N 3.36Å; L2026-M2029 HydrophobicContact CD1-SD 4.44Å; L2026-M2029 PolarHBondContact O-N 3.26Å; M2029-N2032 WeakPolarHBondContact O-CB 3.27Å; M2029-N2032 PolarHBondContact O-N 2.91Å; M2029-A2033 WeakPolarHBondContact O-CB 3.21Å; M2029-A2033 PolarHBondContact O-N 2.91Å; M2029-I2060 HydrophobicContact CG-CD1 4.35Å; M2029-I2060 HydrophobicContact CG-CG2 4.39Å; M2029-I2060 HydrophobicContact SD-CG2 4.25Å
2030	L	91.8	Very high	91.2	Very high	21 Å²	21	36.1 Å²	36.1	11%	0.11	20%	0.2	C	C	.	.	H	α-helix	trans	-65.7	-48.2	176.7	-171.6	69.9	0	0	0	112	L2026 E2028 N2032 A2033 E2034 L2057 I2060 K2061	L2026-L2030 WeakPolarHBondContact O-CB 3.35Å; L2026-L2030 PolarHBondContact O-N 3.01Å; E2028-L2030 VanDerWaalsContact C-N 3.31Å; E2028-L2030 PolarHBondContact O-N 3.11Å; L2030-N2032 PolarHBondContact O-N 3.4Å; L2030-A2033 PolarHBondContact O-N 2.96Å; L2030-A2033 VanDerWaalsContact O-N 3.1Å; L2030-E2034 PolarHBondContact O-N 3.47Å; L2030-L2057 HydrophobicContact CD1-CD1 3.9Å; L2030-I2060 HydrophobicContact CD1-CG2 3.97Å; L2030-K2061 HydrophobicContact CD1-CD 4.34Å; L2030-K2061 HydrophobicContact CD1-CG 3.59Å
2031	T	91.3	Very high	91	Very high	92 Å²	92	39.4 Å²	39.4	56%	0.564	22%	0.221	S	C	*	.	H	α-helix	trans	-59	-37.7	177.1	-57.5	0	0	0	0	111.5	N2027 E2028 S2035	N2027-T2031 VanDerWaalsContact O-CB 3.32Å; N2027-T2031 WeakPolarHBondContact O-CB 3.31Å; N2027-T2031 PolarHBondContact O-N 2.59Å; N2027-T2031 PolarHBondContact O-OG1 3.26Å; E2028-T2031 PolarHBondContact O-N 3.05Å; T2031-S2035 VanDerWaalsContact O-CB 3.24Å; T2031-S2035 WeakPolarHBondContact O-CB 3.31Å; T2031-S2035 PolarHBondContact O-N 2.95Å
2032	N	91.8	Very high	90.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-47.4	173.7	173.7	77.8	0	0	0	111.7	V1995 P2022 E2028 M2029 L2030 E2034 S2035 I2036 N2183	V1995-N2032 HydrophobicContact CG1-CB 4.37Å; V1995-N2032 WeakPolarHBondContact CG1-OD1 3.41Å; V1995-N2032 WeakPolarHBondContact CG2-OD1 3.29Å; P2022-N2032 WeakPolarHBondContact CD-ND2 3.39Å; P2022-N2032 HydrophobicContact CG-CB 3.86Å; E2028-N2032 WeakPolarHBondContact O-CB 3.33Å; E2028-N2032 PolarHBondContact O-N 3.45Å; M2029-N2032 WeakPolarHBondContact O-CB 3.27Å; M2029-N2032 PolarHBondContact O-N 2.91Å; L2030-N2032 PolarHBondContact O-N 3.4Å; N2032-E2034 PolarHBondContact O-N 3.01Å; N2032-S2035 WeakPolarHBondContact O-CB 3.33Å; N2032-S2035 PolarHBondContact O-N 3.32Å; N2032-I2036 VanDerWaalsContact O-CG1 3.31Å; N2032-I2036 WeakPolarHBondContact O-CG1 3.23Å; N2032-I2036 PolarHBondContact O-N 3.03Å; N2032-N2183 PolarHBondContact ND2-OD1 3.34Å
2033	A	92.6	Very high	90.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-43.9	178.4	0	0	0	0	0	112.3	M2029 L2030 I2036 V2037 W2056 L2057 I2060	M2029-A2033 WeakPolarHBondContact O-CB 3.21Å; M2029-A2033 PolarHBondContact O-N 2.91Å; L2030-A2033 PolarHBondContact O-N 2.96Å; L2030-A2033 VanDerWaalsContact O-N 3.1Å; A2033-I2036 PolarHBondContact O-N 2.79Å; A2033-V2037 PolarHBondContact O-N 2.94Å; A2033-W2056 HydrophobicContact CB-CE3 4.33Å; A2033-W2056 HydrophobicContact CB-CH2 3.52Å; A2033-W2056 HydrophobicContact CB-CZ2 4.37Å; A2033-W2056 HydrophobicContact CB-CZ3 3.5Å; A2033-L2057 HydrophobicContact CB-CD1 3.59Å; A2033-I2060 HydrophobicContact CB-CD1 3.91Å
2034	E	93.2	Very high	90.1	Very high	73 Å²	73	44.1 Å²	44.1	34%	0.341	25%	0.248	S	C	.	.	H	α-helix	trans	-67.1	-36.7	174.9	-65.8	-170.1	151.1	0	0	112.3	L2030 N2032 I2036 V2037 N2038 L2057 K2061	L2030-E2034 PolarHBondContact O-N 3.47Å; N2032-E2034 PolarHBondContact O-N 3.01Å; E2034-I2036 VanDerWaalsContact C-N 3.29Å; E2034-I2036 PolarHBondContact O-N 3.05Å; E2034-V2037 PolarHBondContact O-N 2.98Å; E2034-N2038 WeakPolarHBondContact O-CB 3.27Å; E2034-N2038 VanDerWaalsContact O-CG 3.28Å; E2034-N2038 PolarHBondContact O-N 3.33Å; E2034-N2038 PolarHBondContact O-ND2 3.03Å; E2034-L2057 HydrophobicContact CG-CD1 3.81Å; E2034-L2057 HydrophobicContact CG-CD2 4.11Å; E2034-K2061 WeakPolarHBondContact OE1-CE 3.18Å; E2034-K2061 IonicContact OE1-NZ 3.74Å; E2034-K2061 PolarHBondContact OE1-NZ 3.09Å
2035	S	92.5	Very high	90.1	Very high	30 Å²	30	43 Å²	43	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-63.8	-33.8	172.3	-172.3	0	0	0	0	112.6	G1996 T2031 N2032 T2039	G1996-S2035 VanDerWaalsContact CA-OG 3.27Å; G1996-S2035 WeakPolarHBondContact CA-OG 3.46Å; G1996-S2035 PolarHBondContact N-OG 3.36Å; T2031-S2035 VanDerWaalsContact O-CB 3.24Å; T2031-S2035 WeakPolarHBondContact O-CB 3.31Å; T2031-S2035 PolarHBondContact O-N 2.95Å; N2032-S2035 WeakPolarHBondContact O-CB 3.33Å; N2032-S2035 PolarHBondContact O-N 3.32Å; S2035-T2039 WeakPolarHBondContact O-CB 3.2Å; S2035-T2039 PolarHBondContact O-N 3.32Å; S2035-T2039 PolarHBondContact O-OG1 3.5Å
2036	I	93.5	Very high	89.9	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-70.4	-48.3	174.5	-70.7	169.8	0	0	0	110.6	N2032 A2033 E2034 N2038 T2039 L2040 V2053 W2056 P2097 L2182 N2183	N2032-I2036 VanDerWaalsContact O-CG1 3.31Å; N2032-I2036 WeakPolarHBondContact O-CG1 3.23Å; N2032-I2036 PolarHBondContact O-N 3.03Å; A2033-I2036 PolarHBondContact O-N 2.79Å; E2034-I2036 VanDerWaalsContact C-N 3.29Å; E2034-I2036 PolarHBondContact O-N 3.05Å; I2036-N2038 PolarHBondContact O-N 2.93Å; I2036-T2039 WeakPolarHBondContact O-CB 3.46Å; I2036-T2039 PolarHBondContact O-N 3.15Å; I2036-T2039 VanDerWaalsContact O-N 3.14Å; I2036-L2040 HydrophobicContact CG2-CD1 3.9Å; I2036-L2040 HydrophobicContact CG2-CG 4.38Å; I2036-L2040 WeakPolarHBondContact O-CG 3.44Å; I2036-L2040 PolarHBondContact O-N 3.34Å; I2036-V2053 HydrophobicContact CG2-CG1 4.35Å; I2036-W2056 HydrophobicContact CD1-CH2 4.22Å; I2036-P2097 HydrophobicContact CG2-CG 4.08Å; I2036-L2182 HydrophobicContact CD1-CB 4Å; I2036-L2182 HydrophobicContact CG1-CB 4.06Å; I2036-L2182 HydrophobicContact CG2-CB 4.29Å; I2036-L2182 HydrophobicContact CG2-CD1 4.16Å; I2036-L2182 HydrophobicContact CG2-CD2 4.48Å; I2036-N2183 WeakPolarHBondContact CD1-ND2 3.46Å; I2036-N2183 WeakPolarHBondContact CD1-OD1 3.41Å
2037	V	92.8	Very high	89.8	Confident	13 Å²	13	46.4 Å²	46.4	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-54.5	-51.6	174.2	170.3	0	0	0	0	110.7	A2033 E2034 T2039 L2040 T2041 V2053 L2054 L2057	A2033-V2037 PolarHBondContact O-N 2.94Å; E2034-V2037 PolarHBondContact O-N 2.98Å; V2037-T2039 VanDerWaalsContact C-N 3.29Å; V2037-T2039 PolarHBondContact O-N 3.07Å; V2037-L2040 PolarHBondContact O-N 3.28Å; V2037-T2041 PolarHBondContact O-N 3.34Å; V2037-T2041 PolarHBondContact O-OG1 2.71Å; V2037-T2041 VanDerWaalsContact O-OG1 3.08Å; V2037-V2053 HydrophobicContact CG2-CG1 3.64Å; V2037-L2054 HydrophobicContact CG1-CD2 3.98Å; V2037-L2054 HydrophobicContact CG2-CD2 4.38Å; V2037-L2057 HydrophobicContact CG2-CB 4.44Å; V2037-L2057 HydrophobicContact CG2-CD2 4.03Å
2038	N	91.2	Very high	89.6	Confident	104 Å²	104	44 Å²	44	56%	0.556	24%	0.244	S	C	*	.	H	α-helix	trans	-60.3	-37.2	178.8	-72.3	-38.3	0	0	0	112.8	E2034 I2036 S2042	E2034-N2038 WeakPolarHBondContact O-CB 3.27Å; E2034-N2038 VanDerWaalsContact O-CG 3.28Å; E2034-N2038 PolarHBondContact O-N 3.33Å; E2034-N2038 PolarHBondContact O-ND2 3.03Å; I2036-N2038 PolarHBondContact O-N 2.93Å; N2038-S2042 WeakPolarHBondContact O-CB 3.1Å; N2038-S2042 PolarHBondContact O-N 2.83Å; N2038-S2042 PolarHBondContact O-OG 2.78Å
2039	T	90.8	Very high	89.8	Confident	21 Å²	21	42.2 Å²	42.2	13%	0.129	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-40.8	174.3	-62.9	0	0	0	0	111.6	S2035 I2036 V2037 A2043 R2180 L2182	S2035-T2039 WeakPolarHBondContact O-CB 3.2Å; S2035-T2039 PolarHBondContact O-N 3.32Å; S2035-T2039 PolarHBondContact O-OG1 3.5Å; I2036-T2039 WeakPolarHBondContact O-CB 3.46Å; I2036-T2039 PolarHBondContact O-N 3.15Å; I2036-T2039 VanDerWaalsContact O-N 3.14Å; V2037-T2039 VanDerWaalsContact C-N 3.29Å; V2037-T2039 PolarHBondContact O-N 3.07Å; T2039-A2043 PolarHBondContact O-N 2.84Å; T2039-R2180 VanDerWaalsContact CG2-NH1 3.32Å; T2039-L2182 HydrophobicContact CG2-CD2 4.27Å
2040	L	91.1	Very high	89.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-77.6	-41.7	-176.3	-70.6	178.7	0	0	0	113	I2036 V2037 S2042 A2043 I2045 V2053 L2100 V2162 L2182	I2036-L2040 HydrophobicContact CG2-CD1 3.9Å; I2036-L2040 HydrophobicContact CG2-CG 4.38Å; I2036-L2040 WeakPolarHBondContact O-CG 3.44Å; I2036-L2040 PolarHBondContact O-N 3.34Å; V2037-L2040 PolarHBondContact O-N 3.28Å; L2040-S2042 PolarHBondContact O-N 3.03Å; L2040-A2043 WeakPolarHBondContact O-CA 3.42Å; L2040-A2043 PolarHBondContact O-N 3.26Å; L2040-I2045 HydrophobicContact CB-CD1 3.8Å; L2040-I2045 HydrophobicContact CB-CG1 4.36Å; L2040-I2045 HydrophobicContact CD1-CD1 4.39Å; L2040-I2045 HydrophobicContact CD2-CG2 4.21Å; L2040-V2053 HydrophobicContact CD1-CB 4.4Å; L2040-V2053 HydrophobicContact CD1-CG1 4.2Å; L2040-V2053 HydrophobicContact CD1-CG2 3.8Å; L2040-L2100 HydrophobicContact CD2-CD1 3.88Å; L2040-L2100 HydrophobicContact CD2-CD2 4.33Å; L2040-L2100 HydrophobicContact CD2-CG 4.48Å; L2040-V2162 HydrophobicContact CD1-CG1 4.3Å; L2040-V2162 HydrophobicContact CD1-CG2 4.28Å; L2040-V2162 HydrophobicContact CD2-CG2 3.71Å; L2040-L2182 HydrophobicContact CD1-CD1 4.23Å; L2040-L2182 HydrophobicContact CD2-CD1 4.11Å; L2040-L2182 HydrophobicContact CD2-CD2 4.41Å; L2040-L2182 HydrophobicContact CG-CD1 4.45Å
2041	T	90.1	Very high	89.8	Confident	71 Å²	71	46 Å²	46	44%	0.436	25%	0.253	S	S	.	.	H	α-helix	trans	-58	-37.1	170.9	-53.6	0	0	0	0	111.2	V2037 A2043	V2037-T2041 PolarHBondContact O-N 3.34Å; V2037-T2041 PolarHBondContact O-OG1 2.71Å; V2037-T2041 VanDerWaalsContact O-OG1 3.08Å; T2041-A2043 PolarHBondContact O-N 3.35Å
2042	S	85.2	Confident	89.9	Confident	76 Å²	76	43.2 Å²	43.2	53%	0.531	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-14.1	174.6	-55.1	0	0	0	0	114	N2038 L2040 Q2144	N2038-S2042 WeakPolarHBondContact O-CB 3.1Å; N2038-S2042 PolarHBondContact O-N 2.83Å; N2038-S2042 PolarHBondContact O-OG 2.78Å; L2040-S2042 PolarHBondContact O-N 3.03Å; S2042-Q2144 WeakPolarHBondContact O-CG 3.35Å
2043	A	86.4	Confident	89.9	Confident	6 Å²	6	43.2 Å²	43.2	5%	0.05	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	10.3	-178.4	0	0	0	0	0	113.5	T2039 L2040 T2041 I2045 L2100	T2039-A2043 PolarHBondContact O-N 2.84Å; L2040-A2043 WeakPolarHBondContact O-CA 3.42Å; L2040-A2043 PolarHBondContact O-N 3.26Å; T2041-A2043 PolarHBondContact O-N 3.35Å; A2043-I2045 VanDerWaalsContact C-N 3.28Å; A2043-I2045 HydrophobicContact CB-CG2 4.34Å; A2043-I2045 PolarHBondContact O-N 3.33Å; A2043-L2100 HydrophobicContact CB-CD2 4.08Å
2044	H	82.8	Confident	90	Very high	99 Å²	99	46.3 Å²	46.3	46%	0.458	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	44.8	178.4	-59.1	-52.3	0	0	0	113.7
2045	I	88.5	Confident	89.9	Confident	16 Å²	16	46.4 Å²	46.4	8%	0.082	25%	0.251	C	S	.	.			trans	-67.8	160.5	176	63.5	161.9	0	0	0	112.3	L2040 A2043 L2050 L2100 T2160 V2162	L2040-I2045 HydrophobicContact CB-CD1 3.8Å; L2040-I2045 HydrophobicContact CB-CG1 4.36Å; L2040-I2045 HydrophobicContact CD1-CD1 4.39Å; L2040-I2045 HydrophobicContact CD2-CG2 4.21Å; A2043-I2045 VanDerWaalsContact C-N 3.28Å; A2043-I2045 HydrophobicContact CB-CG2 4.34Å; A2043-I2045 PolarHBondContact O-N 3.33Å; I2045-L2050 HydrophobicContact CD1-CB 3.87Å; I2045-L2050 HydrophobicContact CD1-CD1 4.33Å; I2045-L2050 HydrophobicContact CG1-CB 4.26Å; I2045-L2100 HydrophobicContact CG2-CD1 4.42Å; I2045-T2160 HydrophobicContact CG2-CG2 3.89Å; I2045-V2162 HydrophobicContact CD1-CG2 4.31Å; I2045-V2162 HydrophobicContact CG2-CG2 4.03Å
2046	D	86.8	Confident	90	Very high	34 Å²	34	45.4 Å²	45.4	18%	0.182	24%	0.243	C	C	.	.			trans	-61.8	140.9	171.7	-178.5	-83.2	0	0	0	112.1	Y1822 N2048 Y2049 L2050	Y1822-D2046 WeakPolarHBondContact CE1-OD1 3.49Å; D2046-N2048 PolarHBondContact O-N 2.89Å; D2046-N2048 VanDerWaalsContact OD1-CB 3.25Å; D2046-N2048 WeakPolarHBondContact OD1-CB 3.3Å; D2046-N2048 PolarHBondContact OD1-N 3.28Å; D2046-N2048 PolarHBondContact OD1-ND2 3.46Å; D2046-Y2049 HydrophobicContact CB-CD2 4.17Å; D2046-Y2049 WeakPolarHBondContact O-CA 3.43Å; D2046-Y2049 WeakPolarHBondContact O-CB 3.44Å; D2046-Y2049 PolarHBondContact O-N 2.87Å; D2046-L2050 PolarHBondContact O-N 3.04Å; D2046-L2050 VanDerWaalsContact O-N 3.11Å
2047	D	86.8	Confident	89.9	Confident	127 Å²	127	45.8 Å²	45.8	68%	0.679	25%	0.245	S	C	*	.	H	α-helix	trans	-57.2	-33.4	-176.7	-67.8	-48	0	0	0	113.2	Y2049 L2050 E2051	D2047-Y2049 VanDerWaalsContact C-N 3.3Å; D2047-Y2049 PolarHBondContact O-N 2.92Å; D2047-L2050 PolarHBondContact O-N 3.04Å; D2047-E2051 WeakPolarHBondContact O-CB 3.31Å; D2047-E2051 PolarHBondContact O-N 3.45Å
2048	N	86.1	Confident	89.9	Confident	56 Å²	56	49.3 Å²	49.3	30%	0.299	26%	0.263	S	S	.	.	H	α-helix	trans	-68.2	-30.3	176.8	-59.1	-106.5	0	0	0	111.7	Y1822 D2046 R2052	Y1822-N2048 HydrophobicContact CE1-CB 3.87Å; D2046-N2048 PolarHBondContact O-N 2.89Å; D2046-N2048 VanDerWaalsContact OD1-CB 3.25Å; D2046-N2048 WeakPolarHBondContact OD1-CB 3.3Å; D2046-N2048 PolarHBondContact OD1-N 3.28Å; D2046-N2048 PolarHBondContact OD1-ND2 3.46Å; N2048-R2052 WeakPolarHBondContact O-CG 3.4Å; N2048-R2052 PolarHBondContact O-N 2.87Å
2049	Y	91.1	Very high	89.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-74.2	-38.4	172.1	-76.5	-45.5	0	0	0	110.8	F1838 D2046 D2047 R2052 V2053 V2162 F2164	F1838-Y2049 HydrophobicContact CE1-CE2 4.25Å; F1838-Y2049 WeakPolarHBondContact CE2-OH 3.35Å; F1838-Y2049 AromaticContact CZ-CE2 3.63Å; F1838-Y2049 HydrophobicContact CZ-CE2 3.63Å; F1838-Y2049 AromaticContact CZ-CZ 3.76Å; F1838-Y2049 WeakPolarHBondContact CZ-OH 3.45Å; D2046-Y2049 HydrophobicContact CB-CD2 4.17Å; D2046-Y2049 WeakPolarHBondContact O-CA 3.43Å; D2046-Y2049 WeakPolarHBondContact O-CB 3.44Å; D2046-Y2049 PolarHBondContact O-N 2.87Å; D2047-Y2049 VanDerWaalsContact C-N 3.3Å; D2047-Y2049 PolarHBondContact O-N 2.92Å; Y2049-R2052 PolarHBondContact O-N 3.25Å; Y2049-V2053 WeakPolarHBondContact O-CG2 2.91Å; Y2049-V2053 PolarHBondContact O-N 3.49Å; Y2049-V2162 HydrophobicContact CD1-CB 4.19Å; Y2049-V2162 HydrophobicContact CD2-CB 4.5Å; Y2049-V2162 HydrophobicContact CD2-CG2 4.4Å; Y2049-V2162 HydrophobicContact CE1-CB 4.5Å; Y2049-V2162 WeakPolarHBondContact CE1-O 3.28Å; Y2049-V2162 HydrophobicContact CG-CB 4.19Å; Y2049-V2162 HydrophobicContact CG-CG2 4.28Å; Y2049-F2164 AromaticContact CD1-CE2 3.62Å; Y2049-F2164 HydrophobicContact CD1-CE2 3.62Å; Y2049-F2164 HydrophobicContact CD1-CZ 4.3Å; Y2049-F2164 HydrophobicContact CE1-CE2 4.01Å
2050	L	91.1	Very high	89.7	Confident	34 Å²	34	47.3 Å²	47.3	18%	0.178	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-43.9	177.1	-174.2	59.8	0	0	0	111	I2045 D2046 D2047 R2052 V2053 L2054	I2045-L2050 HydrophobicContact CD1-CB 3.87Å; I2045-L2050 HydrophobicContact CD1-CD1 4.33Å; I2045-L2050 HydrophobicContact CG1-CB 4.26Å; D2046-L2050 PolarHBondContact O-N 3.04Å; D2046-L2050 VanDerWaalsContact O-N 3.11Å; D2047-L2050 PolarHBondContact O-N 3.04Å; L2050-R2052 PolarHBondContact O-N 2.83Å; L2050-V2053 PolarHBondContact O-N 3.01Å; L2050-L2054 HydrophobicContact CD1-CD1 4.42Å; L2050-L2054 HydrophobicContact CD1-CG 4.37Å; L2050-L2054 HydrophobicContact CG-CD1 3.98Å; L2050-L2054 HydrophobicContact CG-CG 4.38Å; L2050-L2054 WeakPolarHBondContact O-CB 3.19Å; L2050-L2054 VanDerWaalsContact O-CG 3.31Å; L2050-L2054 WeakPolarHBondContact O-CG 3.37Å; L2050-L2054 PolarHBondContact O-N 2.84Å
2051	E	91	Very high	89.7	Confident	112 Å²	112	50.7 Å²	50.7	52%	0.523	26%	0.263	S	S	.	.	H	α-helix	trans	-57.5	-47.3	175.6	-164.6	-160.7	151.4	0	0	111.8	D2047 V2053 L2054 N2055	D2047-E2051 WeakPolarHBondContact O-CB 3.31Å; D2047-E2051 PolarHBondContact O-N 3.45Å; E2051-V2053 VanDerWaalsContact C-N 3.35Å; E2051-V2053 PolarHBondContact O-N 2.89Å; E2051-L2054 PolarHBondContact O-N 3.3Å; E2051-N2055 WeakPolarHBondContact O-CB 3.42Å; E2051-N2055 VanDerWaalsContact O-CG 3.26Å; E2051-N2055 PolarHBondContact O-N 3.12Å; E2051-N2055 PolarHBondContact O-ND2 3.39Å
2052	R	92.2	Very high	89.4	Confident	33 Å²	33	49.7 Å²	49.7	13%	0.125	26%	0.259	C	S	.	.	H	α-helix	trans	-57.1	-45.2	175.8	-73.9	179.3	76.4	-159.1	2	112.4	N2048 Y2049 L2050 N2055 W2056 E2094 D2095 F2164 D2167	N2048-R2052 WeakPolarHBondContact O-CG 3.4Å; N2048-R2052 PolarHBondContact O-N 2.87Å; Y2049-R2052 PolarHBondContact O-N 3.25Å; L2050-R2052 PolarHBondContact O-N 2.83Å; R2052-N2055 PolarHBondContact O-N 3.29Å; R2052-W2056 PolarHBondContact O-N 3.07Å; R2052-E2094 PolarHBondContact NH2-O 3.02Å; R2052-D2095 IonicContact CZ-OD1 3.19Å; R2052-D2095 IonicContact NE-OD1 2.67Å; R2052-D2095 PolarHBondContact NE-OD1 2.8Å; R2052-D2095 IonicContact NH2-OD1 3.3Å; R2052-D2095 PolarHBondContact NH2-OD1 2.94Å; R2052-F2164 HydrophobicContact CB-CE1 3.89Å; R2052-F2164 HydrophobicContact CB-CZ 3.79Å; R2052-F2164 VanDerWaalsContact NH1-CE2 3.28Å; R2052-F2164 VanDerWaalsContact NH1-CG 3.33Å; R2052-D2167 IonicContact NH1-OD2 3.87Å
2053	V	92.7	Very high	88.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-72.5	-34.7	-179.5	-177.1	0	0	0	0	111.8	I2036 V2037 L2040 Y2049 L2050 E2051 W2056 L2057 P2097 F2164	I2036-V2053 HydrophobicContact CG2-CG1 4.35Å; V2037-V2053 HydrophobicContact CG2-CG1 3.64Å; L2040-V2053 HydrophobicContact CD1-CB 4.4Å; L2040-V2053 HydrophobicContact CD1-CG1 4.2Å; L2040-V2053 HydrophobicContact CD1-CG2 3.8Å; Y2049-V2053 WeakPolarHBondContact O-CG2 2.91Å; Y2049-V2053 PolarHBondContact O-N 3.49Å; L2050-V2053 PolarHBondContact O-N 3.01Å; E2051-V2053 VanDerWaalsContact C-N 3.35Å; E2051-V2053 PolarHBondContact O-N 2.89Å; V2053-W2056 HydrophobicContact CG1-CE3 3.92Å; V2053-W2056 HydrophobicContact CG1-CZ3 4.29Å; V2053-W2056 PolarHBondContact O-N 2.76Å; V2053-L2057 WeakPolarHBondContact O-CB 3.22Å; V2053-L2057 PolarHBondContact O-N 3.13Å; V2053-P2097 HydrophobicContact CG1-CG 4.23Å; V2053-P2097 HydrophobicContact CG2-CB 4.05Å; V2053-P2097 HydrophobicContact CG2-CG 4.19Å; V2053-F2164 HydrophobicContact CG2-CE1 3.77Å; V2053-F2164 HydrophobicContact CG2-CZ 3.65Å
2054	L	93.2	Very high	88	Confident	66 Å²	66	52.7 Å²	52.7	35%	0.346	26%	0.263	S	S	.	.	H	α-helix	trans	-65.5	-40.7	172.3	-72.1	172.9	0	0	0	111.5	V2037 L2050 E2051 L2057 N2058	V2037-L2054 HydrophobicContact CG1-CD2 3.98Å; V2037-L2054 HydrophobicContact CG2-CD2 4.38Å; L2050-L2054 HydrophobicContact CD1-CD1 4.42Å; L2050-L2054 HydrophobicContact CD1-CG 4.37Å; L2050-L2054 HydrophobicContact CG-CD1 3.98Å; L2050-L2054 HydrophobicContact CG-CG 4.38Å; L2050-L2054 WeakPolarHBondContact O-CB 3.19Å; L2050-L2054 VanDerWaalsContact O-CG 3.31Å; L2050-L2054 WeakPolarHBondContact O-CG 3.37Å; L2050-L2054 PolarHBondContact O-N 2.84Å; E2051-L2054 PolarHBondContact O-N 3.3Å; L2054-L2057 PolarHBondContact O-N 2.69Å; L2054-N2058 WeakPolarHBondContact O-CB 3.4Å; L2054-N2058 PolarHBondContact O-N 3.12Å; L2054-N2058 PolarHBondContact O-ND2 3.36Å
2055	N	92.4	Very high	86.9	Confident	75 Å²	75	51.8 Å²	51.8	40%	0.401	27%	0.265	S	S	.	.	H	α-helix	trans	-63.9	-40.5	174.2	-72.2	-23.7	0	0	0	111.7	E2051 R2052 N2058 K2059	E2051-N2055 WeakPolarHBondContact O-CB 3.42Å; E2051-N2055 VanDerWaalsContact O-CG 3.26Å; E2051-N2055 PolarHBondContact O-N 3.12Å; E2051-N2055 PolarHBondContact O-ND2 3.39Å; R2052-N2055 PolarHBondContact O-N 3.29Å; N2055-N2058 PolarHBondContact O-N 2.96Å; N2055-K2059 WeakPolarHBondContact O-CG 3.27Å; N2055-K2059 PolarHBondContact O-N 2.85Å
2056	W	93	Very high	85.5	Confident	9 Å²	9	55 Å²	55	3%	0.034	28%	0.282	C	S	.	.	H	α-helix	trans	-62.8	-44.4	171.4	169.9	75.5	0	0	0	112.9	Q2021 A2033 I2036 R2052 V2053 N2058 K2059 I2060 D2095 I2096 P2097	Q2021-W2056 HydrophobicContact CG-CZ2 4.43Å; A2033-W2056 HydrophobicContact CB-CE3 4.33Å; A2033-W2056 HydrophobicContact CB-CH2 3.52Å; A2033-W2056 HydrophobicContact CB-CZ2 4.37Å; A2033-W2056 HydrophobicContact CB-CZ3 3.5Å; I2036-W2056 HydrophobicContact CD1-CH2 4.22Å; R2052-W2056 PolarHBondContact O-N 3.07Å; V2053-W2056 HydrophobicContact CG1-CE3 3.92Å; V2053-W2056 HydrophobicContact CG1-CZ3 4.29Å; V2053-W2056 PolarHBondContact O-N 2.76Å; W2056-N2058 VanDerWaalsContact C-N 3.31Å; W2056-N2058 PolarHBondContact O-N 2.74Å; W2056-K2059 PolarHBondContact O-N 3.05Å; W2056-I2060 HydrophobicContact CD2-CD1 4.14Å; W2056-I2060 HydrophobicContact CH2-CD1 4.17Å; W2056-I2060 HydrophobicContact CZ2-CD1 3.64Å; W2056-I2060 PolarHBondContact O-N 3.05Å; W2056-D2095 WeakPolarHBondContact CB-O 3.5Å; W2056-I2096 HydrophobicContact CZ2-CG2 4.38Å; W2056-P2097 HydrophobicContact CD2-CG 4.22Å; W2056-P2097 HydrophobicContact CE3-CG 3.82Å; W2056-P2097 HydrophobicContact CH2-CG 4.14Å; W2056-P2097 HydrophobicContact CZ3-CG 3.76Å
2057	L	93.4	Very high	84	Confident	10 Å²	10	56.8 Å²	56.8	5%	0.052	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-41.3	173.6	176.4	65.5	0	0	0	111.6	L2030 A2033 E2034 V2037 V2053 L2054 K2059 I2060 K2061	L2030-L2057 HydrophobicContact CD1-CD1 3.9Å; A2033-L2057 HydrophobicContact CB-CD1 3.59Å; E2034-L2057 HydrophobicContact CG-CD1 3.81Å; E2034-L2057 HydrophobicContact CG-CD2 4.11Å; V2037-L2057 HydrophobicContact CG2-CB 4.44Å; V2037-L2057 HydrophobicContact CG2-CD2 4.03Å; V2053-L2057 WeakPolarHBondContact O-CB 3.22Å; V2053-L2057 PolarHBondContact O-N 3.13Å; L2054-L2057 PolarHBondContact O-N 2.69Å; L2057-K2059 PolarHBondContact O-N 3.07Å; L2057-I2060 PolarHBondContact O-N 2.86Å; L2057-K2061 HydrophobicContact CG-CD 4.33Å; L2057-K2061 WeakPolarHBondContact O-CG 3.17Å; L2057-K2061 PolarHBondContact O-N 3.14Å
2058	N	91.7	Very high	82.4	Confident	87 Å²	87	55.7 Å²	55.7	47%	0.465	29%	0.285	S	S	.	.	H	α-helix	trans	-65.3	-37.1	179.1	-70.8	-22.6	0	0	0	111.9	L2054 N2055 W2056 K2061 S2062	L2054-N2058 WeakPolarHBondContact O-CB 3.4Å; L2054-N2058 PolarHBondContact O-N 3.12Å; L2054-N2058 PolarHBondContact O-ND2 3.36Å; N2055-N2058 PolarHBondContact O-N 2.96Å; W2056-N2058 VanDerWaalsContact C-N 3.31Å; W2056-N2058 PolarHBondContact O-N 2.74Å; N2058-K2061 PolarHBondContact O-N 2.72Å; N2058-S2062 PolarHBondContact O-N 2.64Å; N2058-S2062 PolarHBondContact O-OG 2.94Å
2059	K	89.5	Confident	80.6	Confident	71 Å²	71	57.6 Å²	57.6	31%	0.309	30%	0.298	S	S	.	.	H	α-helix	trans	-59.8	-43.1	170.9	-72.2	-176.6	177.5	-166.7	0	112.4	N2055 W2056 L2057 K2061 S2062 H2063 D2092	N2055-K2059 WeakPolarHBondContact O-CG 3.27Å; N2055-K2059 PolarHBondContact O-N 2.85Å; W2056-K2059 PolarHBondContact O-N 3.05Å; L2057-K2059 PolarHBondContact O-N 3.07Å; K2059-K2061 VanDerWaalsContact C-N 3.3Å; K2059-K2061 PolarHBondContact O-N 2.65Å; K2059-S2062 WeakPolarHBondContact CA-OG 3.34Å; K2059-S2062 PolarHBondContact O-N 3.3Å; K2059-S2062 PolarHBondContact O-OG 3.22Å; K2059-H2063 PolarHBondContact O-CD2 3.04Å; K2059-H2063 VanDerWaalsContact O-CD2 3.27Å; K2059-H2063 PolarHBondContact O-N 3.23Å; K2059-D2092 IonicContact NZ-OD1 3.51Å; K2059-D2092 PolarHBondContact NZ-OD1 3.18Å
2060	I	89.1	Confident	78.3	Confident	11 Å²	11	63.4 Å²	63.4	6%	0.056	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-38.6	175.6	-63.4	170	0	0	0	110.5	L2026 M2029 L2030 A2033 W2056 L2057 H2063 Q2064	L2026-I2060 HydrophobicContact CD1-CG2 4.32Å; M2029-I2060 HydrophobicContact CG-CD1 4.35Å; M2029-I2060 HydrophobicContact CG-CG2 4.39Å; M2029-I2060 HydrophobicContact SD-CG2 4.25Å; L2030-I2060 HydrophobicContact CD1-CG2 3.97Å; A2033-I2060 HydrophobicContact CB-CD1 3.91Å; W2056-I2060 HydrophobicContact CD2-CD1 4.14Å; W2056-I2060 HydrophobicContact CH2-CD1 4.17Å; W2056-I2060 HydrophobicContact CZ2-CD1 3.64Å; W2056-I2060 PolarHBondContact O-N 3.05Å; L2057-I2060 PolarHBondContact O-N 2.86Å; I2060-H2063 PolarHBondContact O-N 2.84Å; I2060-Q2064 PolarHBondContact O-N 2.59Å
2061	K	90.1	Very high	76	Confident	72 Å²	72	67.8 Å²	67.8	31%	0.313	35%	0.349	S	S	.	.	H	α-helix	trans	-69.2	-36.1	176.8	-72.6	-177.9	175.4	-174.7	0	113.6	L2030 E2034 L2057 N2058 K2059 H2063 Q2064 T2065	L2030-K2061 HydrophobicContact CD1-CD 4.34Å; L2030-K2061 HydrophobicContact CD1-CG 3.59Å; E2034-K2061 WeakPolarHBondContact OE1-CE 3.18Å; E2034-K2061 IonicContact OE1-NZ 3.74Å; E2034-K2061 PolarHBondContact OE1-NZ 3.09Å; L2057-K2061 HydrophobicContact CG-CD 4.33Å; L2057-K2061 WeakPolarHBondContact O-CG 3.17Å; L2057-K2061 PolarHBondContact O-N 3.14Å; N2058-K2061 PolarHBondContact O-N 2.72Å; K2059-K2061 VanDerWaalsContact C-N 3.3Å; K2059-K2061 PolarHBondContact O-N 2.65Å; K2061-H2063 VanDerWaalsContact C-N 3.34Å; K2061-H2063 PolarHBondContact O-N 3.17Å; K2061-Q2064 WeakPolarHBondContact O-CB 3.26Å; K2061-Q2064 PolarHBondContact O-N 2.93Å; K2061-Q2064 VanDerWaalsContact O-N 3.13Å; K2061-T2065 PolarHBondContact O-N 3.4Å
2062	S	85.1	Confident	73.6	Confident	50 Å²	50	69.6 Å²	69.6	35%	0.35	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-39.1	173.5	42.5	0	0	0	0	112.3	N2058 K2059 Q2064 T2065 D2066	N2058-S2062 PolarHBondContact O-N 2.64Å; N2058-S2062 PolarHBondContact O-OG 2.94Å; K2059-S2062 WeakPolarHBondContact CA-OG 3.34Å; K2059-S2062 PolarHBondContact O-N 3.3Å; K2059-S2062 PolarHBondContact O-OG 3.22Å; S2062-Q2064 PolarHBondContact O-N 2.91Å; S2062-T2065 WeakPolarHBondContact CA-OG1 3.21Å; S2062-T2065 PolarHBondContact O-N 3.47Å; S2062-T2065 PolarHBondContact O-OG1 3.11Å; S2062-D2066 PolarHBondContact O-N 2.94Å
2063	H	73.7	Confident	71	Confident	89 Å²	89	74.2 Å²	74.2	41%	0.412	39%	0.389	S	S	.	.	H	α-helix	trans	-63.4	-24.9	174.2	-66	-41.4	0	0	0	113.4	K2059 I2060 K2061 D2066 V2067	K2059-H2063 PolarHBondContact O-CD2 3.04Å; K2059-H2063 VanDerWaalsContact O-CD2 3.27Å; K2059-H2063 PolarHBondContact O-N 3.23Å; I2060-H2063 PolarHBondContact O-N 2.84Å; K2061-H2063 VanDerWaalsContact C-N 3.34Å; K2061-H2063 PolarHBondContact O-N 3.17Å; H2063-D2066 IonicContact ND1-OD2 3.68Å; H2063-V2067 WeakPolarHBondContact O-CG2 3.34Å; H2063-V2067 PolarHBondContact O-N 3.48Å
2064	Q	67.6	Low	68.3	Low	55 Å²	55	81.6 Å²	81.6	26%	0.257	43%	0.429	S	S	.	.	H	α-helix	trans	-72.1	-38.8	170.8	-168.9	179.9	9	0	0	112.2	L2026 I2060 K2061 S2062 H2068	L2026-Q2064 HydrophobicContact CD2-CB 4.06Å; L2026-Q2064 HydrophobicContact CD2-CG 4.15Å; I2060-Q2064 PolarHBondContact O-N 2.59Å; K2061-Q2064 WeakPolarHBondContact O-CB 3.26Å; K2061-Q2064 PolarHBondContact O-N 2.93Å; K2061-Q2064 VanDerWaalsContact O-N 3.13Å; S2062-Q2064 PolarHBondContact O-N 2.91Å; Q2064-H2068 PolarHBondContact O-N 3.06Å
2065	T	60	Low	65.5	Low	81 Å²	81	86.3 Å²	86.3	50%	0.497	45%	0.454	S	S	.	.	H	α-helix	trans	-71.2	-33.1	176.6	50.3	0	0	0	0	112.8	K2061 S2062 V2067 T2069	K2061-T2065 PolarHBondContact O-N 3.4Å; S2062-T2065 WeakPolarHBondContact CA-OG1 3.21Å; S2062-T2065 PolarHBondContact O-N 3.47Å; S2062-T2065 PolarHBondContact O-OG1 3.11Å; T2065-V2067 VanDerWaalsContact C-N 3.3Å; T2065-V2067 PolarHBondContact O-N 2.83Å; T2065-T2069 WeakPolarHBondContact O-CB 3.46Å; T2065-T2069 WeakPolarHBondContact O-CG2 3.48Å; T2065-T2069 PolarHBondContact O-N 3.25Å; T2065-T2069 PolarHBondContact O-OG1 3.07Å
2066	D	58.3	Low	63	Low	84 Å²	84	89.4 Å²	89.4	45%	0.449	47%	0.471	S	S	.	.	H	α-helix	trans	-69.7	-27.9	178.4	-59.9	-22	0	0	0	112.3	S2062 H2063 T2069 N2070	S2062-D2066 PolarHBondContact O-N 2.94Å; H2063-D2066 IonicContact ND1-OD2 3.68Å; D2066-T2069 PolarHBondContact O-OG1 2.99Å; D2066-N2070 PolarHBondContact O-ND2 2.84Å
2067	V	56.4	Low	60.3	Low	71 Å²	71	92.4 Å²	92.4	43%	0.43	49%	0.49	S	S	.	.	H	α-helix	trans	-73.7	-55.2	171.8	172.2	0	0	0	0	110.6	H2063 T2065 T2069 N2070 E2071	H2063-V2067 WeakPolarHBondContact O-CG2 3.34Å; H2063-V2067 PolarHBondContact O-N 3.48Å; T2065-V2067 VanDerWaalsContact C-N 3.3Å; T2065-V2067 PolarHBondContact O-N 2.83Å; V2067-T2069 VanDerWaalsContact C-N 3.28Å; V2067-T2069 PolarHBondContact O-N 3.48Å; V2067-N2070 PolarHBondContact O-N 3.32Å; V2067-E2071 PolarHBondContact O-N 2.88Å
2068	H	52.1	Low	57.3	Low	104 Å²	104	96.5 Å²	96.5	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-67.4	-21.9	-176.7	-74.7	-42	0	0	0	114.6	Q2064 N2070 E2071	Q2064-H2068 PolarHBondContact O-N 3.06Å; H2068-N2070 VanDerWaalsContact C-N 3.33Å; H2068-E2071 IonicContact CE1-OE2 2.72Å; H2068-E2071 IonicContact CG-OE2 3.99Å; H2068-E2071 IonicContact ND1-OE2 2.66Å; H2068-E2071 PolarHBondContact ND1-OE2 3.15Å
2069	T	49.3	Very low	54.2	Low	96 Å²	96	98.6 Å²	98.6	59%	0.589	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-20.1	173.2	46.5	0	0	0	0	113.4	T2065 D2066 V2067	T2065-T2069 WeakPolarHBondContact O-CB 3.46Å; T2065-T2069 WeakPolarHBondContact O-CG2 3.48Å; T2065-T2069 PolarHBondContact O-N 3.25Å; T2065-T2069 PolarHBondContact O-OG1 3.07Å; D2066-T2069 PolarHBondContact O-OG1 2.99Å; V2067-T2069 VanDerWaalsContact C-N 3.28Å; V2067-T2069 PolarHBondContact O-N 3.48Å
2070	N	42.8	Very low	51.3	Low	121 Å²	121	101.9 Å²	101.9	65%	0.647	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-22	174.4	-77.5	-71.2	0	0	0	113.4	D2066 V2067 H2068 N2072 N2073	D2066-N2070 PolarHBondContact O-ND2 2.84Å; V2067-N2070 PolarHBondContact O-N 3.32Å; H2068-N2070 VanDerWaalsContact C-N 3.33Å; N2070-N2072 PolarHBondContact O-N 2.73Å; N2070-N2073 PolarHBondContact O-N 2.85Å
2071	E	43.3	Very low	48.5	Very low	127 Å²	127	107.6 Å²	107.6	59%	0.593	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-14.1	178.2	-70.9	-179.5	135.4	0	0	114.2	V2067 H2068	V2067-E2071 PolarHBondContact O-N 2.88Å; H2068-E2071 IonicContact CE1-OE2 2.72Å; H2068-E2071 IonicContact CG-OE2 3.99Å; H2068-E2071 IonicContact ND1-OE2 2.66Å; H2068-E2071 PolarHBondContact ND1-OE2 3.15Å
2072	N	39.4	Very low	45.6	Very low	149 Å²	149	109.9 Å²	109.9	80%	0.797	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	13.4	177.8	-90.5	-23.3	0	0	0	114.6	N2070	N2070-N2072 PolarHBondContact O-N 2.73Å
2073	N	37.2	Very low	43	Very low	130 Å²	130	112.6 Å²	112.6	70%	0.695	62%	0.62	S	S	*	*	S	Bend	trans	-131.6	128	166.9	-88.6	-50.3	0	0	0	111.1	N2070	N2070-N2073 PolarHBondContact O-N 2.85Å
2074	N	37.2	Very low	41.3	Very low	156 Å²	156	115.2 Å²	115.2	83%	0.834	63%	0.63	S	S	*	*			trans	71	87.4	174.6	-57.7	-25.7	0	0	0	118	N2076	N2074-N2076 PolarHBondContact O-N 3.21Å
2075	N	33.8	Very low	39.4	Very low	164 Å²	164	116.2 Å²	116.2	88%	0.877	64%	0.644	S	S	*	*			trans	-71.9	108.3	152.4	-83.2	-45.3	0	0	0	110.7
2076	N	39.4	Very low	37.9	Very low	140 Å²	140	117.2 Å²	117.2	75%	0.749	65%	0.654	S	S	*	*			trans	-168.5	103.4	133.5	-105.4	-22.7	0	0	0	115.1	N2074	N2074-N2076 PolarHBondContact O-N 3.21Å
2077	T	35.8	Very low	36.4	Very low	72 Å²	72	120 Å²	120	44%	0.442	67%	0.674	S	S	.	*			trans	58.6	103.4	136.5	61	0	0	0	0	121.2	N2410	T2077-N2410 PolarHBondContact OG1-ND2 2.83Å
2078	N	31	Very low	35.2	Very low	97 Å²	97	121.1 Å²	121.1	52%	0.519	68%	0.681	S	S	.	*				114.5	119.5	122.7	-62.2	-14	0	0	0	120
2079	N	27.3	Very low	34.3	Very low	131 Å²	131	122 Å²	122	70%	0.701	69%	0.686	S	S	*	*			trans	65.2	88.6	147.4	-61.7	-14.8	0	0	0	119.2
2080	T	29	Very low	33.7	Very low	139 Å²	139	121 Å²	121	85%	0.853	67%	0.674	S	S	*	*			trans	-154.2	141.8	135.3	-5.7	0	0	0	0	110.8	T2082	T2080-T2082 PolarHBondContact O-N 2.99Å
2081	T	28.8	Very low	33.5	Very low	132 Å²	132	119.9 Å²	119.9	81%	0.81	67%	0.672	S	S	*	*			trans	-76.5	103.8	177.7	-52.8	0	0	0	0	109.5	T2083	T2081-T2083 PolarHBondContact O-N 3.04Å
2082	T	30.5	Very low	33.7	Very low	119 Å²	119	116.8 Å²	116.8	73%	0.73	66%	0.659	S	S	*	*			trans	-65.8	96.2	-179.5	34.7	0	0	0	0	111.3	T2080 F2084	T2080-T2082 PolarHBondContact O-N 2.99Å; T2082-F2084 PolarHBondContact O-N 2.78Å
2083	T	30.5	Very low	34.6	Very low	108 Å²	108	111.7 Å²	111.7	66%	0.663	64%	0.635	S	S	*	*			trans	-76.5	106.4	171.6	-60.1	0	0	0	0	108.3	T2081 S2085	T2081-T2083 PolarHBondContact O-N 3.04Å; T2083-S2085 PolarHBondContact O-N 3.24Å
2084	F	37.3	Very low	35.9	Very low	143 Å²	143	108.3 Å²	108.3	63%	0.627	62%	0.615	S	S	*	*			trans	-63.7	92.5	172.6	-78	-91.2	0	0	0	110	T2082	T2082-F2084 PolarHBondContact O-N 2.78Å
2085	S	27.3	Very low	38.1	Very low	77 Å²	77	103.1 Å²	103.1	54%	0.538	59%	0.587	S	S	.	*			trans	-157.8	138.5	178.1	-70.2	0	0	0	0	112.4	T2083	T2083-S2085 PolarHBondContact O-N 3.24Å
2086	S	28.9	Very low	40.9	Very low	101 Å²	101	96.3 Å²	96.3	71%	0.706	55%	0.551	S	S	*	*	S	Bend	trans	55.2	73.2	157.9	61	0	0	0	0	119.9
2087	T	27.3	Very low	43.6	Very low	142 Å²	142	89.6 Å²	89.6	87%	0.871	52%	0.515	S	S	*	.			trans	-153.2	37.4	147.6	10.8	0	0	0	0	114.7
2088	T	31.5	Very low	46.5	Very low	95 Å²	95	86.2 Å²	86.2	58%	0.583	49%	0.494	S	S	*	.			trans	-125.3	68.8	173.9	41.6	0	0	0	0	110.9
2089	H	33.6	Very low	49.6	Very low	124 Å²	124	81.6 Å²	81.6	57%	0.574	47%	0.469	S	S	*	.			trans	-99	140.9	-172	-109.6	-108	0	0	0	113.7	T2091	H2089-T2091 PolarHBondContact O-N 3.19Å
2090	E	36.1	Very low	52.8	Low	73 Å²	73	75.5 Å²	75.5	34%	0.341	44%	0.437	S	S	.	.	S	Bend	trans	78.2	-12.7	163.6	-52.5	-156.2	146.8	0	0	121.8	M2299 I2300	E2090-M2299 WeakPolarHBondContact OE1-CA 3.21Å; E2090-M2299 WeakPolarHBondContact OE2-CA 3.17Å; E2090-M2299 WeakPolarHBondContact OE2-CE 3.22Å; E2090-M2299 WeakPolarHBondContact OE2-CG 3.41Å; E2090-I2300 PolarHBondContact OE1-N 2.88Å
2091	T	38.1	Very low	56	Low	99 Å²	99	69.1 Å²	69.1	61%	0.607	40%	0.397	S	S	*	.	S	Bend	trans	-124.9	-18.2	172.2	48.5	0	0	0	0	116.8	H2089	H2089-T2091 PolarHBondContact O-N 3.19Å
2092	D	48.4	Very low	59.2	Low	62 Å²	62	63 Å²	63	33%	0.332	36%	0.359	S	S	.	.	S	Bend	trans	-95.3	-5.2	-169.4	-67	-63.7	0	0	0	115.5	K2059	K2059-D2092 IonicContact NZ-OD1 3.51Å; K2059-D2092 PolarHBondContact NZ-OD1 3.18Å
2093	S	58.3	Low	62.3	Low	41 Å²	41	57.3 Å²	57.3	29%	0.287	33%	0.325	S	S	.	.	S	Bend	trans	-82.7	-20.6	-177.8	65.3	0	0	0	0	114.9	D2095 I2096 H2165	S2093-D2095 PolarHBondContact O-N 3.18Å; S2093-D2095 VanDerWaalsContact O-N 3.15Å; S2093-I2096 PolarHBondContact O-N 3.1Å; S2093-H2165 PolarHBondContact O-CD2 3.17Å
2094	E	64.3	Low	65.5	Low	59 Å²	59	52.2 Å²	52.2	28%	0.276	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23	-170.2	-48.4	-145.8	145.5	0	0	114.1	Q1869 R1870 R2052	Q1869-E2094 VanDerWaalsContact NE2-CG 3.3Å; Q1869-E2094 PolarHBondContact NE2-OE1 2.85Å; R1870-E2094 VanDerWaalsContact CD-OE1 3.3Å; R1870-E2094 WeakPolarHBondContact CD-OE1 3.21Å; R1870-E2094 IonicContact CZ-OE1 2.71Å; R1870-E2094 IonicContact NE-OE1 3.26Å; R1870-E2094 IonicContact NH1-OE1 2.73Å; R1870-E2094 PolarHBondContact NH1-OE1 3.26Å; R1870-E2094 IonicContact NH1-OE2 3.16Å; R1870-E2094 PolarHBondContact NH1-OE2 2.83Å; R2052-E2094 PolarHBondContact NH2-O 3.02Å
2095	D	82.7	Confident	68.2	Low	47 Å²	47	47 Å²	47	25%	0.251	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	16.5	-175.3	-71.1	-45.4	0	0	0	114.3	R2052 W2056 S2093 P2097 F2164	R2052-D2095 IonicContact CZ-OD1 3.19Å; R2052-D2095 IonicContact NE-OD1 2.67Å; R2052-D2095 PolarHBondContact NE-OD1 2.8Å; R2052-D2095 IonicContact NH2-OD1 3.3Å; R2052-D2095 PolarHBondContact NH2-OD1 2.94Å; W2056-D2095 WeakPolarHBondContact CB-O 3.5Å; S2093-D2095 PolarHBondContact O-N 3.18Å; S2093-D2095 VanDerWaalsContact O-N 3.15Å; D2095-P2097 VanDerWaalsContact O-CD 3.31Å; D2095-P2097 WeakPolarHBondContact O-CD 3.21Å; D2095-F2164 WeakPolarHBondContact O-CD1 3.33Å
2096	I	93.6	Very high	71.4	Confident	21 Å²	21	44 Å²	44	11%	0.108	25%	0.25	C	S	.	.			trans	-77.4	117.5	172.8	-51.5	169.5	0	0	0	109.8	V2019 Q2021 W2056 S2093 G2098 F2164 H2165	V2019-I2096 HydrophobicContact CB-CG2 4.02Å; V2019-I2096 HydrophobicContact CG1-CG2 3.59Å; Q2021-I2096 HydrophobicContact CG-CG2 4.04Å; W2056-I2096 HydrophobicContact CZ2-CG2 4.38Å; S2093-I2096 PolarHBondContact O-N 3.1Å; I2096-G2098 PolarHBondContact O-N 2.71Å; I2096-F2164 VanDerWaalsContact O-CA 3.28Å; I2096-F2164 WeakPolarHBondContact O-CA 3.18Å; I2096-F2164 WeakPolarHBondContact O-CB 3.21Å; I2096-H2165 PolarHBondContact O-N 2.86Å
2097	P	95.6	Very high	74.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	123.4	178.9	30.4	-34.7	0	0	0	111.1	I2036 V2053 W2056 D2095 V2162 F2164 L2182 N2183	I2036-P2097 HydrophobicContact CG2-CG 4.08Å; V2053-P2097 HydrophobicContact CG1-CG 4.23Å; V2053-P2097 HydrophobicContact CG2-CB 4.05Å; V2053-P2097 HydrophobicContact CG2-CG 4.19Å; W2056-P2097 HydrophobicContact CD2-CG 4.22Å; W2056-P2097 HydrophobicContact CE3-CG 3.82Å; W2056-P2097 HydrophobicContact CH2-CG 4.14Å; W2056-P2097 HydrophobicContact CZ3-CG 3.76Å; D2095-P2097 VanDerWaalsContact O-CD 3.31Å; D2095-P2097 WeakPolarHBondContact O-CD 3.21Å; P2097-V2162 HydrophobicContact CB-CG1 4.12Å; P2097-F2164 HydrophobicContact CB-CD1 4.17Å; P2097-F2164 HydrophobicContact CB-CE1 4.06Å; P2097-L2182 HydrophobicContact CB-CD1 4.22Å; P2097-N2183 PolarHBondContact O-ND2 3.42Å
2098	G	95.8	Very high	77.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-61.5	-179.7	0	0	0	0	0	113	I2096 Q2163 L2182 N2183 C2185	I2096-G2098 PolarHBondContact O-N 2.71Å; G2098-Q2163 WeakPolarHBondContact CA-O 3.31Å; G2098-Q2163 PolarHBondContact N-O 3.03Å; G2098-L2182 WeakPolarHBondContact O-CB 3.23Å; G2098-L2182 PolarHBondContact O-N 3.2Å; G2098-N2183 PolarHBondContact O-N 2.92Å; G2098-C2185 VanDerWaalsContact CA-SG 3.55Å; G2098-C2185 PolarHBondContact O-SG 2.86Å
2099	A	95.9	Very high	80.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	147.9	-172.2	0	0	0	0	0	113.4	M2016 Q2163 V2179	M2016-A2099 HydrophobicContact CE-CB 3.94Å; A2099-Q2163 PolarHBondContact N-O 3.03Å; A2099-Q2163 VanDerWaalsContact N-O 3.08Å; A2099-Q2163 PolarHBondContact O-N 3.26Å; A2099-V2179 HydrophobicContact CB-CG1 4Å
2100	L	95.3	Very high	83.3	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.4	169.5	-179.6	63.9	0	0	0	109.5	L2040 A2043 I2045 T2160 V2162 R2180 L2182	L2040-L2100 HydrophobicContact CD2-CD1 3.88Å; L2040-L2100 HydrophobicContact CD2-CD2 4.33Å; L2040-L2100 HydrophobicContact CD2-CG 4.48Å; A2043-L2100 HydrophobicContact CB-CD2 4.08Å; I2045-L2100 HydrophobicContact CG2-CD1 4.42Å; L2100-T2160 HydrophobicContact CD1-CG2 3.65Å; L2100-V2162 HydrophobicContact CD1-CG2 4.15Å; L2100-R2180 PolarHBondContact N-O 2.94Å; L2100-R2180 PolarHBondContact O-N 3.34Å; L2100-L2182 HydrophobicContact CB-CD1 4.41Å; L2100-L2182 HydrophobicContact CB-CD2 4.22Å; L2100-L2182 HydrophobicContact CB-CG 4.37Å
2101	W	96.1	Very high	86.1	Confident	5 Å²	5	28.8 Å²	28.8	2%	0.019	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	145.6	177.6	-68.9	73.3	0	0	0	110.5	N2014 I2103 T2160 I2161 I2171 H2177 Q2178 V2179 K2187	N2014-W2101 HydrophobicContact CB-CH2 3.87Å; N2014-W2101 HydrophobicContact CB-CZ2 4.07Å; W2101-I2103 HydrophobicContact CE3-CD1 4.46Å; W2101-I2103 HydrophobicContact CE3-CG1 4.49Å; W2101-T2160 WeakPolarHBondContact O-CA 3.42Å; W2101-I2161 HydrophobicContact CB-CB 4.16Å; W2101-I2161 PolarHBondContact N-O 3.48Å; W2101-I2161 PolarHBondContact O-N 3.33Å; W2101-I2171 HydrophobicContact CE3-CD1 4.48Å; W2101-I2171 HydrophobicContact CH2-CD1 3.97Å; W2101-I2171 HydrophobicContact CZ3-CD1 3.52Å; W2101-I2171 HydrophobicContact CZ3-CG1 4.46Å; W2101-H2177 AromaticContact CE3-CD2 3.92Å; W2101-H2177 AromaticContact CZ3-CD2 3.48Å; W2101-H2177 VanDerWaalsContact CZ3-CD2 3.48Å; W2101-H2177 WeakPolarHBondContact CZ3-CD2 3.49Å; W2101-H2177 AromaticContact CZ3-NE2 3.84Å; W2101-Q2178 WeakPolarHBondContact CA-O 3.42Å; W2101-V2179 HydrophobicContact CD2-CB 4.48Å; W2101-V2179 HydrophobicContact CD2-CG1 4.14Å; W2101-V2179 HydrophobicContact CD2-CG2 3.7Å; W2101-V2179 HydrophobicContact CE3-CG2 3.49Å; W2101-V2179 VanDerWaalsContact CE3-CG2 3.49Å; W2101-V2179 HydrophobicContact CG-CG1 4.42Å; W2101-V2179 HydrophobicContact CH2-CG2 3.68Å; W2101-V2179 HydrophobicContact CZ2-CG1 4.13Å; W2101-V2179 HydrophobicContact CZ2-CG2 3.89Å; W2101-V2179 HydrophobicContact CZ3-CG2 3.47Å; W2101-V2179 VanDerWaalsContact CZ3-CG2 3.47Å; W2101-K2187 HydrophobicContact CZ2-CD 4.37Å
2102	H	95.8	Very high	88.8	Confident	3 Å²	3	24.1 Å²	24.1	1%	0.014	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	118.3	164.6	-53.2	91.2	0	0	0	107.3	P2158 H2177 Q2178	H2102-P2158 HydrophobicContact CB-CB 3.77Å; H2102-P2158 HydrophobicContact CB-CG 4Å; H2102-H2177 VanDerWaalsContact O-CA 3.27Å; H2102-H2177 WeakPolarHBondContact O-CA 3.43Å; H2102-Q2178 HydrophobicContact CB-CG 3.81Å; H2102-Q2178 PolarHBondContact N-O 2.84Å; H2102-Q2178 VanDerWaalsContact N-O 3.13Å; H2102-Q2178 PolarHBondContact ND1-NE2 2.7Å; H2102-Q2178 PolarHBondContact O-N 2.9Å
2103	I	96.6	Very high	91	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131.2	-179.3	-53.6	-178.7	0	0	0	108.6	P1862 W2101 P2158 C2159 I2161 V2169 I2171 A2175 H2177	P1862-I2103 HydrophobicContact CB-CD1 3.83Å; P1862-I2103 HydrophobicContact CB-CG2 4.3Å; P1862-I2103 HydrophobicContact CG-CB 4.49Å; P1862-I2103 HydrophobicContact CG-CD1 4.41Å; P1862-I2103 HydrophobicContact CG-CG2 4.28Å; W2101-I2103 HydrophobicContact CE3-CD1 4.46Å; W2101-I2103 HydrophobicContact CE3-CG1 4.49Å; I2103-P2158 CarbonylContact O-C 3.47Å; I2103-P2158 VanDerWaalsContact O-CA 3.28Å; I2103-P2158 WeakPolarHBondContact O-CA 3.47Å; I2103-P2158 WeakPolarHBondContact O-CB 3.32Å; I2103-C2159 HydrophobicContact CB-CB 4.43Å; I2103-C2159 PolarHBondContact N-O 3.43Å; I2103-C2159 PolarHBondContact O-N 3.4Å; I2103-I2161 HydrophobicContact CD1-CD1 4.11Å; I2103-V2169 HydrophobicContact CD1-CG1 3.94Å; I2103-I2171 HydrophobicContact CD1-CG1 4.44Å; I2103-A2175 HydrophobicContact CG2-CB 3.94Å; I2103-H2177 HydrophobicContact CB-CB 4.27Å; I2103-H2177 HydrophobicContact CG1-CB 3.94Å; I2103-H2177 HydrophobicContact CG2-CB 4.28Å
2104	F	96.5	Very high	92.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.			trans	-105.7	137.4	174.8	-61.5	-88.5	0	0	0	109.3	L2005 D2108 L2112 M2142 L2147 L2150 I2156 P2158 A2175 A2176	L2005-F2104 HydrophobicContact CD1-CD2 3.96Å; L2005-F2104 HydrophobicContact CD1-CE2 3.96Å; F2104-D2108 HydrophobicContact CB-CB 4.46Å; F2104-L2112 HydrophobicContact CB-CD2 4.16Å; F2104-L2112 HydrophobicContact CD1-CD2 4.29Å; F2104-L2112 HydrophobicContact CD2-CD2 3.86Å; F2104-L2112 HydrophobicContact CE2-CD2 4.36Å; F2104-L2112 HydrophobicContact CG-CD2 3.83Å; F2104-M2142 HydrophobicContact CD2-CE 4.38Å; F2104-M2142 HydrophobicContact CE1-CE 4.48Å; F2104-M2142 HydrophobicContact CE2-CE 3.31Å; F2104-M2142 HydrophobicContact CZ-CE 3.37Å; F2104-L2147 HydrophobicContact CZ-CD2 3.8Å; F2104-L2150 HydrophobicContact CD1-CD2 4.46Å; F2104-L2150 HydrophobicContact CE1-CD2 3.48Å; F2104-L2150 VanDerWaalsContact CE1-CD2 3.48Å; F2104-L2150 HydrophobicContact CZ-CD2 3.84Å; F2104-I2156 HydrophobicContact CD1-CG2 3.56Å; F2104-I2156 HydrophobicContact CE1-CG2 3.74Å; F2104-P2158 HydrophobicContact CD1-CB 4.03Å; F2104-P2158 HydrophobicContact CD2-CB 4.37Å; F2104-P2158 HydrophobicContact CE1-CB 3.64Å; F2104-P2158 HydrophobicContact CE1-CG 4Å; F2104-P2158 HydrophobicContact CE2-CB 4Å; F2104-P2158 HydrophobicContact CG-CB 4.39Å; F2104-P2158 HydrophobicContact CZ-CB 3.63Å; F2104-P2158 HydrophobicContact CZ-CG 3.89Å; F2104-A2175 VanDerWaalsContact O-CA 3.31Å; F2104-A2175 WeakPolarHBondContact O-CA 3.27Å; F2104-A2175 WeakPolarHBondContact O-CB 3.2Å; F2104-A2176 HydrophobicContact CB-CB 4.46Å; F2104-A2176 WeakPolarHBondContact CB-O 3.44Å; F2104-A2176 WeakPolarHBondContact CD2-O 3.5Å; F2104-A2176 PolarHBondContact N-O 2.89Å; F2104-A2176 PolarHBondContact O-N 3.19Å
2105	L	94.4	Very high	94.1	Very high	35 Å²	35	23.2 Å²	23.2	18%	0.183	12%	0.121	C	C	.	.			trans	-64.9	148.4	177.9	-55.1	179.5	0	0	0	110.2	E2107 D2108	L2105-E2107 WeakPolarHBondContact CB-OE2 3.33Å; L2105-E2107 PolarHBondContact O-N 3.42Å; L2105-D2108 WeakPolarHBondContact O-CB 3.22Å; L2105-D2108 PolarHBondContact O-N 2.83Å
2106	P	94.3	Very high	94.7	Very high	13 Å²	13	21 Å²	21	8%	0.084	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-53.6	-32.3	-176.2	-27.7	35.5	0	0	0	114.4	N1860 D2108 S2109 A2175 Q2200	N1860-P2106 HydrophobicContact CB-CG 4.02Å; P2106-D2108 PolarHBondContact O-N 3.01Å; P2106-S2109 VanDerWaalsContact O-CB 3.29Å; P2106-S2109 WeakPolarHBondContact O-CB 3.48Å; P2106-S2109 PolarHBondContact O-N 2.99Å; P2106-S2109 PolarHBondContact O-OG 2.98Å; P2106-A2175 HydrophobicContact CG-CB 4.48Å; P2106-Q2200 HydrophobicContact CB-CG 4.32Å; P2106-Q2200 HydrophobicContact CG-CG 4.5Å
2107	E	92.7	Very high	94.5	Very high	106 Å²	106	22.1 Å²	22.1	50%	0.495	12%	0.119	S	C	.	.	G	3₁₀ helix	trans	-61.9	-29.2	177.7	-62.4	69.4	-152	0	0	113	N1860 L2105 S2109	N1860-E2107 PolarHBondContact ND2-OE1 2.86Å; L2105-E2107 WeakPolarHBondContact CB-OE2 3.33Å; L2105-E2107 PolarHBondContact O-N 3.42Å; E2107-S2109 VanDerWaalsContact C-N 3.33Å
2108	D	94.7	Very high	94.3	Very high	7 Å²	7	26.4 Å²	26.4	4%	0.037	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-79.8	-18.4	-174.9	-69.8	8.9	0	0	0	112.3	R1781 F2104 L2105 P2106 N2110 G2111 L2112 I2156	R1781-D2108 IonicContact CZ-OD1 2.74Å; R1781-D2108 VanDerWaalsContact CZ-OD1 3.3Å; R1781-D2108 IonicContact CZ-OD2 3.78Å; R1781-D2108 IonicContact NH1-OD1 2.74Å; R1781-D2108 PolarHBondContact NH1-OD1 3.37Å; R1781-D2108 IonicContact NH1-OD2 3.61Å; R1781-D2108 VanDerWaalsContact NH2-CG 3.29Å; R1781-D2108 IonicContact NH2-OD1 3.16Å; R1781-D2108 PolarHBondContact NH2-OD1 3.24Å; R1781-D2108 IonicContact NH2-OD2 2.88Å; R1781-D2108 PolarHBondContact NH2-OD2 2.9Å; F2104-D2108 HydrophobicContact CB-CB 4.46Å; L2105-D2108 WeakPolarHBondContact O-CB 3.22Å; L2105-D2108 PolarHBondContact O-N 2.83Å; P2106-D2108 PolarHBondContact O-N 3.01Å; D2108-N2110 PolarHBondContact O-N 2.94Å; D2108-G2111 PolarHBondContact O-N 2.92Å; D2108-L2112 WeakPolarHBondContact O-CB 3.27Å; D2108-L2112 PolarHBondContact O-N 2.9Å; D2108-I2156 HydrophobicContact CB-CD1 4.15Å; D2108-I2156 HydrophobicContact CB-CG1 4.26Å; D2108-I2156 HydrophobicContact CB-CG2 4.13Å; D2108-I2156 WeakPolarHBondContact OD2-CG2 3.06Å
2109	S	92.3	Very high	94	Very high	11 Å²	11	26.5 Å²	26.5	8%	0.077	14%	0.136	C	C	.	.	H	α-helix	trans	-48.9	-38.7	-173.9	-58.4	0	0	0	0	113.9	P2106 E2107 R2113	P2106-S2109 VanDerWaalsContact O-CB 3.29Å; P2106-S2109 WeakPolarHBondContact O-CB 3.48Å; P2106-S2109 PolarHBondContact O-N 2.99Å; P2106-S2109 PolarHBondContact O-OG 2.98Å; E2107-S2109 VanDerWaalsContact C-N 3.33Å; S2109-R2113 WeakPolarHBondContact O-CB 3.44Å; S2109-R2113 WeakPolarHBondContact O-CD 3.18Å; S2109-R2113 WeakPolarHBondContact O-CG 3.48Å; S2109-R2113 PolarHBondContact O-N 2.79Å
2110	N	92.3	Very high	93.6	Very high	67 Å²	67	27.1 Å²	27.1	36%	0.358	14%	0.14	S	C	.	.	H	α-helix	trans	-75.9	-38.4	-178	-69.2	-38.9	0	0	0	113.1	L1677 D2108 L2112 R2113 E2114	L1677-N2110 WeakPolarHBondContact CD1-ND2 3.43Å; D2108-N2110 PolarHBondContact O-N 2.94Å; N2110-L2112 VanDerWaalsContact C-N 3.34Å; N2110-R2113 PolarHBondContact OD1-NH1 2.78Å; N2110-E2114 PolarHBondContact O-N 3.3Å; N2110-E2114 VanDerWaalsContact O-N 3.12Å
2111	G	94.8	Very high	93.2	Very high	25 Å²	25	31.9 Å²	31.9	26%	0.258	16%	0.162	S	C	.	.	H	α-helix	trans	-69	-36.6	172.5	0	0	0	0	0	111.7	D2108 E2114 F2115	D2108-G2111 PolarHBondContact O-N 2.92Å; G2111-E2114 PolarHBondContact O-N 3.15Å; G2111-F2115 WeakPolarHBondContact O-CB 3.49Å; G2111-F2115 PolarHBondContact O-N 3.06Å
2112	L	95.5	Very high	92.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-45.8	174.9	-175.2	54.4	0	0	0	111.9	L2005 F2104 D2108 N2110 E2114 F2115 L2116 I2135 M2142 L2150 A2176	L2005-L2112 HydrophobicContact CD1-CD2 4.41Å; L2005-L2112 HydrophobicContact CD2-CD1 4.37Å; L2005-L2112 HydrophobicContact CD2-CD2 4Å; L2005-L2112 HydrophobicContact CD2-CG 4.25Å; F2104-L2112 HydrophobicContact CB-CD2 4.16Å; F2104-L2112 HydrophobicContact CD1-CD2 4.29Å; F2104-L2112 HydrophobicContact CD2-CD2 3.86Å; F2104-L2112 HydrophobicContact CE2-CD2 4.36Å; F2104-L2112 HydrophobicContact CG-CD2 3.83Å; D2108-L2112 WeakPolarHBondContact O-CB 3.27Å; D2108-L2112 PolarHBondContact O-N 2.9Å; N2110-L2112 VanDerWaalsContact C-N 3.34Å; L2112-E2114 PolarHBondContact O-N 3.13Å; L2112-F2115 PolarHBondContact O-N 3.03Å; L2112-L2116 HydrophobicContact CD1-CD1 4.02Å; L2112-L2116 HydrophobicContact CD1-CG 4.18Å; L2112-L2116 HydrophobicContact CG-CD1 3.98Å; L2112-L2116 WeakPolarHBondContact O-CB 3.22Å; L2112-L2116 VanDerWaalsContact O-CG 3.27Å; L2112-L2116 WeakPolarHBondContact O-CG 3.34Å; L2112-L2116 PolarHBondContact O-N 3Å; L2112-I2135 HydrophobicContact CB-CD1 4.37Å; L2112-I2135 HydrophobicContact CD2-CD1 4.02Å; L2112-I2135 HydrophobicContact CG-CD1 3.98Å; L2112-M2142 HydrophobicContact CD1-CE 3.91Å; L2112-M2142 HydrophobicContact CD1-SD 3.86Å; L2112-L2150 HydrophobicContact CD1-CD1 4.17Å; L2112-L2150 HydrophobicContact CD1-CD2 3.84Å; L2112-A2176 HydrophobicContact CD2-CB 4.03Å
2113	R	93.4	Very high	92	Very high	31 Å²	31	41.8 Å²	41.8	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-56.2	-46.5	170.9	-79	165	169.6	143	4.6	112.8	S2109 N2110 L2116 S2117 D2133 I2135 H2136 E2207	S2109-R2113 WeakPolarHBondContact O-CB 3.44Å; S2109-R2113 WeakPolarHBondContact O-CD 3.18Å; S2109-R2113 WeakPolarHBondContact O-CG 3.48Å; S2109-R2113 PolarHBondContact O-N 2.79Å; N2110-R2113 PolarHBondContact OD1-NH1 2.78Å; R2113-L2116 PolarHBondContact O-N 2.71Å; R2113-S2117 VanDerWaalsContact O-CB 3.31Å; R2113-S2117 WeakPolarHBondContact O-CB 3.45Å; R2113-S2117 PolarHBondContact O-N 2.73Å; R2113-S2117 PolarHBondContact O-OG 2.95Å; R2113-D2133 IonicContact CZ-OD2 3.71Å; R2113-D2133 VanDerWaalsContact CZ-OD2 3.25Å; R2113-D2133 IonicContact NE-OD1 3.3Å; R2113-D2133 IonicContact NE-OD2 2.78Å; R2113-D2133 PolarHBondContact NE-OD2 3.15Å; R2113-D2133 IonicContact NH2-OD2 3.4Å; R2113-D2133 PolarHBondContact NH2-OD2 2.73Å; R2113-I2135 HydrophobicContact CG-CD1 3.79Å; R2113-I2135 HydrophobicContact CG-CG1 4.22Å; R2113-H2136 PolarHBondContact NH2-NE2 3.29Å; R2113-E2207 IonicContact CZ-OE1 2.71Å; R2113-E2207 IonicContact CZ-OE2 3.34Å; R2113-E2207 IonicContact NH1-OE1 3.69Å; R2113-E2207 PolarHBondContact NH1-OE1 3.46Å; R2113-E2207 IonicContact NH1-OE2 3.1Å; R2113-E2207 PolarHBondContact NH1-OE2 2.77Å; R2113-E2207 IonicContact NH2-OE1 2.94Å; R2113-E2207 IonicContact NH2-OE2 2.69Å; R2113-E2207 PolarHBondContact NH2-OE2 3.36Å
2114	E	93	Very high	91	Very high	107 Å²	107	45.1 Å²	45.1	50%	0.5	23%	0.234	S	C	.	.	H	α-helix	trans	-67.1	-37.2	179.8	-156	-143.5	163.9	0	0	111.4	N2110 G2111 L2112 R2118	N2110-E2114 PolarHBondContact O-N 3.3Å; N2110-E2114 VanDerWaalsContact O-N 3.12Å; G2111-E2114 PolarHBondContact O-N 3.15Å; L2112-E2114 PolarHBondContact O-N 3.13Å; E2114-R2118 WeakPolarHBondContact O-CG 3.49Å; E2114-R2118 PolarHBondContact O-N 2.85Å; E2114-R2118 PolarHBondContact O-NE 2.78Å; E2114-R2118 IonicContact OE1-CZ 2.67Å; E2114-R2118 IonicContact OE1-NE 3.28Å; E2114-R2118 IonicContact OE1-NH1 3.55Å; E2114-R2118 PolarHBondContact OE1-NH1 3.07Å; E2114-R2118 IonicContact OE1-NH2 3.83Å; E2114-R2118 IonicContact OE2-CZ 3.4Å; E2114-R2118 IonicContact OE2-NH1 2.71Å; E2114-R2118 PolarHBondContact OE2-NH1 2.65Å; E2114-R2118 VanDerWaalsContact OE2-NH1 3.13Å; E2114-R2118 IonicContact OE2-NH2 3.1Å; E2114-R2118 PolarHBondContact OE2-NH2 2.93Å
2115	F	95.4	Very high	90	Very high	6 Å²	6	48.1 Å²	48.1	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-57.1	171.3	177.5	-102.2	0	0	0	111.4	G2111 L2112 S2117 R2118 V2119 M2142 L2146 R2149 L2150 C2153 T2154	G2111-F2115 WeakPolarHBondContact O-CB 3.49Å; G2111-F2115 PolarHBondContact O-N 3.06Å; L2112-F2115 PolarHBondContact O-N 3.03Å; F2115-S2117 VanDerWaalsContact C-N 3.29Å; F2115-S2117 PolarHBondContact O-N 3.32Å; F2115-R2118 CarbonylContact O-C 3.49Å; F2115-R2118 WeakPolarHBondContact O-CA 3.44Å; F2115-R2118 WeakPolarHBondContact O-CB 3.36Å; F2115-R2118 PolarHBondContact O-N 3.5Å; F2115-V2119 HydrophobicContact CD1-CG2 3.79Å; F2115-V2119 HydrophobicContact CD2-CG2 4.38Å; F2115-V2119 HydrophobicContact CE1-CG2 3.51Å; F2115-V2119 HydrophobicContact CE2-CG2 4.13Å; F2115-V2119 HydrophobicContact CG-CG2 4.23Å; F2115-V2119 HydrophobicContact CZ-CG2 3.7Å; F2115-V2119 VanDerWaalsContact O-CG2 3.3Å; F2115-V2119 WeakPolarHBondContact O-CG2 3.41Å; F2115-V2119 PolarHBondContact O-N 3.21Å; F2115-M2142 HydrophobicContact CE1-SD 4.46Å; F2115-L2146 WeakPolarHBondContact CZ-O 3.46Å; F2115-R2149 HydrophobicContact CE2-CB 4.45Å; F2115-R2149 HydrophobicContact CE2-CG 4.3Å; F2115-R2149 WeakPolarHBondContact CE2-O 3.19Å; F2115-R2149 HydrophobicContact CZ-CB 4.23Å; F2115-R2149 HydrophobicContact CZ-CG 4.46Å; F2115-L2150 HydrophobicContact CB-CD1 3.72Å; F2115-L2150 HydrophobicContact CD1-CB 4.13Å; F2115-L2150 HydrophobicContact CD1-CD1 3.66Å; F2115-L2150 HydrophobicContact CD1-CG 4.41Å; F2115-L2150 HydrophobicContact CD2-CB 4.48Å; F2115-L2150 HydrophobicContact CD2-CD1 4.07Å; F2115-L2150 HydrophobicContact CE1-CB 3.8Å; F2115-L2150 HydrophobicContact CE1-CD1 4.24Å; F2115-L2150 HydrophobicContact CE2-CB 4.19Å; F2115-L2150 HydrophobicContact CG-CB 4.44Å; F2115-L2150 HydrophobicContact CG-CD1 3.55Å; F2115-L2150 HydrophobicContact CZ-CB 3.83Å; F2115-C2153 HydrophobicContact CD2-CB 4.25Å; F2115-C2153 HydrophobicContact CE2-CB 4.34Å; F2115-T2154 HydrophobicContact CB-CG2 4.42Å
2116	L	93.9	Very high	89	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-36.1	-176.9	-67.5	168.1	0	0	0	112.9	L2005 L2112 R2113 V2119 S2120 P2134 I2135 F2140 M2142	L2005-L2116 HydrophobicContact CD2-CD1 3.46Å; L2005-L2116 VanDerWaalsContact CD2-CD1 3.46Å; L2112-L2116 HydrophobicContact CD1-CD1 4.02Å; L2112-L2116 HydrophobicContact CD1-CG 4.18Å; L2112-L2116 HydrophobicContact CG-CD1 3.98Å; L2112-L2116 WeakPolarHBondContact O-CB 3.22Å; L2112-L2116 VanDerWaalsContact O-CG 3.27Å; L2112-L2116 WeakPolarHBondContact O-CG 3.34Å; L2112-L2116 PolarHBondContact O-N 3Å; R2113-L2116 PolarHBondContact O-N 2.71Å; L2116-V2119 WeakPolarHBondContact O-CB 3.41Å; L2116-V2119 PolarHBondContact O-N 2.8Å; L2116-S2120 WeakPolarHBondContact O-CB 3.26Å; L2116-S2120 PolarHBondContact O-N 2.87Å; L2116-P2134 HydrophobicContact CB-CB 3.94Å; L2116-P2134 HydrophobicContact CB-CG 3.74Å; L2116-P2134 HydrophobicContact CD1-CB 4.47Å; L2116-P2134 HydrophobicContact CD1-CG 4.41Å; L2116-I2135 HydrophobicContact CD1-CD1 4.38Å; L2116-I2135 HydrophobicContact CD1-CG1 3.79Å; L2116-F2140 HydrophobicContact CB-CD2 4.47Å; L2116-F2140 HydrophobicContact CD2-CB 4.01Å; L2116-F2140 HydrophobicContact CD2-CD1 4.24Å; L2116-F2140 HydrophobicContact CD2-CD2 4.13Å; L2116-F2140 HydrophobicContact CD2-CG 3.86Å; L2116-M2142 HydrophobicContact CD2-CG 4.29Å; L2116-M2142 HydrophobicContact CD2-SD 4.02Å
2117	S	90.9	Very high	88.3	Confident	43 Å²	43	53.4 Å²	53.4	30%	0.301	30%	0.299	S	S	.	.	H	α-helix	trans	-62.4	-42.6	173.9	-58.7	0	0	0	0	111.7	R2113 F2115 S2120 E2121	R2113-S2117 VanDerWaalsContact O-CB 3.31Å; R2113-S2117 WeakPolarHBondContact O-CB 3.45Å; R2113-S2117 PolarHBondContact O-N 2.73Å; R2113-S2117 PolarHBondContact O-OG 2.95Å; F2115-S2117 VanDerWaalsContact C-N 3.29Å; F2115-S2117 PolarHBondContact O-N 3.32Å; S2117-S2120 PolarHBondContact O-N 2.71Å; S2117-E2121 PolarHBondContact O-N 3.42Å
2118	R	90.5	Very high	87.5	Confident	90 Å²	90	50 Å²	50	34%	0.34	29%	0.286	S	S	.	.	H	α-helix	trans	-69.5	-33.9	173.8	-71	174.9	-69.5	-160.4	3.6	112.2	E2114 F2115 N2122	E2114-R2118 WeakPolarHBondContact O-CG 3.49Å; E2114-R2118 PolarHBondContact O-N 2.85Å; E2114-R2118 PolarHBondContact O-NE 2.78Å; E2114-R2118 IonicContact OE1-CZ 2.67Å; E2114-R2118 IonicContact OE1-NE 3.28Å; E2114-R2118 IonicContact OE1-NH1 3.55Å; E2114-R2118 PolarHBondContact OE1-NH1 3.07Å; E2114-R2118 IonicContact OE1-NH2 3.83Å; E2114-R2118 IonicContact OE2-CZ 3.4Å; E2114-R2118 IonicContact OE2-NH1 2.71Å; E2114-R2118 PolarHBondContact OE2-NH1 2.65Å; E2114-R2118 VanDerWaalsContact OE2-NH1 3.13Å; E2114-R2118 IonicContact OE2-NH2 3.1Å; E2114-R2118 PolarHBondContact OE2-NH2 2.93Å; F2115-R2118 CarbonylContact O-C 3.49Å; F2115-R2118 WeakPolarHBondContact O-CA 3.44Å; F2115-R2118 WeakPolarHBondContact O-CB 3.36Å; F2115-R2118 PolarHBondContact O-N 3.5Å; R2118-N2122 VanDerWaalsContact O-CB 3.31Å; R2118-N2122 WeakPolarHBondContact O-CB 3.46Å; R2118-N2122 PolarHBondContact O-N 2.8Å; R2118-N2122 VanDerWaalsContact O-N 3.07Å; R2118-N2122 PolarHBondContact O-ND2 2.79Å
2119	V	90.2	Very high	86.7	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-61.4	-50.6	171.9	176.8	0	0	0	0	110	F2115 L2116 E2121 N2122 E2123 F2140 L2146	F2115-V2119 HydrophobicContact CD1-CG2 3.79Å; F2115-V2119 HydrophobicContact CD2-CG2 4.38Å; F2115-V2119 HydrophobicContact CE1-CG2 3.51Å; F2115-V2119 HydrophobicContact CE2-CG2 4.13Å; F2115-V2119 HydrophobicContact CG-CG2 4.23Å; F2115-V2119 HydrophobicContact CZ-CG2 3.7Å; F2115-V2119 VanDerWaalsContact O-CG2 3.3Å; F2115-V2119 WeakPolarHBondContact O-CG2 3.41Å; F2115-V2119 PolarHBondContact O-N 3.21Å; L2116-V2119 WeakPolarHBondContact O-CB 3.41Å; L2116-V2119 PolarHBondContact O-N 2.8Å; V2119-E2121 PolarHBondContact O-N 3.46Å; V2119-N2122 PolarHBondContact O-N 3.32Å; V2119-E2123 HydrophobicContact CG1-CG 4.49Å; V2119-E2123 WeakPolarHBondContact O-CB 3.48Å; V2119-E2123 PolarHBondContact O-N 2.85Å; V2119-F2140 HydrophobicContact CG1-CE1 3.99Å; V2119-L2146 HydrophobicContact CG1-CD2 4.11Å; V2119-L2146 HydrophobicContact CG2-CD2 4.49Å
2120	S	86.8	Confident	85.5	Confident	14 Å²	14	63.4 Å²	63.4	10%	0.098	36%	0.362	C	S	.	.	H	α-helix	trans	-54.4	-52.8	177.8	-165.4	0	0	0	0	111.9	L2116 S2117 N2122 T2124 T2126	L2116-S2120 WeakPolarHBondContact O-CB 3.26Å; L2116-S2120 PolarHBondContact O-N 2.87Å; S2117-S2120 PolarHBondContact O-N 2.71Å; S2120-N2122 PolarHBondContact O-N 3.35Å; S2120-T2124 WeakPolarHBondContact O-CB 3.41Å; S2120-T2124 PolarHBondContact O-N 3.1Å; S2120-T2124 PolarHBondContact O-OG1 3.4Å; S2120-T2126 CarbonylContact C-O 3.28Å
2121	E	86.9	Confident	84.5	Confident	102 Å²	102	62.5 Å²	62.5	48%	0.477	37%	0.369	S	S	.	.	H	α-helix	trans	-62.2	-45.7	-178.1	-173.2	172.8	-149.7	0	0	112.5	S2117 V2119 G2125 P2127	S2117-E2121 PolarHBondContact O-N 3.42Å; V2119-E2121 PolarHBondContact O-N 3.46Å; E2121-G2125 VanDerWaalsContact O-CA 3.31Å; E2121-G2125 WeakPolarHBondContact O-CA 3.37Å; E2121-G2125 PolarHBondContact O-N 3.29Å; E2121-P2127 HydrophobicContact CB-CB 4.45Å; E2121-P2127 HydrophobicContact CG-CB 4.22Å
2122	N	86.1	Confident	83.7	Confident	131 Å²	131	63.1 Å²	63.1	70%	0.701	37%	0.369	S	S	*	.	H	α-helix	trans	-71.4	-35.6	-177.5	-75.7	-57.5	0	0	0	113.7	R2118 V2119 S2120	R2118-N2122 VanDerWaalsContact O-CB 3.31Å; R2118-N2122 WeakPolarHBondContact O-CB 3.46Å; R2118-N2122 PolarHBondContact O-N 2.8Å; R2118-N2122 VanDerWaalsContact O-N 3.07Å; R2118-N2122 PolarHBondContact O-ND2 2.79Å; V2119-N2122 PolarHBondContact O-N 3.32Å; S2120-N2122 PolarHBondContact O-N 3.35Å
2123	E	81.6	Confident	83.4	Confident	86 Å²	86	64.1 Å²	64.1	40%	0.402	37%	0.374	S	S	.	.	H	α-helix	trans	-95.4	-42.5	-172.4	-66.4	180	-165.5	0	0	112.5	L771 V2119 R2149	L771-E2123 WeakPolarHBondContact CD2-O 3.47Å; V2119-E2123 HydrophobicContact CG1-CG 4.49Å; V2119-E2123 WeakPolarHBondContact O-CB 3.48Å; V2119-E2123 PolarHBondContact O-N 2.85Å; E2123-R2149 IonicContact OE1-CZ 3.55Å; E2123-R2149 IonicContact OE1-NH1 3.56Å; E2123-R2149 PolarHBondContact OE1-NH1 3.03Å; E2123-R2149 IonicContact OE1-NH2 3.95Å; E2123-R2149 PolarHBondContact OE1-NH2 2.84Å
2124	T	74.5	Confident	83.2	Confident	71 Å²	71	62.8 Å²	62.8	44%	0.436	37%	0.37	S	S	.	.	H	α-helix	trans	-81.7	-20.6	177.7	74.5	0	0	0	0	113	S2120 T2126	S2120-T2124 WeakPolarHBondContact O-CB 3.41Å; S2120-T2124 PolarHBondContact O-N 3.1Å; S2120-T2124 PolarHBondContact O-OG1 3.4Å; T2124-T2126 PolarHBondContact O-N 2.96Å; T2124-T2126 PolarHBondContact OG1-N 3Å; T2124-T2126 VanDerWaalsContact OG1-N 3.12Å; T2124-T2126 PolarHBondContact OG1-O 3.4Å; T2124-T2126 PolarHBondContact OG1-OG1 3.42Å
2125	G	76.4	Confident	83.2	Confident	63 Å²	63	57.8 Å²	57.8	65%	0.649	35%	0.346	S	S	*	.	S	Bend	trans	75	6.8	-170.8	0	0	0	0	0	113.9	E2121	E2121-G2125 VanDerWaalsContact O-CA 3.31Å; E2121-G2125 WeakPolarHBondContact O-CA 3.37Å; E2121-G2125 PolarHBondContact O-N 3.29Å
2126	T	73.7	Confident	82.9	Confident	77 Å²	77	57.8 Å²	57.8	47%	0.472	35%	0.346	S	S	.	.	S	Bend	trans	-125.7	126	176.2	41.6	0	0	0	0	110.4	S2120 T2124	S2120-T2126 CarbonylContact C-O 3.28Å; T2124-T2126 PolarHBondContact O-N 2.96Å; T2124-T2126 PolarHBondContact OG1-N 3Å; T2124-T2126 VanDerWaalsContact OG1-N 3.12Å; T2124-T2126 PolarHBondContact OG1-O 3.4Å; T2124-T2126 PolarHBondContact OG1-OG1 3.42Å
2127	P	78.2	Confident	82.5	Confident	81 Å²	81	60.1 Å²	60.1	53%	0.526	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-65.9	154.9	169.9	29.9	-34.9	0	0	0	110.4	E2121	E2121-P2127 HydrophobicContact CB-CB 4.45Å; E2121-P2127 HydrophobicContact CG-CB 4.22Å
2128	V	77.2	Confident	82.5	Confident	34 Å²	34	62.1 Å²	62.1	21%	0.206	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-55.5	139.9	176.9	-178.6	0	0	0	0	110.4	S2132	V2128-S2132 WeakPolarHBondContact CG1-OG 3.37Å
2129	E	76.3	Confident	82.2	Confident	162 Å²	162	62.4 Å²	62.4	76%	0.757	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-63.5	145.9	-177.5	-66.7	-158.4	170.2	0	0	111.9	G2131 S2132	E2129-G2131 PolarHBondContact O-N 3.49Å; E2129-S2132 WeakPolarHBondContact O-CB 3.44Å; E2129-S2132 PolarHBondContact O-N 3.28Å
2130	S	68.9	Low	82.1	Confident	139 Å²	139	63.7 Å²	63.7	97%	0.972	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	88.3	-175.1	-62.2	0	0	0	0	112.5
2131	G	70.9	Confident	82.3	Confident	47 Å²	47	64.5 Å²	64.5	49%	0.485	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	125.5	3	-173.3	0	0	0	0	0	114.3	E2129	E2129-G2131 PolarHBondContact O-N 3.49Å
2132	S	78.3	Confident	82.5	Confident	39 Å²	39	59.7 Å²	59.7	27%	0.273	36%	0.356	S	S	.	.			trans	-94.5	151.6	165.7	166	0	0	0	0	110	V2128 E2129 D2137	V2128-S2132 WeakPolarHBondContact CG1-OG 3.37Å; E2129-S2132 WeakPolarHBondContact O-CB 3.44Å; E2129-S2132 PolarHBondContact O-N 3.28Å; S2132-D2137 VanDerWaalsContact CA-OD2 3.25Å; S2132-D2137 WeakPolarHBondContact CA-OD2 3.5Å; S2132-D2137 VanDerWaalsContact CB-OD2 3.22Å; S2132-D2137 WeakPolarHBondContact CB-OD2 3.4Å; S2132-D2137 PolarHBondContact OG-OD2 2.81Å
2133	D	87.6	Confident	82.7	Confident	20 Å²	20	55.6 Å²	55.6	11%	0.107	33%	0.334	C	S	.	.			trans	-131.7	122.4	173.4	172.5	-28.4	0	0	0	108	R2113 I2135 H2136 D2137 L2211	R2113-D2133 IonicContact CZ-OD2 3.71Å; R2113-D2133 VanDerWaalsContact CZ-OD2 3.25Å; R2113-D2133 IonicContact NE-OD1 3.3Å; R2113-D2133 IonicContact NE-OD2 2.78Å; R2113-D2133 PolarHBondContact NE-OD2 3.15Å; R2113-D2133 IonicContact NH2-OD2 3.4Å; R2113-D2133 PolarHBondContact NH2-OD2 2.73Å; D2133-I2135 PolarHBondContact O-N 3.02Å; D2133-I2135 VanDerWaalsContact O-N 3.08Å; D2133-I2135 PolarHBondContact OD1-N 3.35Å; D2133-H2136 HydrophobicContact CB-CB 4.05Å; D2133-H2136 PolarHBondContact O-N 2.77Å; D2133-H2136 VanDerWaalsContact O-N 3.16Å; D2133-H2136 PolarHBondContact OD1-N 3.41Å; D2133-H2136 IonicContact OD2-CD2 2.75Å; D2133-H2136 PolarHBondContact OD2-CD2 2.93Å; D2133-H2136 IonicContact OD2-CG 3.9Å; D2133-H2136 IonicContact OD2-NE2 2.79Å; D2133-D2137 PolarHBondContact N-OD2 2.77Å; D2133-D2137 WeakPolarHBondContact O-CB 3.31Å; D2133-D2137 PolarHBondContact O-N 2.83Å; D2133-D2137 VanDerWaalsContact O-OD2 3.11Å; D2133-L2211 HydrophobicContact CB-CD2 4.14Å
2134	P	89.7	Confident	83.1	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.026	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-17.8	-171.3	27.8	-36.3	0	0	0	115	L2116 L2139 F2140	L2116-P2134 HydrophobicContact CB-CB 3.94Å; L2116-P2134 HydrophobicContact CB-CG 3.74Å; L2116-P2134 HydrophobicContact CD1-CB 4.47Å; L2116-P2134 HydrophobicContact CD1-CG 4.41Å; P2134-L2139 PolarHBondContact O-N 3.03Å; P2134-F2140 HydrophobicContact CB-CD2 3.84Å; P2134-F2140 HydrophobicContact CB-CE2 3.7Å
2135	I	93.3	Very high	83.8	Confident	1 Å²	1	54 Å²	54	1%	0.005	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-46.9	174.1	-53.1	-176.8	0	0	0	110	L2005 V2007 L2112 R2113 L2116 D2133 Q2138 A2176	L2005-I2135 HydrophobicContact CD2-CG1 4.16Å; V2007-I2135 HydrophobicContact CB-CG2 4.1Å; V2007-I2135 HydrophobicContact CG1-CG2 3.94Å; L2112-I2135 HydrophobicContact CB-CD1 4.37Å; L2112-I2135 HydrophobicContact CD2-CD1 4.02Å; L2112-I2135 HydrophobicContact CG-CD1 3.98Å; R2113-I2135 HydrophobicContact CG-CD1 3.79Å; R2113-I2135 HydrophobicContact CG-CG1 4.22Å; L2116-I2135 HydrophobicContact CD1-CD1 4.38Å; L2116-I2135 HydrophobicContact CD1-CG1 3.79Å; D2133-I2135 PolarHBondContact O-N 3.02Å; D2133-I2135 VanDerWaalsContact O-N 3.08Å; D2133-I2135 PolarHBondContact OD1-N 3.35Å; I2135-Q2138 PolarHBondContact O-N 3.06Å; I2135-Q2138 VanDerWaalsContact O-N 3.11Å; I2135-A2176 HydrophobicContact CD1-CB 4.44Å; I2135-A2176 HydrophobicContact CG2-CB 4.21Å
2136	H	89.7	Confident	84.6	Confident	6 Å²	6	52 Å²	52	3%	0.028	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-35.9	-178.7	-69.2	-40.1	0	0	0	112.9	V2007 R2113 D2133 Q2138 E2207 F2208 L2211 H2215	V2007-H2136 VanDerWaalsContact CG1-CE1 3.47Å; V2007-H2136 WeakPolarHBondContact CG1-CE1 3.48Å; V2007-H2136 WeakPolarHBondContact CG1-ND1 3.44Å; R2113-H2136 PolarHBondContact NH2-NE2 3.29Å; D2133-H2136 HydrophobicContact CB-CB 4.05Å; D2133-H2136 PolarHBondContact O-N 2.77Å; D2133-H2136 VanDerWaalsContact O-N 3.16Å; D2133-H2136 PolarHBondContact OD1-N 3.41Å; D2133-H2136 IonicContact OD2-CD2 2.75Å; D2133-H2136 PolarHBondContact OD2-CD2 2.93Å; D2133-H2136 IonicContact OD2-CG 3.9Å; D2133-H2136 IonicContact OD2-NE2 2.79Å; H2136-Q2138 PolarHBondContact O-N 3.18Å; H2136-E2207 IonicContact CE1-OE2 2.7Å; H2136-E2207 IonicContact NE2-OE2 3.14Å; H2136-E2207 PolarHBondContact NE2-OE2 3.27Å; H2136-E2207 VanDerWaalsContact NE2-OE2 3.09Å; H2136-F2208 HydrophobicContact CB-CE1 4.31Å; H2136-F2208 AromaticContact CE1-CE1 3.45Å; H2136-F2208 VanDerWaalsContact CE1-CE1 3.45Å; H2136-F2208 WeakPolarHBondContact CE1-CE1 3.45Å; H2136-F2208 AromaticContact CE1-CZ 3.62Å; H2136-F2208 AromaticContact CG-CE1 3.73Å; H2136-F2208 AromaticContact ND1-CE1 3.17Å; H2136-F2208 WeakPolarHBondContact ND1-CE1 3.35Å; H2136-F2208 AromaticContact ND1-CZ 3.59Å; H2136-L2211 HydrophobicContact CB-CD1 3.84Å; H2136-H2215 PolarHBondContact O-NE2 3.02Å
2137	D	85.9	Confident	85.6	Confident	51 Å²	51	48.9 Å²	48.9	27%	0.273	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1	173.1	-68.8	-66.3	0	0	0	113	S2132 D2133 L2139 H2215	S2132-D2137 VanDerWaalsContact CA-OD2 3.25Å; S2132-D2137 WeakPolarHBondContact CA-OD2 3.5Å; S2132-D2137 VanDerWaalsContact CB-OD2 3.22Å; S2132-D2137 WeakPolarHBondContact CB-OD2 3.4Å; S2132-D2137 PolarHBondContact OG-OD2 2.81Å; D2133-D2137 PolarHBondContact N-OD2 2.77Å; D2133-D2137 WeakPolarHBondContact O-CB 3.31Å; D2133-D2137 PolarHBondContact O-N 2.83Å; D2133-D2137 VanDerWaalsContact O-OD2 3.11Å; D2137-L2139 VanDerWaalsContact C-N 3.28Å; D2137-L2139 HydrophobicContact CB-CD1 4.04Å; D2137-L2139 HydrophobicContact CB-CD2 4.01Å; D2137-L2139 HydrophobicContact CB-CG 3.68Å; D2137-L2139 WeakPolarHBondContact O-CD2 3.44Å; D2137-L2139 PolarHBondContact O-N 3.5Å; D2137-H2215 IonicContact OD1-CD2 2.63Å; D2137-H2215 PolarHBondContact OD1-CD2 2.81Å; D2137-H2215 VanDerWaalsContact OD1-CD2 3.26Å; D2137-H2215 IonicContact OD1-NE2 3.27Å
2138	Q	89.8	Confident	86.4	Confident	85 Å²	85	47.8 Å²	47.8	40%	0.397	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	33.6	177.1	-47.2	-164.2	-11.6	0	0	115.6	N2004 L2005 H2006 I2135 H2136 F2140	N2004-Q2138 HydrophobicContact CB-CB 4.48Å; N2004-Q2138 WeakPolarHBondContact CB-O 3.28Å; N2004-Q2138 PolarHBondContact ND2-O 3.19Å; L2005-Q2138 WeakPolarHBondContact O-CA 3.48Å; H2006-Q2138 HydrophobicContact CB-CB 4.43Å; H2006-Q2138 HydrophobicContact CB-CG 3.66Å; I2135-Q2138 PolarHBondContact O-N 3.06Å; I2135-Q2138 VanDerWaalsContact O-N 3.11Å; H2136-Q2138 PolarHBondContact O-N 3.18Å; Q2138-F2140 PolarHBondContact O-N 3.23Å
2139	L	83.6	Confident	87.2	Confident	95 Å²	95	50.2 Å²	50.2	50%	0.497	28%	0.28	S	S	.	.			trans	-75.8	-19.7	-164.6	-62.5	178.2	0	0	0	114.9	P2134 D2137	P2134-L2139 PolarHBondContact O-N 3.03Å; D2137-L2139 VanDerWaalsContact C-N 3.28Å; D2137-L2139 HydrophobicContact CB-CD1 4.04Å; D2137-L2139 HydrophobicContact CB-CD2 4.01Å; D2137-L2139 HydrophobicContact CB-CG 3.68Å; D2137-L2139 WeakPolarHBondContact O-CD2 3.44Å; D2137-L2139 PolarHBondContact O-N 3.5Å
2140	F	89.1	Confident	88.1	Confident	30 Å²	30	42.5 Å²	42.5	13%	0.132	24%	0.244	C	C	.	.			trans	-121	148	-166.9	-70.7	-87.3	0	0	0	113.5	N2004 L2005 L2116 V2119 P2134 Q2138	N2004-F2140 WeakPolarHBondContact CB-O 3.49Å; L2005-F2140 WeakPolarHBondContact CB-O 3.38Å; L2005-F2140 PolarHBondContact N-O 2.9Å; L2116-F2140 HydrophobicContact CB-CD2 4.47Å; L2116-F2140 HydrophobicContact CD2-CB 4.01Å; L2116-F2140 HydrophobicContact CD2-CD1 4.24Å; L2116-F2140 HydrophobicContact CD2-CD2 4.13Å; L2116-F2140 HydrophobicContact CD2-CG 3.86Å; V2119-F2140 HydrophobicContact CG1-CE1 3.99Å; P2134-F2140 HydrophobicContact CB-CD2 3.84Å; P2134-F2140 HydrophobicContact CB-CE2 3.7Å; Q2138-F2140 PolarHBondContact O-N 3.23Å
2141	Y	90.5	Very high	89.4	Confident	31 Å²	31	39.6 Å²	39.6	12%	0.122	21%	0.212	C	C	.	.			trans	-121.6	131.1	153	169.4	-97.1	0	0	0	106.8	S2001 D2143 Q2178 R2180	S2001-Y2141 VanDerWaalsContact CB-CD2 3.45Å; Y2141-D2143 HydrophobicContact CE1-CB 4.12Å; Y2141-Q2178 HydrophobicContact CD2-CB 4.27Å; Y2141-Q2178 HydrophobicContact CD2-CG 4.44Å; Y2141-Q2178 VanDerWaalsContact CD2-OE1 3.3Å; Y2141-Q2178 HydrophobicContact CE2-CG 4.47Å; Y2141-R2180 HydrophobicContact CE2-CB 4.22Å; Y2141-R2180 VanDerWaalsContact OH-CD 3.31Å; Y2141-R2180 WeakPolarHBondContact OH-CD 3.33Å
2142	M	90.8	Very high	90.5	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.223	C	C	.	.			trans	-93.2	107.8	176.4	-64.8	176.4	-63.8	0	0	108.3	L2005 F2104 L2112 F2115 L2116 L2146 L2147 L2150 Q2178	L2005-M2142 HydrophobicContact CD1-CE 3.94Å; L2005-M2142 HydrophobicContact CD2-CE 3.88Å; L2005-M2142 HydrophobicContact CG-CE 4.42Å; F2104-M2142 HydrophobicContact CD2-CE 4.38Å; F2104-M2142 HydrophobicContact CE1-CE 4.48Å; F2104-M2142 HydrophobicContact CE2-CE 3.31Å; F2104-M2142 HydrophobicContact CZ-CE 3.37Å; L2112-M2142 HydrophobicContact CD1-CE 3.91Å; L2112-M2142 HydrophobicContact CD1-SD 3.86Å; F2115-M2142 HydrophobicContact CE1-SD 4.46Å; L2116-M2142 HydrophobicContact CD2-CG 4.29Å; L2116-M2142 HydrophobicContact CD2-SD 4.02Å; M2142-L2146 HydrophobicContact CB-CB 3.89Å; M2142-L2146 HydrophobicContact CG-CB 4.1Å; M2142-L2147 HydrophobicContact CB-CD2 3.72Å; M2142-L2147 HydrophobicContact CB-CG 4.03Å; M2142-L2147 HydrophobicContact CE-CD2 4.05Å; M2142-L2147 HydrophobicContact SD-CD2 4.33Å; M2142-L2150 HydrophobicContact SD-CD2 4.16Å; M2142-Q2178 PolarHBondContact O-NE2 2.65Å
2143	D	89.8	Confident	91.2	Very high	44 Å²	44	45.8 Å²	45.8	24%	0.235	24%	0.237	C	C	.	.			trans	-71	176	164.2	69.7	14.1	0	0	0	110.7	Y2141 S2145 L2146 L2147	Y2141-D2143 HydrophobicContact CE1-CB 4.12Å; D2143-S2145 PolarHBondContact O-N 3.49Å; D2143-S2145 PolarHBondContact OD1-N 2.89Å; D2143-S2145 VanDerWaalsContact OD1-N 3.13Å; D2143-L2146 PolarHBondContact O-N 2.8Å; D2143-L2146 PolarHBondContact OD1-N 2.85Å; D2143-L2147 WeakPolarHBondContact O-CG 3.49Å; D2143-L2147 PolarHBondContact O-N 3.44Å
2144	Q	90.2	Very high	91.5	Very high	43 Å²	43	46.8 Å²	46.8	20%	0.201	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-39.9	-177.4	-166.6	61.6	34.2	0	0	112.1	S2042 L2146 L2147 D2148	S2042-Q2144 WeakPolarHBondContact O-CG 3.35Å; Q2144-L2146 VanDerWaalsContact C-N 3.25Å; Q2144-L2146 PolarHBondContact O-N 3.33Å; Q2144-L2147 PolarHBondContact O-N 3.02Å; Q2144-L2147 VanDerWaalsContact O-N 3.09Å; Q2144-D2148 PolarHBondContact NE2-OD1 2.88Å; Q2144-D2148 WeakPolarHBondContact O-CB 3.43Å; Q2144-D2148 PolarHBondContact O-N 2.88Å
2145	S	90.6	Very high	91.7	Very high	81 Å²	81	48.3 Å²	48.3	57%	0.566	26%	0.26	S	S	*	.	H	α-helix	trans	-65.8	-26.6	179.4	-174.5	0	0	0	0	113.3	D2143 R2149	D2143-S2145 PolarHBondContact O-N 3.49Å; D2143-S2145 PolarHBondContact OD1-N 2.89Å; D2143-S2145 VanDerWaalsContact OD1-N 3.13Å; S2145-R2149 VanDerWaalsContact O-CB 3.3Å; S2145-R2149 WeakPolarHBondContact O-CB 3.4Å; S2145-R2149 PolarHBondContact O-N 2.94Å
2146	L	93.2	Very high	91.8	Very high	22 Å²	22	48.5 Å²	48.5	12%	0.115	26%	0.261	C	S	.	.	H	α-helix	trans	-82.6	-32.8	171.6	-73.2	175.3	0	0	0	112.5	F2115 V2119 M2142 D2143 Q2144 R2149 L2150	F2115-L2146 WeakPolarHBondContact CZ-O 3.46Å; V2119-L2146 HydrophobicContact CG1-CD2 4.11Å; V2119-L2146 HydrophobicContact CG2-CD2 4.49Å; M2142-L2146 HydrophobicContact CB-CB 3.89Å; M2142-L2146 HydrophobicContact CG-CB 4.1Å; D2143-L2146 PolarHBondContact O-N 2.8Å; D2143-L2146 PolarHBondContact OD1-N 2.85Å; Q2144-L2146 VanDerWaalsContact C-N 3.25Å; Q2144-L2146 PolarHBondContact O-N 3.33Å; L2146-R2149 VanDerWaalsContact CD2-NH2 3.35Å; L2146-L2150 WeakPolarHBondContact O-CB 3.47Å; L2146-L2150 PolarHBondContact O-N 2.99Å
2147	L	94.6	Very high	91.9	Very high	10 Å²	10	50 Å²	50	5%	0.052	27%	0.268	C	S	.	.	H	α-helix	trans	-68.3	-46.2	174.6	-65.8	176.5	0	0	0	112	F2104 M2142 D2143 Q2144 R2149 L2150 Y2151 P2158	F2104-L2147 HydrophobicContact CZ-CD2 3.8Å; M2142-L2147 HydrophobicContact CB-CD2 3.72Å; M2142-L2147 HydrophobicContact CB-CG 4.03Å; M2142-L2147 HydrophobicContact CE-CD2 4.05Å; M2142-L2147 HydrophobicContact SD-CD2 4.33Å; D2143-L2147 WeakPolarHBondContact O-CG 3.49Å; D2143-L2147 PolarHBondContact O-N 3.44Å; Q2144-L2147 PolarHBondContact O-N 3.02Å; Q2144-L2147 VanDerWaalsContact O-N 3.09Å; L2147-R2149 VanDerWaalsContact C-N 3.28Å; L2147-R2149 PolarHBondContact O-N 2.85Å; L2147-L2150 WeakPolarHBondContact O-CB 3.44Å; L2147-L2150 PolarHBondContact O-N 2.83Å; L2147-Y2151 PolarHBondContact O-N 3.17Å; L2147-P2158 HydrophobicContact CD2-CG 4.16Å
2148	D	93.5	Very high	92.3	Very high	58 Å²	58	47.9 Å²	47.9	31%	0.31	26%	0.257	S	S	.	.	H	α-helix	trans	-57.5	-45	174.2	-58.8	-25.2	0	0	0	110.2	Q2144 L2150 Y2151 D2152	Q2144-D2148 PolarHBondContact NE2-OD1 2.88Å; Q2144-D2148 WeakPolarHBondContact O-CB 3.43Å; Q2144-D2148 PolarHBondContact O-N 2.88Å; D2148-L2150 PolarHBondContact O-N 2.97Å; D2148-Y2151 PolarHBondContact O-N 3.38Å; D2148-D2152 WeakPolarHBondContact O-CB 3.2Å; D2148-D2152 PolarHBondContact O-N 3.44Å
2149	R	95.2	Very high	92.5	Very high	86 Å²	86	43.9 Å²	43.9	33%	0.325	24%	0.239	S	C	.	.	H	α-helix	trans	-70.5	-30.3	179.8	-161.9	177.5	78.3	-164.3	7	112.8	F2115 E2123 S2145 L2146 L2147 C2153	F2115-R2149 HydrophobicContact CE2-CB 4.45Å; F2115-R2149 HydrophobicContact CE2-CG 4.3Å; F2115-R2149 WeakPolarHBondContact CE2-O 3.19Å; F2115-R2149 HydrophobicContact CZ-CB 4.23Å; F2115-R2149 HydrophobicContact CZ-CG 4.46Å; E2123-R2149 IonicContact OE1-CZ 3.55Å; E2123-R2149 IonicContact OE1-NH1 3.56Å; E2123-R2149 PolarHBondContact OE1-NH1 3.03Å; E2123-R2149 IonicContact OE1-NH2 3.95Å; E2123-R2149 PolarHBondContact OE1-NH2 2.84Å; S2145-R2149 VanDerWaalsContact O-CB 3.3Å; S2145-R2149 WeakPolarHBondContact O-CB 3.4Å; S2145-R2149 PolarHBondContact O-N 2.94Å; L2146-R2149 VanDerWaalsContact CD2-NH2 3.35Å; L2147-R2149 VanDerWaalsContact C-N 3.28Å; L2147-R2149 PolarHBondContact O-N 2.85Å; R2149-C2153 VanDerWaalsContact O-CB 3.23Å; R2149-C2153 WeakPolarHBondContact O-CB 3.49Å; R2149-C2153 PolarHBondContact O-N 2.89Å; R2149-C2153 VanDerWaalsContact O-N 3.11Å; R2149-C2153 PolarHBondContact O-SG 3.08Å
2150	L	96	Very high	93	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-49.3	171.1	172	65.2	0	0	0	109.9	F2104 L2112 F2115 M2142 L2146 L2147 D2148 C2153 T2154 I2156	F2104-L2150 HydrophobicContact CD1-CD2 4.46Å; F2104-L2150 HydrophobicContact CE1-CD2 3.48Å; F2104-L2150 VanDerWaalsContact CE1-CD2 3.48Å; F2104-L2150 HydrophobicContact CZ-CD2 3.84Å; L2112-L2150 HydrophobicContact CD1-CD1 4.17Å; L2112-L2150 HydrophobicContact CD1-CD2 3.84Å; F2115-L2150 HydrophobicContact CB-CD1 3.72Å; F2115-L2150 HydrophobicContact CD1-CB 4.13Å; F2115-L2150 HydrophobicContact CD1-CD1 3.66Å; F2115-L2150 HydrophobicContact CD1-CG 4.41Å; F2115-L2150 HydrophobicContact CD2-CB 4.48Å; F2115-L2150 HydrophobicContact CD2-CD1 4.07Å; F2115-L2150 HydrophobicContact CE1-CB 3.8Å; F2115-L2150 HydrophobicContact CE1-CD1 4.24Å; F2115-L2150 HydrophobicContact CE2-CB 4.19Å; F2115-L2150 HydrophobicContact CG-CB 4.44Å; F2115-L2150 HydrophobicContact CG-CD1 3.55Å; F2115-L2150 HydrophobicContact CZ-CB 3.83Å; M2142-L2150 HydrophobicContact SD-CD2 4.16Å; L2146-L2150 WeakPolarHBondContact O-CB 3.47Å; L2146-L2150 PolarHBondContact O-N 2.99Å; L2147-L2150 WeakPolarHBondContact O-CB 3.44Å; L2147-L2150 PolarHBondContact O-N 2.83Å; D2148-L2150 PolarHBondContact O-N 2.97Å; L2150-C2153 PolarHBondContact O-N 3.25Å; L2150-T2154 HydrophobicContact CD1-CG2 4.13Å; L2150-T2154 WeakPolarHBondContact CD1-OG1 3.1Å; L2150-T2154 WeakPolarHBondContact O-CB 2.94Å; L2150-T2154 PolarHBondContact O-N 2.9Å; L2150-T2154 PolarHBondContact O-OG1 3.11Å; L2150-I2156 HydrophobicContact CD1-CB 4.2Å; L2150-I2156 HydrophobicContact CD1-CD1 4.46Å; L2150-I2156 HydrophobicContact CD1-CG2 4.4Å; L2150-I2156 HydrophobicContact CD2-CB 4.37Å; L2150-I2156 HydrophobicContact CD2-CG2 3.85Å; L2150-I2156 HydrophobicContact CG-CB 4.11Å; L2150-I2156 HydrophobicContact CG-CG2 4.15Å
2151	Y	94.9	Very high	93.3	Very high	78 Å²	78	38.3 Å²	38.3	31%	0.306	21%	0.211	S	C	.	.	H	α-helix	trans	-58.9	-51.5	177.3	-178.2	-101.8	0	0	0	111.9	H1833 L2147 D2148 C2153 T2154 G2155 I2156 Q2157	H1833-Y2151 AromaticContact CE1-CD1 3.54Å; H1833-Y2151 AromaticContact CE1-CE1 3.48Å; H1833-Y2151 VanDerWaalsContact CE1-CE1 3.48Å; H1833-Y2151 WeakPolarHBondContact CE1-CE1 3.47Å; H1833-Y2151 AromaticContact ND1-CD1 3.59Å; H1833-Y2151 AromaticContact ND1-CE1 3.45Å; H1833-Y2151 WeakPolarHBondContact ND1-CE1 3.24Å; H1833-Y2151 AromaticContact ND1-CZ 3.96Å; L2147-Y2151 PolarHBondContact O-N 3.17Å; D2148-Y2151 PolarHBondContact O-N 3.38Å; Y2151-C2153 VanDerWaalsContact C-N 3.26Å; Y2151-C2153 PolarHBondContact O-N 3.42Å; Y2151-T2154 PolarHBondContact O-N 2.99Å; Y2151-G2155 WeakPolarHBondContact O-CA 3.17Å; Y2151-G2155 PolarHBondContact O-N 3.4Å; Y2151-I2156 WeakPolarHBondContact CA-O 3.3Å; Y2151-Q2157 HydrophobicContact CD2-CB 3.98Å; Y2151-Q2157 HydrophobicContact CE2-CB 4.36Å
2152	D	94.2	Very high	93.5	Very high	134 Å²	134	36.8 Å²	36.8	72%	0.717	21%	0.205	S	C	*	.	H	α-helix	trans	-57.9	-35.3	177.2	-92.5	-10.2	0	0	0	113.4	D2148	D2148-D2152 WeakPolarHBondContact O-CB 3.2Å; D2148-D2152 PolarHBondContact O-N 3.44Å
2153	C	92.8	Very high	93.8	Very high	82 Å²	82	36.8 Å²	36.8	55%	0.554	21%	0.205	S	C	*	.	H	α-helix	trans	-87.1	-24.4	-177.3	-67.7	0	0	0	0	114.3	F2115 R2149 L2150 Y2151	F2115-C2153 HydrophobicContact CD2-CB 4.25Å; F2115-C2153 HydrophobicContact CE2-CB 4.34Å; R2149-C2153 VanDerWaalsContact O-CB 3.23Å; R2149-C2153 WeakPolarHBondContact O-CB 3.49Å; R2149-C2153 PolarHBondContact O-N 2.89Å; R2149-C2153 VanDerWaalsContact O-N 3.11Å; R2149-C2153 PolarHBondContact O-SG 3.08Å; L2150-C2153 PolarHBondContact O-N 3.25Å; Y2151-C2153 VanDerWaalsContact C-N 3.26Å; Y2151-C2153 PolarHBondContact O-N 3.42Å
2154	T	93.7	Very high	94.1	Very high	40 Å²	40	34.7 Å²	34.7	25%	0.245	19%	0.194	C	C	.	.	H	α-helix	trans	-138.1	-18.1	-166.1	67.7	0	0	0	0	115.7	F2115 L2150 Y2151 I2156	F2115-T2154 HydrophobicContact CB-CG2 4.42Å; L2150-T2154 HydrophobicContact CD1-CG2 4.13Å; L2150-T2154 WeakPolarHBondContact CD1-OG1 3.1Å; L2150-T2154 WeakPolarHBondContact O-CB 2.94Å; L2150-T2154 PolarHBondContact O-N 2.9Å; L2150-T2154 PolarHBondContact O-OG1 3.11Å; Y2151-T2154 PolarHBondContact O-N 2.99Å; T2154-I2156 PolarHBondContact O-N 2.67Å; T2154-I2156 WeakPolarHBondContact OG1-CB 3.09Å; T2154-I2156 WeakPolarHBondContact OG1-CG1 3.07Å; T2154-I2156 PolarHBondContact OG1-N 3.24Å
2155	G	93.7	Very high	94.4	Very high	37 Å²	37	33.1 Å²	33.1	38%	0.381	19%	0.186	S	C	.	.			trans	69.4	17.6	-169.4	0	0	0	0	0	114.4	R1781 Y2151	R1781-G2155 PolarHBondContact NE-O 2.71Å; Y2151-G2155 WeakPolarHBondContact O-CA 3.17Å; Y2151-G2155 PolarHBondContact O-N 3.4Å
2156	I	95.2	Very high	94.6	Very high	5 Å²	5	29.2 Å²	29.2	3%	0.026	16%	0.159	C	C	.	.			trans	-87.6	131.7	169.8	-67.2	168.7	0	0	0	108.8	F2104 D2108 L2150 Y2151 T2154	F2104-I2156 HydrophobicContact CD1-CG2 3.56Å; F2104-I2156 HydrophobicContact CE1-CG2 3.74Å; D2108-I2156 HydrophobicContact CB-CD1 4.15Å; D2108-I2156 HydrophobicContact CB-CG1 4.26Å; D2108-I2156 HydrophobicContact CB-CG2 4.13Å; D2108-I2156 WeakPolarHBondContact OD2-CG2 3.06Å; L2150-I2156 HydrophobicContact CD1-CB 4.2Å; L2150-I2156 HydrophobicContact CD1-CD1 4.46Å; L2150-I2156 HydrophobicContact CD1-CG2 4.4Å; L2150-I2156 HydrophobicContact CD2-CB 4.37Å; L2150-I2156 HydrophobicContact CD2-CG2 3.85Å; L2150-I2156 HydrophobicContact CG-CB 4.11Å; L2150-I2156 HydrophobicContact CG-CG2 4.15Å; Y2151-I2156 WeakPolarHBondContact CA-O 3.3Å; T2154-I2156 PolarHBondContact O-N 2.67Å; T2154-I2156 WeakPolarHBondContact OG1-CB 3.09Å; T2154-I2156 WeakPolarHBondContact OG1-CG1 3.07Å; T2154-I2156 PolarHBondContact OG1-N 3.24Å
2157	Q	92	Very high	94.8	Very high	36 Å²	36	28.3 Å²	28.3	17%	0.168	15%	0.154	C	C	.	.			trans	-133.8	134.2	173.1	-175	170.1	-15.6	0	0	107.5	H1833 H1834 Y2151	H1833-Q2157 PolarHBondContact O-NE2 2.83Å; H1834-Q2157 PolarHBondContact O-OE1 2.82Å; Y2151-Q2157 HydrophobicContact CD2-CB 3.98Å; Y2151-Q2157 HydrophobicContact CE2-CB 4.36Å
2158	P	94.5	Very high	94.9	Very high	7 Å²	7	27.8 Å²	27.8	5%	0.045	15%	0.152	C	C	.	.			trans	-72.8	154.7	174.8	29.7	-33.5	0	0	0	111.7	N1835 P1836 H2102 I2103 F2104 L2147 T2160	N1835-P2158 PolarHBondContact OD1-O 3.4Å; P1836-P2158 VanDerWaalsContact CD-O 3.29Å; P1836-P2158 WeakPolarHBondContact CD-O 3.38Å; P1836-P2158 WeakPolarHBondContact CG-O 3.44Å; H2102-P2158 HydrophobicContact CB-CB 3.77Å; H2102-P2158 HydrophobicContact CB-CG 4Å; I2103-P2158 CarbonylContact O-C 3.47Å; I2103-P2158 VanDerWaalsContact O-CA 3.28Å; I2103-P2158 WeakPolarHBondContact O-CA 3.47Å; I2103-P2158 WeakPolarHBondContact O-CB 3.32Å; F2104-P2158 HydrophobicContact CD1-CB 4.03Å; F2104-P2158 HydrophobicContact CD2-CB 4.37Å; F2104-P2158 HydrophobicContact CE1-CB 3.64Å; F2104-P2158 HydrophobicContact CE1-CG 4Å; F2104-P2158 HydrophobicContact CE2-CB 4Å; F2104-P2158 HydrophobicContact CG-CB 4.39Å; F2104-P2158 HydrophobicContact CZ-CB 3.63Å; F2104-P2158 HydrophobicContact CZ-CG 3.89Å; L2147-P2158 HydrophobicContact CD2-CG 4.16Å; P2158-T2160 PolarHBondContact O-N 2.67Å; P2158-T2160 VanDerWaalsContact O-N 3.17Å
2159	C	93.8	Very high	95.1	Very high	2 Å²	2	25 Å²	25	1%	0.014	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	106	153.4	-68.2	0	0	0	0	108	N1835 P1836 P1862 I2103	N1835-C2159 WeakPolarHBondContact OD1-CA 3.47Å; P1836-C2159 HydrophobicContact CG-CB 4.49Å; P1836-C2159 PolarHBondContact O-SG 2.97Å; P1862-C2159 HydrophobicContact CG-CB 4.01Å; I2103-C2159 HydrophobicContact CB-CB 4.43Å; I2103-C2159 PolarHBondContact N-O 3.43Å; I2103-C2159 PolarHBondContact O-N 3.4Å
2160	T	94.5	Very high	95.2	Very high	7 Å²	7	21 Å²	21	4%	0.043	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.2	174.6	-56.3	0	0	0	0	109.3	N1835 I2045 L2100 W2101 P2158	N1835-T2160 PolarHBondContact ND2-O 3Å; N1835-T2160 PolarHBondContact OD1-N 2.74Å; I2045-T2160 HydrophobicContact CG2-CG2 3.89Å; L2100-T2160 HydrophobicContact CD1-CG2 3.65Å; W2101-T2160 WeakPolarHBondContact O-CA 3.42Å; P2158-T2160 PolarHBondContact O-N 2.67Å; P2158-T2160 VanDerWaalsContact O-N 3.17Å
2161	I	95.2	Very high	95.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129	-176.1	-71.3	168.5	0	0	0	109.5	F1838 P1862 V1864 W2101 I2103 V2169	F1838-I2161 HydrophobicContact CD1-CG1 4.32Å; F1838-I2161 HydrophobicContact CD2-CD1 4.32Å; F1838-I2161 HydrophobicContact CD2-CG1 4.49Å; F1838-I2161 HydrophobicContact CE1-CG1 4.15Å; F1838-I2161 HydrophobicContact CE2-CG1 4.33Å; F1838-I2161 HydrophobicContact CG-CD1 4.35Å; F1838-I2161 HydrophobicContact CZ-CG1 4.19Å; P1862-I2161 HydrophobicContact CB-CD1 4.46Å; P1862-I2161 HydrophobicContact CG-CD1 4.49Å; V1864-I2161 HydrophobicContact CG2-CD1 3.99Å; V1864-I2161 HydrophobicContact CG2-CG1 4.42Å; V1864-I2161 HydrophobicContact CG2-CG2 3.85Å; W2101-I2161 HydrophobicContact CB-CB 4.16Å; W2101-I2161 PolarHBondContact N-O 3.48Å; W2101-I2161 PolarHBondContact O-N 3.33Å; I2103-I2161 HydrophobicContact CD1-CD1 4.11Å; I2161-V2169 HydrophobicContact CG2-CG2 4.29Å
2162	V	95.3	Very high	95.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	114.9	167.1	-174.9	0	0	0	0	107.6	L2040 I2045 Y2049 P2097 L2100 F2164 L2182	L2040-V2162 HydrophobicContact CD1-CG1 4.3Å; L2040-V2162 HydrophobicContact CD1-CG2 4.28Å; L2040-V2162 HydrophobicContact CD2-CG2 3.71Å; I2045-V2162 HydrophobicContact CD1-CG2 4.31Å; I2045-V2162 HydrophobicContact CG2-CG2 4.03Å; Y2049-V2162 HydrophobicContact CD1-CB 4.19Å; Y2049-V2162 HydrophobicContact CD2-CB 4.5Å; Y2049-V2162 HydrophobicContact CD2-CG2 4.4Å; Y2049-V2162 HydrophobicContact CE1-CB 4.5Å; Y2049-V2162 WeakPolarHBondContact CE1-O 3.28Å; Y2049-V2162 HydrophobicContact CG-CB 4.19Å; Y2049-V2162 HydrophobicContact CG-CG2 4.28Å; P2097-V2162 HydrophobicContact CB-CG1 4.12Å; L2100-V2162 HydrophobicContact CD1-CG2 4.15Å; V2162-F2164 HydrophobicContact CB-CD2 4.41Å; V2162-F2164 HydrophobicContact CB-CE2 3.72Å; V2162-F2164 HydrophobicContact CB-CZ 4.39Å; V2162-F2164 HydrophobicContact CG1-CD2 4.04Å; V2162-F2164 HydrophobicContact CG1-CE2 3.49Å; V2162-F2164 VanDerWaalsContact CG1-CE2 3.49Å; V2162-F2164 HydrophobicContact CG1-CZ 3.87Å; V2162-F2164 VanDerWaalsContact O-CD2 3.22Å; V2162-F2164 WeakPolarHBondContact O-CD2 3.45Å; V2162-F2164 WeakPolarHBondContact O-CE2 3.41Å; V2162-L2182 HydrophobicContact CG1-CD1 4.28Å
2163	Q	96.5	Very high	95.5	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.5	178.2	-173.1	-172.8	26.2	0	0	109.4	N2014 M2016 G2098 A2099 D2167 V2169	N2014-Q2163 PolarHBondContact O-NE2 3.23Å; N2014-Q2163 PolarHBondContact OD1-NE2 3.44Å; M2016-Q2163 HydrophobicContact CB-CG 3.97Å; M2016-Q2163 HydrophobicContact CE-CB 4.28Å; M2016-Q2163 HydrophobicContact CE-CG 3.94Å; G2098-Q2163 WeakPolarHBondContact CA-O 3.31Å; G2098-Q2163 PolarHBondContact N-O 3.03Å; A2099-Q2163 PolarHBondContact N-O 3.03Å; A2099-Q2163 VanDerWaalsContact N-O 3.08Å; A2099-Q2163 PolarHBondContact O-N 3.26Å; Q2163-D2167 HydrophobicContact CG-CB 3.84Å; Q2163-D2167 PolarHBondContact NE2-O 3.13Å; Q2163-V2169 HydrophobicContact CB-CG2 4.16Å; Q2163-V2169 HydrophobicContact CG-CG2 3.83Å
2164	F	96.4	Very high	95.6	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	170.8	177.2	-62	-112	0	0	0	110.6	M2016 Y2049 R2052 V2053 D2095 I2096 P2097 V2162 G2166 D2167	M2016-F2164 VanDerWaalsContact CB-O 3.22Å; M2016-F2164 WeakPolarHBondContact CB-O 3.48Å; M2016-F2164 WeakPolarHBondContact CG-O 3.44Å; Y2049-F2164 AromaticContact CD1-CE2 3.62Å; Y2049-F2164 HydrophobicContact CD1-CE2 3.62Å; Y2049-F2164 HydrophobicContact CD1-CZ 4.3Å; Y2049-F2164 HydrophobicContact CE1-CE2 4.01Å; R2052-F2164 HydrophobicContact CB-CE1 3.89Å; R2052-F2164 HydrophobicContact CB-CZ 3.79Å; R2052-F2164 VanDerWaalsContact NH1-CE2 3.28Å; R2052-F2164 VanDerWaalsContact NH1-CG 3.33Å; V2053-F2164 HydrophobicContact CG2-CE1 3.77Å; V2053-F2164 HydrophobicContact CG2-CZ 3.65Å; D2095-F2164 WeakPolarHBondContact O-CD1 3.33Å; I2096-F2164 VanDerWaalsContact O-CA 3.28Å; I2096-F2164 WeakPolarHBondContact O-CA 3.18Å; I2096-F2164 WeakPolarHBondContact O-CB 3.21Å; P2097-F2164 HydrophobicContact CB-CD1 4.17Å; P2097-F2164 HydrophobicContact CB-CE1 4.06Å; V2162-F2164 HydrophobicContact CB-CD2 4.41Å; V2162-F2164 HydrophobicContact CB-CE2 3.72Å; V2162-F2164 HydrophobicContact CB-CZ 4.39Å; V2162-F2164 HydrophobicContact CG1-CD2 4.04Å; V2162-F2164 HydrophobicContact CG1-CE2 3.49Å; V2162-F2164 VanDerWaalsContact CG1-CE2 3.49Å; V2162-F2164 HydrophobicContact CG1-CZ 3.87Å; V2162-F2164 VanDerWaalsContact O-CD2 3.22Å; V2162-F2164 WeakPolarHBondContact O-CD2 3.45Å; V2162-F2164 WeakPolarHBondContact O-CE2 3.41Å; F2164-G2166 PolarHBondContact O-N 2.99Å; F2164-D2167 VanDerWaalsContact CB-OD2 3.28Å; F2164-D2167 WeakPolarHBondContact CB-OD2 3.45Å; F2164-D2167 WeakPolarHBondContact CD2-OD2 3.37Å; F2164-D2167 PolarHBondContact N-OD2 3.25Å; F2164-D2167 WeakPolarHBondContact O-CB 3.41Å; F2164-D2167 PolarHBondContact O-N 3.04Å
2165	H	96.2	Very high	95.7	Very high	10 Å²	10	5.6 Å²	5.6	5%	0.046	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	124.4	171.1	172.9	65.4	0	0	0	110.9	Q1874 L2017 V2019 S2093 I2096 D2167	Q1874-H2165 PolarHBondContact OE1-CE1 3.43Å; L2017-H2165 PolarHBondContact O-CE1 3.2Å; L2017-H2165 VanDerWaalsContact O-CE1 3.3Å; L2017-H2165 PolarHBondContact O-ND1 3.46Å; V2019-H2165 HydrophobicContact CB-CB 4.41Å; V2019-H2165 HydrophobicContact CG2-CB 3.85Å; S2093-H2165 PolarHBondContact O-CD2 3.17Å; I2096-H2165 PolarHBondContact O-N 2.86Å; H2165-D2167 VanDerWaalsContact C-N 3.35Å
2166	G	94.9	Very high	95.9	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.021	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	4.6	-177.6	0	0	0	0	0	116.9	G1867 C1868 Q1869 M2016 F2164	G1867-G2166 PolarHBondContact N-O 3.44Å; C1868-G2166 VanDerWaalsContact CB-O 3.3Å; C1868-G2166 WeakPolarHBondContact CB-O 3.49Å; C1868-G2166 PolarHBondContact N-O 3.37Å; Q1869-G2166 VanDerWaalsContact OE1-CA 3.31Å; M2016-G2166 WeakPolarHBondContact O-CA 3.23Å; M2016-G2166 PolarHBondContact O-N 3.07Å; F2164-G2166 PolarHBondContact O-N 2.99Å
2167	D	96.9	Very high	95.9	Very high	2 Å²	2	4 Å²	4	1%	0.011	2%	0.021	C	C	.	.			trans	-77.9	124	166.8	-75.2	-29	0	0	0	110.4	V1864 S1866 M2016 R2052 Q2163 F2164 H2165	V1864-D2167 HydrophobicContact CG1-CB 4.02Å; S1866-D2167 VanDerWaalsContact CA-OD1 3.22Å; S1866-D2167 WeakPolarHBondContact CA-OD1 3.32Å; S1866-D2167 WeakPolarHBondContact CB-OD1 3.48Å; S1866-D2167 PolarHBondContact OG-OD1 3.09Å; M2016-D2167 PolarHBondContact N-O 2.98Å; R2052-D2167 IonicContact NH1-OD2 3.87Å; Q2163-D2167 HydrophobicContact CG-CB 3.84Å; Q2163-D2167 PolarHBondContact NE2-O 3.13Å; F2164-D2167 VanDerWaalsContact CB-OD2 3.28Å; F2164-D2167 WeakPolarHBondContact CB-OD2 3.45Å; F2164-D2167 WeakPolarHBondContact CD2-OD2 3.37Å; F2164-D2167 PolarHBondContact N-OD2 3.25Å; F2164-D2167 WeakPolarHBondContact O-CB 3.41Å; F2164-D2167 PolarHBondContact O-N 3.04Å; H2165-D2167 VanDerWaalsContact C-N 3.35Å
2168	A	97.5	Very high	96.1	Very high	0 Å²	0	2.2 Å²	2.2	0%	0	1%	0.013	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.9	169.6	0	0	0	0	0	110.1	V1864 I1865 P1958 V2013 N2014 V2015 F2170	V1864-A2168 CarbonylContact C-O 3.57Å; V1864-A2168 WeakPolarHBondContact CA-O 3.37Å; I1865-A2168 HydrophobicContact CB-CB 4.46Å; I1865-A2168 PolarHBondContact N-O 3.26Å; I1865-A2168 PolarHBondContact O-N 2.95Å; P1958-A2168 HydrophobicContact CG-CB 3.69Å; V2013-A2168 HydrophobicContact CG2-CB 4.16Å; N2014-A2168 CarbonylContact O-C 3.45Å; N2014-A2168 WeakPolarHBondContact O-CA 3.28Å; V2015-A2168 HydrophobicContact CG2-CB 4.04Å; A2168-F2170 HydrophobicContact CB-CE2 4.41Å
2169	V	97.9	Very high	96.2	Very high	0 Å²	0	2 Å²	2	0%	0	1%	0.012	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	125.8	178.4	-177.1	0	0	0	0	109.2	L1863 V1864 V2013 N2014 I2103 I2161 Q2163 I2171	L1863-V2169 WeakPolarHBondContact O-CA 3.37Å; V1864-V2169 HydrophobicContact CG2-CG2 4.48Å; V2013-V2169 CarbonylContact C-O 2.96Å; V2013-V2169 WeakPolarHBondContact CA-O 3.37Å; N2014-V2169 PolarHBondContact N-O 2.82Å; N2014-V2169 PolarHBondContact O-N 2.99Å; I2103-V2169 HydrophobicContact CD1-CG1 3.94Å; I2161-V2169 HydrophobicContact CG2-CG2 4.29Å; Q2163-V2169 HydrophobicContact CB-CG2 4.16Å; Q2163-V2169 HydrophobicContact CG-CG2 3.83Å; V2169-I2171 HydrophobicContact CG1-CG1 4.31Å
2170	F	98	Very high	96.1	Very high	0 Å²	0	2.3 Å²	2.3	0%	0	1%	0.013	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	131.7	175.5	-77.3	-104	0	0	0	110.4	F1853 W1857 P1862 L1863 I1865 P1958 M1959 T1963 A2012 V2013 A2168 F2192	F1853-F2170 HydrophobicContact CE2-CB 4.46Å; F1853-F2170 AromaticContact CE2-CD1 3.49Å; F1853-F2170 HydrophobicContact CE2-CD1 3.49Å; F1853-F2170 VanDerWaalsContact CE2-CD1 3.49Å; F1853-F2170 HydrophobicContact CE2-CD2 4.48Å; F1853-F2170 AromaticContact CE2-CE1 3.68Å; F1853-F2170 HydrophobicContact CE2-CE1 3.68Å; F1853-F2170 AromaticContact CE2-CG 3.91Å; F1853-F2170 HydrophobicContact CE2-CG 3.91Å; F1853-F2170 HydrophobicContact CE2-CZ 4.28Å; F1853-F2170 AromaticContact CZ-CD1 3.84Å; F1853-F2170 HydrophobicContact CZ-CD1 3.84Å; F1853-F2170 HydrophobicContact CZ-CE1 4Å; W1857-F2170 HydrophobicContact CH2-CB 4.11Å; W1857-F2170 HydrophobicContact CH2-CD1 4.45Å; W1857-F2170 HydrophobicContact CZ3-CB 3.79Å; P1862-F2170 WeakPolarHBondContact CA-O 3.43Å; P1862-F2170 WeakPolarHBondContact CB-O 3.2Å; L1863-F2170 HydrophobicContact CB-CB 4.2Å; L1863-F2170 PolarHBondContact N-O 2.82Å; L1863-F2170 PolarHBondContact O-N 3.21Å; I1865-F2170 HydrophobicContact CB-CE2 4.39Å; I1865-F2170 HydrophobicContact CD1-CD2 4.3Å; I1865-F2170 HydrophobicContact CD1-CE2 3.6Å; I1865-F2170 HydrophobicContact CD1-CZ 4.12Å; I1865-F2170 HydrophobicContact CG1-CD2 4.2Å; I1865-F2170 HydrophobicContact CG1-CE2 3.83Å; P1958-F2170 HydrophobicContact CB-CE2 4.45Å; P1958-F2170 HydrophobicContact CB-CZ 4.41Å; P1958-F2170 HydrophobicContact CG-CE2 3.87Å; P1958-F2170 HydrophobicContact CG-CZ 3.94Å; M1959-F2170 HydrophobicContact CB-CE1 4.28Å; M1959-F2170 HydrophobicContact CB-CZ 4.06Å; M1959-F2170 HydrophobicContact CG-CZ 4.14Å; T1963-F2170 HydrophobicContact CG2-CE1 3.53Å; T1963-F2170 HydrophobicContact CG2-CZ 3.9Å; A2012-F2170 WeakPolarHBondContact O-CA 3.39Å; V2013-F2170 HydrophobicContact CB-CD1 4.1Å; V2013-F2170 HydrophobicContact CB-CE1 3.95Å; V2013-F2170 HydrophobicContact CB-CE2 4.44Å; V2013-F2170 HydrophobicContact CB-CG 4.44Å; V2013-F2170 HydrophobicContact CB-CZ 4.13Å; V2013-F2170 HydrophobicContact CG2-CD1 4.25Å; V2013-F2170 HydrophobicContact CG2-CD2 3.94Å; V2013-F2170 HydrophobicContact CG2-CE1 3.97Å; V2013-F2170 HydrophobicContact CG2-CE2 3.59Å; V2013-F2170 HydrophobicContact CG2-CG 4.26Å; V2013-F2170 HydrophobicContact CG2-CZ 3.62Å; A2168-F2170 HydrophobicContact CB-CE2 4.41Å; F2170-F2192 HydrophobicContact CD1-CE1 4.18Å; F2170-F2192 AromaticContact CD1-CZ 3.94Å; F2170-F2192 HydrophobicContact CD1-CZ 3.94Å; F2170-F2192 HydrophobicContact CE1-CE1 4.3Å; F2170-F2192 HydrophobicContact CE1-CZ 4.17Å
2171	I	97.6	Very high	96.2	Very high	5 Å²	5	2 Å²	2	3%	0.026	1%	0.011	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	112.3	-170.8	-50.2	170.2	0	0	0	108.1	A2012 W2101 I2103 V2169 A2175	A2012-I2171 HydrophobicContact CB-CB 4.37Å; A2012-I2171 HydrophobicContact CB-CD1 4.42Å; A2012-I2171 PolarHBondContact N-O 3Å; A2012-I2171 PolarHBondContact O-N 3.21Å; W2101-I2171 HydrophobicContact CE3-CD1 4.48Å; W2101-I2171 HydrophobicContact CH2-CD1 3.97Å; W2101-I2171 HydrophobicContact CZ3-CD1 3.52Å; W2101-I2171 HydrophobicContact CZ3-CG1 4.46Å; I2103-I2171 HydrophobicContact CD1-CG1 4.44Å; V2169-I2171 HydrophobicContact CG1-CG1 4.31Å; I2171-A2175 HydrophobicContact CG2-CB 4.17Å
2172	P	97.3	Very high	96.1	Very high	1 Å²	1	2.1 Å²	2.1	1%	0.006	1%	0.012	C	C	.	.			trans	-59	141.5	174.1	-28.9	37.8	0	0	0	112.9	W1857 N1860 H1861 G2174 A2175 H2197	W1857-P2172 HydrophobicContact CE3-CG 4.23Å; W1857-P2172 HydrophobicContact CH2-CG 4.2Å; W1857-P2172 HydrophobicContact CZ3-CG 3.74Å; N1860-P2172 WeakPolarHBondContact O-CG 3.44Å; H1861-P2172 WeakPolarHBondContact O-CG 3.34Å; P2172-G2174 PolarHBondContact O-N 2.98Å; P2172-A2175 HydrophobicContact CB-CB 4.17Å; P2172-A2175 HydrophobicContact CG-CB 4.5Å; P2172-A2175 VanDerWaalsContact O-CB 3.23Å; P2172-A2175 WeakPolarHBondContact O-CB 3.36Å; P2172-A2175 PolarHBondContact O-N 3.31Å; P2172-H2197 VanDerWaalsContact CB-CE1 3.44Å; P2172-H2197 WeakPolarHBondContact CB-CE1 3.38Å
2173	A	96.3	Very high	96.1	Very high	0 Å²	0	2.2 Å²	2.2	0%	0	1%	0.012	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	128.3	169.4	0	0	0	0	0	110.5	A2010 D2011 H2197 Q2200	A2010-A2173 WeakPolarHBondContact O-CA 3.25Å; D2011-A2173 PolarHBondContact OD1-N 3.25Å; A2173-H2197 HydrophobicContact CB-CB 3.98Å; A2173-Q2200 VanDerWaalsContact O-CB 3.29Å; A2173-Q2200 WeakPolarHBondContact O-CB 3.22Å
2174	G	94.2	Very high	96.1	Very high	5 Å²	5	2.3 Å²	2.3	5%	0.052	1%	0.013	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-5.8	-174.6	0	0	0	0	0	116	V2007 D2008 P2172 A2176	V2007-G2174 WeakPolarHBondContact CG2-O 3.18Å; D2008-G2174 PolarHBondContact O-N 3.06Å; D2008-G2174 VanDerWaalsContact O-N 3.13Å; P2172-G2174 PolarHBondContact O-N 2.98Å; G2174-A2176 PolarHBondContact O-N 3.38Å
2175	A	96.2	Very high	96.2	Very high	1 Å²	1	2.3 Å²	2.3	1%	0.008	1%	0.013	C	C	.	.			trans	-76.1	109.4	173.1	0	0	0	0	0	110.5	I2103 F2104 P2106 I2171 P2172 H2177	I2103-A2175 HydrophobicContact CG2-CB 3.94Å; F2104-A2175 VanDerWaalsContact O-CA 3.31Å; F2104-A2175 WeakPolarHBondContact O-CA 3.27Å; F2104-A2175 WeakPolarHBondContact O-CB 3.2Å; P2106-A2175 HydrophobicContact CG-CB 4.48Å; I2171-A2175 HydrophobicContact CG2-CB 4.17Å; P2172-A2175 HydrophobicContact CB-CB 4.17Å; P2172-A2175 HydrophobicContact CG-CB 4.5Å; P2172-A2175 VanDerWaalsContact O-CB 3.23Å; P2172-A2175 WeakPolarHBondContact O-CB 3.36Å; P2172-A2175 PolarHBondContact O-N 3.31Å; A2175-H2177 PolarHBondContact O-N 3.47Å; A2175-H2177 PolarHBondContact O-ND1 3.49Å
2176	A	96.8	Very high	96.2	Very high	0 Å²	0	1.9 Å²	1.9	0%	0	1%	0.011	C	C	.	.			trans	-70.6	130.9	177.6	0	0	0	0	0	110	L2005 H2006 V2007 F2104 L2112 I2135 G2174	L2005-A2176 HydrophobicContact CD1-CB 4.28Å; H2006-A2176 CarbonylContact O-C 3.54Å; H2006-A2176 WeakPolarHBondContact O-CA 3.47Å; V2007-A2176 HydrophobicContact CB-CB 4.41Å; F2104-A2176 HydrophobicContact CB-CB 4.46Å; F2104-A2176 WeakPolarHBondContact CB-O 3.44Å; F2104-A2176 WeakPolarHBondContact CD2-O 3.5Å; F2104-A2176 PolarHBondContact N-O 2.89Å; F2104-A2176 PolarHBondContact O-N 3.19Å; L2112-A2176 HydrophobicContact CD2-CB 4.03Å; I2135-A2176 HydrophobicContact CD1-CB 4.44Å; I2135-A2176 HydrophobicContact CG2-CB 4.21Å; G2174-A2176 PolarHBondContact O-N 3.38Å
2177	H	96.9	Very high	96.3	Very high	7 Å²	7	2.2 Å²	2.2	3%	0.032	1%	0.012	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	158.9	-173.3	72.1	-84.4	0	0	0	114.4	L2005 H2006 D2008 W2101 H2102 I2103 A2175	L2005-H2177 WeakPolarHBondContact CA-O 3.29Å; H2006-H2177 AromaticContact CE1-CD2 3.75Å; H2006-H2177 AromaticContact CE1-CE1 3.47Å; H2006-H2177 PolarHBondContact CE1-CE1 3.07Å; H2006-H2177 VanDerWaalsContact CE1-CE1 3.47Å; H2006-H2177 AromaticContact CE1-NE2 3.11Å; H2006-H2177 PolarHBondContact CE1-NE2 3.11Å; H2006-H2177 PolarHBondContact N-O 3.26Å; H2006-H2177 VanDerWaalsContact N-O 3.07Å; H2006-H2177 AromaticContact ND1-NE2 3.97Å; H2006-H2177 PolarHBondContact ND1-O 3.48Å; H2006-H2177 VanDerWaalsContact ND1-O 3.15Å; H2006-H2177 AromaticContact NE2-CE1 3.68Å; H2006-H2177 AromaticContact NE2-NE2 3.6Å; H2006-H2177 PolarHBondContact O-N 3.18Å; D2008-H2177 IonicContact OD2-CE1 2.83Å; D2008-H2177 PolarHBondContact OD2-CE1 2.79Å; W2101-H2177 AromaticContact CE3-CD2 3.92Å; W2101-H2177 AromaticContact CZ3-CD2 3.48Å; W2101-H2177 VanDerWaalsContact CZ3-CD2 3.48Å; W2101-H2177 WeakPolarHBondContact CZ3-CD2 3.49Å; W2101-H2177 AromaticContact CZ3-NE2 3.84Å; H2102-H2177 VanDerWaalsContact O-CA 3.27Å; H2102-H2177 WeakPolarHBondContact O-CA 3.43Å; I2103-H2177 HydrophobicContact CB-CB 4.27Å; I2103-H2177 HydrophobicContact CG1-CB 3.94Å; I2103-H2177 HydrophobicContact CG2-CB 4.28Å; A2175-H2177 PolarHBondContact O-N 3.47Å; A2175-H2177 PolarHBondContact O-ND1 3.49Å
2178	Q	95.9	Very high	96.2	Very high	0 Å²	0	2.1 Å²	2.1	0%	0	1%	0.012	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	152.5	-179.1	58.7	171.7	19.7	0	0	112.1	L2005 W2101 H2102 Y2141 M2142	L2005-Q2178 HydrophobicContact CB-CB 4.32Å; L2005-Q2178 HydrophobicContact CD1-CB 4.41Å; W2101-Q2178 WeakPolarHBondContact CA-O 3.42Å; H2102-Q2178 HydrophobicContact CB-CG 3.81Å; H2102-Q2178 PolarHBondContact N-O 2.84Å; H2102-Q2178 VanDerWaalsContact N-O 3.13Å; H2102-Q2178 PolarHBondContact ND1-NE2 2.7Å; H2102-Q2178 PolarHBondContact O-N 2.9Å; Y2141-Q2178 HydrophobicContact CD2-CB 4.27Å; Y2141-Q2178 HydrophobicContact CD2-CG 4.44Å; Y2141-Q2178 VanDerWaalsContact CD2-OE1 3.3Å; Y2141-Q2178 HydrophobicContact CE2-CG 4.47Å; M2142-Q2178 PolarHBondContact O-NE2 2.65Å
2179	V	95.1	Very high	96	Very high	3 Å²	3	2.4 Å²	2.4	2%	0.018	2%	0.015	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	128.4	-172.1	-165.3	0	0	0	0	112.7	T2002 T2003 A2099 W2101	T2002-V2179 PolarHBondContact N-O 3.05Å; T2002-V2179 PolarHBondContact OG1-O 3.43Å; T2003-V2179 PolarHBondContact N-O 3.04Å; T2003-V2179 PolarHBondContact O-N 3.41Å; A2099-V2179 HydrophobicContact CB-CG1 4Å; W2101-V2179 HydrophobicContact CD2-CB 4.48Å; W2101-V2179 HydrophobicContact CD2-CG1 4.14Å; W2101-V2179 HydrophobicContact CD2-CG2 3.7Å; W2101-V2179 HydrophobicContact CE3-CG2 3.49Å; W2101-V2179 VanDerWaalsContact CE3-CG2 3.49Å; W2101-V2179 HydrophobicContact CG-CG1 4.42Å; W2101-V2179 HydrophobicContact CH2-CG2 3.68Å; W2101-V2179 HydrophobicContact CZ2-CG1 4.13Å; W2101-V2179 HydrophobicContact CZ2-CG2 3.89Å; W2101-V2179 HydrophobicContact CZ3-CG2 3.47Å; W2101-V2179 VanDerWaalsContact CZ3-CG2 3.47Å
2180	R	93.5	Very high	95.8	Very high	7 Å²	7	2.8 Å²	2.8	3%	0.026	2%	0.017	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	113.5	172.1	176.8	172.6	168.5	-139.9	-10.6	110.9	T1994 S1997 I2000 T2002 T2039 L2100 Y2141 L2182	T1994-R2180 HydrophobicContact CG2-CG 4.2Å; T1994-R2180 WeakPolarHBondContact OG1-CG 3.48Å; T1994-R2180 PolarHBondContact OG1-NE 3.05Å; S1997-R2180 PolarHBondContact O-NE 3.27Å; S1997-R2180 PolarHBondContact O-NH2 3.32Å; I2000-R2180 WeakPolarHBondContact O-CD 3.46Å; I2000-R2180 WeakPolarHBondContact O-CG 3.34Å; T2002-R2180 WeakPolarHBondContact OG1-CA 3.37Å; T2039-R2180 VanDerWaalsContact CG2-NH1 3.32Å; L2100-R2180 PolarHBondContact N-O 2.94Å; L2100-R2180 PolarHBondContact O-N 3.34Å; Y2141-R2180 HydrophobicContact CE2-CB 4.22Å; Y2141-R2180 VanDerWaalsContact OH-CD 3.31Å; Y2141-R2180 WeakPolarHBondContact OH-CD 3.33Å; R2180-L2182 PolarHBondContact O-N 3.25Å
2181	N	95.3	Very high	95.6	Very high	1 Å²	1	4.8 Å²	4.8	1%	0.005	3%	0.027	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	129	170.7	-81.9	12.2	0	0	0	111.7	A1991 Y1992 T1994 T2002 N2183 C2185 K2187	A1991-N2181 WeakPolarHBondContact CB-ND2 3.41Å; A1991-N2181 PolarHBondContact O-ND2 3.18Å; Y1992-N2181 WeakPolarHBondContact O-CB 3.41Å; Y1992-N2181 PolarHBondContact O-ND2 3.14Å; T1994-N2181 WeakPolarHBondContact CB-O 3.33Å; T1994-N2181 WeakPolarHBondContact CG2-O 3.3Å; T1994-N2181 PolarHBondContact N-O 3.35Å; T1994-N2181 PolarHBondContact OG1-O 3.15Å; T2002-N2181 HydrophobicContact CG2-CB 3.74Å; T2002-N2181 PolarHBondContact OG1-N 3.46Å; N2181-N2183 WeakPolarHBondContact CB-O 3.46Å; N2181-C2185 WeakPolarHBondContact ND2-CB 3.37Å; N2181-K2187 PolarHBondContact OD1-NZ 3.37Å
2182	L	94.5	Very high	95.5	Very high	2 Å²	2	4.6 Å²	4.6	1%	0.01	3%	0.026	C	C	.	.	S	Bend	trans	-85.6	-63.1	173.5	-58.7	166.9	0	0	0	108.2	G1993 T1994 I2036 T2039 L2040 P2097 G2098 L2100 V2162 R2180	G1993-L2182 VanDerWaalsContact CA-O 3.26Å; G1993-L2182 WeakPolarHBondContact CA-O 3.5Å; T1994-L2182 PolarHBondContact N-O 3.11Å; I2036-L2182 HydrophobicContact CD1-CB 4Å; I2036-L2182 HydrophobicContact CG1-CB 4.06Å; I2036-L2182 HydrophobicContact CG2-CB 4.29Å; I2036-L2182 HydrophobicContact CG2-CD1 4.16Å; I2036-L2182 HydrophobicContact CG2-CD2 4.48Å; T2039-L2182 HydrophobicContact CG2-CD2 4.27Å; L2040-L2182 HydrophobicContact CD1-CD1 4.23Å; L2040-L2182 HydrophobicContact CD2-CD1 4.11Å; L2040-L2182 HydrophobicContact CD2-CD2 4.41Å; L2040-L2182 HydrophobicContact CG-CD1 4.45Å; P2097-L2182 HydrophobicContact CB-CD1 4.22Å; G2098-L2182 WeakPolarHBondContact O-CB 3.23Å; G2098-L2182 PolarHBondContact O-N 3.2Å; L2100-L2182 HydrophobicContact CB-CD1 4.41Å; L2100-L2182 HydrophobicContact CB-CD2 4.22Å; L2100-L2182 HydrophobicContact CB-CG 4.37Å; V2162-L2182 HydrophobicContact CG1-CD1 4.28Å; R2180-L2182 PolarHBondContact O-N 3.25Å
2183	N	95.3	Very high	95.5	Very high	2 Å²	2	4.5 Å²	4.5	1%	0.011	3%	0.026	C	C	.	.	S	Bend	trans	-95.1	174.2	168	-76.4	-51.6	0	0	0	110.9	G1993 V2019 N2032 I2036 P2097 G2098 N2181 C2185	G1993-N2183 VanDerWaalsContact CA-O 3.27Å; G1993-N2183 WeakPolarHBondContact CA-O 3.49Å; V2019-N2183 HydrophobicContact CG1-CB 3.47Å; V2019-N2183 VanDerWaalsContact CG1-CB 3.47Å; N2032-N2183 PolarHBondContact ND2-OD1 3.34Å; I2036-N2183 WeakPolarHBondContact CD1-ND2 3.46Å; I2036-N2183 WeakPolarHBondContact CD1-OD1 3.41Å; P2097-N2183 PolarHBondContact O-ND2 3.42Å; G2098-N2183 PolarHBondContact O-N 2.92Å; N2181-N2183 WeakPolarHBondContact CB-O 3.46Å; N2183-C2185 PolarHBondContact O-SG 3.2Å
2184	S	96	Very high	95.5	Very high	3 Å²	3	4.5 Å²	4.5	2%	0.021	3%	0.026	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.5	174.8	-60.8	0	0	0	0	109.9	F1914 R1920 A1991 Y1992 G1993 V2019 G2020	F1914-S2184 VanDerWaalsContact CE1-CB 3.47Å; F1914-S2184 WeakPolarHBondContact O-CB 3.39Å; F1914-S2184 PolarHBondContact O-OG 3.25Å; R1920-S2184 PolarHBondContact NH2-OG 2.89Å; R1920-S2184 VanDerWaalsContact NH2-OG 3.15Å; A1991-S2184 WeakPolarHBondContact O-CA 3.45Å; Y1992-S2184 WeakPolarHBondContact CA-OG 3.37Å; G1993-S2184 PolarHBondContact N-OG 2.88Å; V2019-S2184 CarbonylContact C-O 2.89Å; V2019-S2184 WeakPolarHBondContact CA-O 3.44Å; G2020-S2184 PolarHBondContact N-O 3.11Å; G2020-S2184 WeakPolarHBondContact O-CB 3.37Å; G2020-S2184 PolarHBondContact O-N 3.46Å
2185	C	97.1	Very high	95.6	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.024	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140	-169.7	-60.5	0	0	0	0	112.8	V1990 A1991 M2016 Y2018 G2098 N2181 N2183 K2187	V1990-C2185 WeakPolarHBondContact CA-O 3.14Å; A1991-C2185 PolarHBondContact N-O 3.24Å; A1991-C2185 VanDerWaalsContact N-O 3.14Å; A1991-C2185 PolarHBondContact O-N 2.74Å; M2016-C2185 HydrophobicContact CE-CB 4.14Å; M2016-C2185 HydrophobicContact SD-CB 3.67Å; Y2018-C2185 WeakPolarHBondContact O-CA 3.31Å; G2098-C2185 VanDerWaalsContact CA-SG 3.55Å; G2098-C2185 PolarHBondContact O-SG 2.86Å; N2181-C2185 WeakPolarHBondContact ND2-CB 3.37Å; N2183-C2185 PolarHBondContact O-SG 3.2Å; C2185-K2187 HydrophobicContact CB-CG 4.27Å
2186	I	97.1	Very high	95.7	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	114.1	163.9	-55.5	176.6	0	0	0	106.4	W1877 P1879 F1882 W1911 F1914 L1988 V1990 L2017 Y2018	W1877-I2186 WeakPolarHBondContact O-CD1 3.32Å; P1879-I2186 HydrophobicContact CG-CD1 4.2Å; F1882-I2186 HydrophobicContact CD2-CD1 3.92Å; F1882-I2186 HydrophobicContact CE2-CD1 3.85Å; F1882-I2186 HydrophobicContact CE2-CG2 4.04Å; F1882-I2186 HydrophobicContact CZ-CG2 4.32Å; W1911-I2186 HydrophobicContact CH2-CD1 3.93Å; W1911-I2186 HydrophobicContact CH2-CG1 4.33Å; W1911-I2186 HydrophobicContact CZ3-CD1 3.74Å; W1911-I2186 HydrophobicContact CZ3-CG1 4.19Å; F1914-I2186 HydrophobicContact CE1-CG1 4.21Å; F1914-I2186 HydrophobicContact CE2-CG1 4.49Å; F1914-I2186 HydrophobicContact CZ-CD1 4.39Å; F1914-I2186 HydrophobicContact CZ-CG1 3.72Å; L1988-I2186 HydrophobicContact CD1-CG2 4.14Å; L1988-I2186 HydrophobicContact CD2-CG2 4.25Å; L1988-I2186 HydrophobicContact CG-CG2 4.34Å; V1990-I2186 HydrophobicContact CG1-CG1 4.35Å; V1990-I2186 HydrophobicContact CG2-CG2 4.21Å; L2017-I2186 PolarHBondContact N-O 3.46Å; Y2018-I2186 HydrophobicContact CD1-CD1 4.38Å; Y2018-I2186 HydrophobicContact CG-CD1 4.43Å; Y2018-I2186 PolarHBondContact N-O 2.78Å; Y2018-I2186 VanDerWaalsContact N-O 3.11Å; Y2018-I2186 PolarHBondContact O-N 2.74Å
2187	K	96.4	Very high	95.6	Very high	7 Å²	7	5.2 Å²	5.2	3%	0.03	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	147.5	175.1	-33.7	-167.6	-170.2	77.2	0	110.1	L1988 Y1989 N2014 V2015 M2016 W2101 N2181 C2185	L1988-K2187 WeakPolarHBondContact CD1-O 3.24Å; Y1989-K2187 PolarHBondContact N-O 3.46Å; Y1989-K2187 PolarHBondContact O-N 3.37Å; N2014-K2187 WeakPolarHBondContact OD1-CD 3.17Å; V2015-K2187 VanDerWaalsContact O-CA 3.23Å; V2015-K2187 WeakPolarHBondContact O-CA 3.3Å; V2015-K2187 WeakPolarHBondContact O-CB 3.48Å; M2016-K2187 HydrophobicContact CE-CD 3.93Å; M2016-K2187 VanDerWaalsContact CE-CE 3.43Å; M2016-K2187 HydrophobicContact CE-CG 4.23Å; M2016-K2187 HydrophobicContact SD-CD 4.28Å; M2016-K2187 HydrophobicContact SD-CG 3.92Å; W2101-K2187 HydrophobicContact CZ2-CD 4.37Å; N2181-K2187 PolarHBondContact OD1-NZ 3.37Å; C2185-K2187 HydrophobicContact CB-CG 4.27Å
2188	A	94.4	Very high	95.5	Very high	1 Å²	1	4.9 Å²	4.9	1%	0.008	3%	0.026	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.9	161.8	0	0	0	0	0	109.3	L1953 K1987 L1988 N2014 V2015 L2017	L1953-A2188 HydrophobicContact CD1-CB 4.1Å; L1953-A2188 HydrophobicContact CD2-CB 3.65Å; K1987-A2188 WeakPolarHBondContact O-CA 3.23Å; L1988-A2188 HydrophobicContact CD1-CB 4.04Å; N2014-A2188 CarbonylContact C-O 3.59Å; N2014-A2188 WeakPolarHBondContact CA-O 3.44Å; V2015-A2188 PolarHBondContact N-O 2.85Å; V2015-A2188 PolarHBondContact O-N 3.15Å; L2017-A2188 HydrophobicContact CD1-CB 3.58Å
2189	A	93.8	Very high	95.4	Very high	6 Å²	6	7.9 Å²	7.9	5%	0.05	5%	0.046	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	148	164.3	0	0	0	0	0	110.7	P1986 K1987 Y1989 V2013	P1986-A2189 CarbonylContact C-O 3.41Å; P1986-A2189 WeakPolarHBondContact CA-O 3.22Å; P1986-A2189 WeakPolarHBondContact CB-O 3.1Å; K1987-A2189 PolarHBondContact N-O 3.02Å; K1987-A2189 PolarHBondContact O-N 3.23Å; Y1989-A2189 HydrophobicContact CD2-CB 4.15Å; Y1989-A2189 HydrophobicContact CE2-CB 3.65Å; V2013-A2189 VanDerWaalsContact O-CA 3.24Å; V2013-A2189 WeakPolarHBondContact O-CA 3.15Å
2190	V	93.9	Very high	95.4	Very high	7 Å²	7	8.7 Å²	8.7	4%	0.042	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.2	171.6	176.2	0	0	0	0	107.4	L1953 M1954 L1957 P1986 V2013	L1953-V2190 HydrophobicContact CD2-CG2 4.3Å; M1954-V2190 HydrophobicContact CE-CG2 3.67Å; L1957-V2190 HydrophobicContact CD1-CB 4.35Å; L1957-V2190 HydrophobicContact CD1-CG1 4.17Å; L1957-V2190 HydrophobicContact CD1-CG2 4.05Å; L1957-V2190 HydrophobicContact CD2-CG2 4.07Å; P1986-V2190 HydrophobicContact CB-CG2 3.87Å; V2013-V2190 HydrophobicContact CG1-CB 4Å; V2013-V2190 PolarHBondContact N-O 2.53Å; V2013-V2190 PolarHBondContact O-N 2.74Å
2191	D	94.5	Very high	95.4	Very high	43 Å²	43	8.3 Å²	8.3	23%	0.23	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	148.2	176.7	-52.6	-11	0	0	0	109.1	L1984 A2010 D2011	L1984-D2191 HydrophobicContact CB-CB 3.92Å; L1984-D2191 WeakPolarHBondContact CB-O 3.24Å; L1984-D2191 HydrophobicContact CD2-CB 3.95Å; L1984-D2191 HydrophobicContact CG-CB 4.44Å; L1984-D2191 PolarHBondContact O-N 2.87Å; A2010-D2191 HydrophobicContact CB-CB 4.17Å; D2011-D2191 CarbonylContact O-C 3.5Å; D2011-D2191 WeakPolarHBondContact O-CA 3.48Å
2192	F	95.8	Very high	95.2	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	169.4	174.4	61.4	-82.4	0	0	0	110.1	W1857 Y1962 T1963 A2010 D2011 V2013 F2170	W1857-F2192 HydrophobicContact CH2-CZ 4.02Å; W1857-F2192 AromaticContact CZ2-CE2 3.74Å; W1857-F2192 HydrophobicContact CZ2-CE2 3.74Å; W1857-F2192 AromaticContact CZ2-CZ 3.52Å; W1857-F2192 HydrophobicContact CZ2-CZ 3.52Å; Y1962-F2192 HydrophobicContact CD1-CD2 4.47Å; Y1962-F2192 HydrophobicContact CD1-CE2 4.12Å; Y1962-F2192 HydrophobicContact CG-CE2 4.44Å; Y1962-F2192 WeakPolarHBondContact O-CB 3.45Å; Y1962-F2192 WeakPolarHBondContact O-CD2 3.49Å; Y1962-F2192 WeakPolarHBondContact O-CG 3.44Å; T1963-F2192 HydrophobicContact CG2-CD1 4.19Å; T1963-F2192 HydrophobicContact CG2-CE1 4.02Å; T1963-F2192 HydrophobicContact CG2-CZ 4.47Å; A2010-F2192 WeakPolarHBondContact CB-O 3.31Å; D2011-F2192 HydrophobicContact CB-CD1 4.03Å; D2011-F2192 HydrophobicContact CB-CD2 3.68Å; D2011-F2192 HydrophobicContact CB-CE1 3.85Å; D2011-F2192 HydrophobicContact CB-CE2 3.49Å; D2011-F2192 VanDerWaalsContact CB-CE2 3.49Å; D2011-F2192 HydrophobicContact CB-CG 3.95Å; D2011-F2192 HydrophobicContact CB-CZ 3.57Å; D2011-F2192 WeakPolarHBondContact CB-O 3.31Å; D2011-F2192 PolarHBondContact N-O 2.91Å; D2011-F2192 PolarHBondContact O-N 2.89Å; V2013-F2192 HydrophobicContact CB-CE1 4.25Å; V2013-F2192 HydrophobicContact CG1-CE1 4.42Å; F2170-F2192 HydrophobicContact CD1-CE1 4.18Å; F2170-F2192 AromaticContact CD1-CZ 3.94Å; F2170-F2192 HydrophobicContact CD1-CZ 3.94Å; F2170-F2192 HydrophobicContact CE1-CE1 4.3Å; F2170-F2192 HydrophobicContact CE1-CZ 4.17Å
2193	V	96.4	Very high	95.1	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.068	C	C	.	.			trans	-128.6	100.9	175.9	-178.7	0	0	0	0	108.5	N1970 L1971 A2010 L2198 L2222 I2224 M2227	N1970-V2193 PolarHBondContact OD1-N 3.03Å; L1971-V2193 HydrophobicContact CB-CB 4.37Å; L1971-V2193 HydrophobicContact CB-CG1 4.29Å; L1971-V2193 WeakPolarHBondContact CB-O 3.41Å; L1971-V2193 HydrophobicContact CD1-CG1 4.37Å; L1971-V2193 WeakPolarHBondContact CG-O 3.35Å; L1971-V2193 PolarHBondContact N-O 3.11Å; A2010-V2193 HydrophobicContact CB-CG2 4.24Å; V2193-L2198 HydrophobicContact CG1-CD2 4.05Å; V2193-L2222 HydrophobicContact CG2-CD1 4.2Å; V2193-I2224 HydrophobicContact CG1-CD1 3.84Å; V2193-I2224 HydrophobicContact CG2-CD1 4.43Å; V2193-M2227 HydrophobicContact CB-CE 3.55Å; V2193-M2227 HydrophobicContact CG1-CE 3.89Å; V2193-M2227 HydrophobicContact CG2-CE 3.57Å; V2193-M2227 HydrophobicContact CG2-SD 4.42Å
2194	S	97	Very high	94.9	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.069	C	C	.	.			trans	-77.2	151.5	176.1	68.2	0	0	0	0	111.8	W1857 D2011 E2196	W1857-S2194 PolarHBondContact NE1-OG 3.14Å; D2011-S2194 WeakPolarHBondContact OD2-CB 3.43Å; D2011-S2194 PolarHBondContact OD2-N 2.96Å; D2011-S2194 PolarHBondContact OD2-OG 3.44Å; S2194-E2196 VanDerWaalsContact CB-OE2 3.31Å; S2194-E2196 WeakPolarHBondContact CB-OE2 3.28Å; S2194-E2196 PolarHBondContact O-N 3.33Å
2195	P	96.6	Very high	94.5	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.006	7%	0.073	C	C	.	.	S	Bend	trans	-67	-22.3	174.8	26.7	-34.6	0	0	0	113.7	Y1464 C1468 A1469 L1969 L1971	Y1464-P2195 HydrophobicContact CE1-CG 4.46Å; C1468-P2195 HydrophobicContact CB-CB 3.93Å; C1468-P2195 HydrophobicContact CB-CG 4.35Å; A1469-P2195 HydrophobicContact CB-CB 4.22Å; L1969-P2195 WeakPolarHBondContact O-CD 3.34Å; L1971-P2195 HydrophobicContact CD1-CB 4.25Å
2196	E	96.6	Very high	94	Very high	19 Å²	19	17.2 Å²	17.2	9%	0.089	9%	0.089	C	C	.	.	S	Bend	trans	-66.9	-49.4	179.1	-63.4	88.6	147	0	0	112	Y1464 R1858 Y1962 S2194 L2198 P2199	Y1464-E2196 WeakPolarHBondContact CE1-OE1 3.43Å; Y1464-E2196 PolarHBondContact OH-OE1 2.88Å; Y1464-E2196 VanDerWaalsContact OH-OE1 3.06Å; R1858-E2196 HydrophobicContact CG-CG 3.71Å; Y1962-E2196 WeakPolarHBondContact CE1-OE1 3.2Å; Y1962-E2196 PolarHBondContact OH-OE1 3.44Å; S2194-E2196 VanDerWaalsContact CB-OE2 3.31Å; S2194-E2196 WeakPolarHBondContact CB-OE2 3.28Å; S2194-E2196 PolarHBondContact O-N 3.33Å; E2196-L2198 PolarHBondContact O-N 2.83Å; E2196-P2199 VanDerWaalsContact O-CD 3.3Å; E2196-P2199 WeakPolarHBondContact O-CD 3.39Å
2197	H	96.6	Very high	93.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	-92.5	13.2	-173.3	-59.2	141.9	0	0	0	115.1	W1857 N1860 D2011 P2172 A2173 P2199 Q2200 C2201	W1857-H2197 AromaticContact CD1-CE1 3.85Å; W1857-H2197 AromaticContact CD2-CE1 3.42Å; W1857-H2197 VanDerWaalsContact CD2-CE1 3.42Å; W1857-H2197 AromaticContact CE2-CE1 3.25Å; W1857-H2197 AromaticContact CE2-ND1 3.46Å; W1857-H2197 AromaticContact CE3-CE1 3.87Å; W1857-H2197 AromaticContact CG-CE1 3.85Å; W1857-H2197 AromaticContact CZ2-CE1 3.63Å; W1857-H2197 AromaticContact CZ2-ND1 3.62Å; W1857-H2197 AromaticContact NE1-CE1 3.45Å; W1857-H2197 PolarHBondContact NE1-CE1 3.41Å; W1857-H2197 AromaticContact NE1-ND1 3.46Å; W1857-H2197 PolarHBondContact NE1-ND1 3.37Å; W1857-H2197 PolarHBondContact O-NE2 3.44Å; N1860-H2197 PolarHBondContact OD1-CD2 2.93Å; N1860-H2197 VanDerWaalsContact OD1-CD2 3.32Å; N1860-H2197 PolarHBondContact OD1-NE2 3.3Å; D2011-H2197 IonicContact OD1-CE1 2.65Å; D2011-H2197 IonicContact OD1-CG 2.71Å; D2011-H2197 IonicContact OD1-ND1 3.19Å; D2011-H2197 PolarHBondContact OD1-ND1 2.94Å; D2011-H2197 IonicContact OD2-ND1 3.07Å; P2172-H2197 VanDerWaalsContact CB-CE1 3.44Å; P2172-H2197 WeakPolarHBondContact CB-CE1 3.38Å; A2173-H2197 HydrophobicContact CB-CB 3.98Å; H2197-P2199 VanDerWaalsContact C-N 3.33Å; H2197-Q2200 VanDerWaalsContact CA-OE1 3.31Å; H2197-Q2200 PolarHBondContact O-N 3.48Å; H2197-Q2200 PolarHBondContact O-OE1 3.37Å; H2197-C2201 PolarHBondContact O-N 2.91Å; H2197-C2201 PolarHBondContact O-SG 3.43Å
2198	L	94.8	Very high	93.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-52.5	-40.8	172.2	-75.9	173.5	0	0	0	114	A1469 L1472 L1971 V2193 E2196 Q2200 C2201 F2202 I2224 L2228	A1469-L2198 HydrophobicContact CB-CD1 3.66Å; L1472-L2198 HydrophobicContact CD2-CB 3.51Å; L1472-L2198 HydrophobicContact CD2-CD1 4.07Å; L1472-L2198 HydrophobicContact CD2-CG 4.43Å; L1971-L2198 HydrophobicContact CD1-CD1 3.68Å; L1971-L2198 HydrophobicContact CD1-CD2 3.78Å; L1971-L2198 HydrophobicContact CD1-CG 3.89Å; V2193-L2198 HydrophobicContact CG1-CD2 4.05Å; E2196-L2198 PolarHBondContact O-N 2.83Å; L2198-Q2200 VanDerWaalsContact C-N 3.31Å; L2198-Q2200 PolarHBondContact O-N 3.1Å; L2198-C2201 WeakPolarHBondContact O-CB 3.32Å; L2198-C2201 PolarHBondContact O-N 3.22Å; L2198-F2202 VanDerWaalsContact O-CD2 3.28Å; L2198-F2202 WeakPolarHBondContact O-CD2 3.24Å; L2198-F2202 PolarHBondContact O-N 3.29Å; L2198-I2224 HydrophobicContact CD2-CD1 4.45Å; L2198-I2224 HydrophobicContact CD2-CG2 3.73Å; L2198-L2228 HydrophobicContact CD1-CD1 3.89Å
2199	P	93	Very high	92.7	Very high	63 Å²	63	20 Å²	20	41%	0.409	10%	0.101	S	C	.	.	H	α-helix	trans	-57.8	-40.6	177.2	-24.8	35.5	0	0	0	113.4	E2196 H2197 F2202 Q2203	E2196-P2199 VanDerWaalsContact O-CD 3.3Å; E2196-P2199 WeakPolarHBondContact O-CD 3.39Å; H2197-P2199 VanDerWaalsContact C-N 3.33Å; P2199-F2202 WeakPolarHBondContact O-CB 3.21Å; P2199-F2202 PolarHBondContact O-N 3.49Å; P2199-Q2203 PolarHBondContact O-N 3.48Å
2200	Q	94.6	Very high	92.2	Very high	20 Å²	20	26.3 Å²	26.3	9%	0.093	13%	0.129	C	C	.	.	H	α-helix	trans	-68.7	-46	177.3	-65.1	80.6	-16.6	0	0	110.1	N1860 P2106 A2173 H2197 L2198 F2202 Q2203 L2204	N1860-Q2200 PolarHBondContact ND2-NE2 2.97Å; N1860-Q2200 PolarHBondContact OD1-NE2 2.94Å; P2106-Q2200 HydrophobicContact CB-CG 4.32Å; P2106-Q2200 HydrophobicContact CG-CG 4.5Å; A2173-Q2200 VanDerWaalsContact O-CB 3.29Å; A2173-Q2200 WeakPolarHBondContact O-CB 3.22Å; H2197-Q2200 VanDerWaalsContact CA-OE1 3.31Å; H2197-Q2200 PolarHBondContact O-N 3.48Å; H2197-Q2200 PolarHBondContact O-OE1 3.37Å; L2198-Q2200 VanDerWaalsContact C-N 3.31Å; L2198-Q2200 PolarHBondContact O-N 3.1Å; Q2200-F2202 PolarHBondContact O-N 3.24Å; Q2200-Q2203 WeakPolarHBondContact O-CB 3.45Å; Q2200-Q2203 PolarHBondContact O-N 2.74Å; Q2200-L2204 WeakPolarHBondContact O-CD1 3.48Å; Q2200-L2204 VanDerWaalsContact O-CG 3.27Å; Q2200-L2204 WeakPolarHBondContact O-CG 3.31Å; Q2200-L2204 PolarHBondContact O-N 3.01Å
2201	C	93.9	Very high	91.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-55.2	-39.4	173.1	-60.4	0	0	0	0	112	I2009 H2197 L2198 M2205 I2224	I2009-C2201 PolarHBondContact O-SG 2.84Å; I2009-C2201 VanDerWaalsContact O-SG 3.4Å; H2197-C2201 PolarHBondContact O-N 2.91Å; H2197-C2201 PolarHBondContact O-SG 3.43Å; L2198-C2201 WeakPolarHBondContact O-CB 3.32Å; L2198-C2201 PolarHBondContact O-N 3.22Å; C2201-M2205 WeakPolarHBondContact O-CB 3.21Å; C2201-M2205 PolarHBondContact O-N 3.05Å; C2201-M2205 VanDerWaalsContact O-N 3.1Å; C2201-I2224 HydrophobicContact CB-CD1 3.73Å; C2201-I2224 HydrophobicContact CB-CG1 3.92Å
2202	F	91	Very high	91	Very high	46 Å²	46	27.1 Å²	27.1	20%	0.202	14%	0.137	C	C	.	.	H	α-helix	trans	-69.2	-39.1	174.9	-92	-72.3	0	0	0	113.5	L1472 L2198 P2199 Q2200 E2206 I2224 K2225 L2228	L1472-F2202 HydrophobicContact CD1-CD2 4.18Å; L1472-F2202 HydrophobicContact CD1-CE2 4.16Å; L1472-F2202 HydrophobicContact CD2-CD2 3.9Å; L1472-F2202 HydrophobicContact CD2-CE2 3.8Å; L1472-F2202 HydrophobicContact CG-CD2 4.42Å; L1472-F2202 HydrophobicContact CG-CE2 4.1Å; L2198-F2202 VanDerWaalsContact O-CD2 3.28Å; L2198-F2202 WeakPolarHBondContact O-CD2 3.24Å; L2198-F2202 PolarHBondContact O-N 3.29Å; P2199-F2202 WeakPolarHBondContact O-CB 3.21Å; P2199-F2202 PolarHBondContact O-N 3.49Å; Q2200-F2202 PolarHBondContact O-N 3.24Å; F2202-E2206 PolarHBondContact O-N 2.93Å; F2202-I2224 HydrophobicContact CD2-CG2 3.83Å; F2202-I2224 HydrophobicContact CE1-CG2 4.35Å; F2202-I2224 HydrophobicContact CE2-CG2 3.48Å; F2202-I2224 VanDerWaalsContact CE2-CG2 3.48Å; F2202-I2224 HydrophobicContact CG-CG2 4.4Å; F2202-I2224 HydrophobicContact CZ-CG2 3.77Å; F2202-K2225 HydrophobicContact CE1-CD 4.36Å; F2202-K2225 HydrophobicContact CE1-CG 3.56Å; F2202-K2225 HydrophobicContact CZ-CG 3.79Å; F2202-L2228 HydrophobicContact CE2-CD2 3.97Å; F2202-L2228 HydrophobicContact CZ-CD2 4.2Å
2203	Q	91.8	Very high	90.1	Very high	49 Å²	49	32 Å²	32	23%	0.229	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-53	173.6	178.5	-174.6	-21.7	0	0	110.5	F1678 P2199 Q2200 M2205 E2206 E2207	F1678-Q2203 HydrophobicContact CE1-CB 4Å; F1678-Q2203 HydrophobicContact CE1-CG 4.11Å; F1678-Q2203 HydrophobicContact CZ-CB 4.01Å; F1678-Q2203 HydrophobicContact CZ-CG 4.06Å; F1678-Q2203 VanDerWaalsContact CZ-OE1 3.28Å; P2199-Q2203 PolarHBondContact O-N 3.48Å; Q2200-Q2203 WeakPolarHBondContact O-CB 3.45Å; Q2200-Q2203 PolarHBondContact O-N 2.74Å; Q2203-M2205 VanDerWaalsContact C-N 3.31Å; Q2203-M2205 PolarHBondContact O-N 3.29Å; Q2203-E2206 PolarHBondContact O-N 3.34Å; Q2203-E2207 HydrophobicContact CG-CG 4.29Å; Q2203-E2207 PolarHBondContact NE2-OE1 2.98Å; Q2203-E2207 PolarHBondContact O-N 3.39Å
2204	L	91.6	Very high	89.2	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-40.1	-176.2	-66.1	161.6	0	0	0	111.6	V2007 D2008 I2009 Q2200 E2206 E2207 F2208	V2007-L2204 HydrophobicContact CG1-CD2 4.27Å; V2007-L2204 HydrophobicContact CG2-CD2 4.17Å; D2008-L2204 WeakPolarHBondContact O-CD1 3.41Å; I2009-L2204 HydrophobicContact CG1-CB 4.26Å; Q2200-L2204 WeakPolarHBondContact O-CD1 3.48Å; Q2200-L2204 VanDerWaalsContact O-CG 3.27Å; Q2200-L2204 WeakPolarHBondContact O-CG 3.31Å; Q2200-L2204 PolarHBondContact O-N 3.01Å; L2204-E2206 VanDerWaalsContact C-N 3.27Å; L2204-E2206 PolarHBondContact O-N 3.3Å; L2204-E2207 PolarHBondContact O-N 3.14Å; L2204-F2208 HydrophobicContact CB-CD2 4.19Å; L2204-F2208 HydrophobicContact CB-CE2 3.96Å; L2204-F2208 WeakPolarHBondContact O-CB 3.35Å; L2204-F2208 WeakPolarHBondContact O-CD2 3.46Å; L2204-F2208 WeakPolarHBondContact O-CG 3.43Å; L2204-F2208 PolarHBondContact O-N 2.93Å
2205	M	87.5	Confident	88.5	Confident	23 Å²	23	39.7 Å²	39.7	11%	0.113	21%	0.213	C	C	.	.	H	α-helix	trans	-56.3	-38.9	174	-178	-179.2	-66.5	0	0	112.9	C2201 Q2203 R2209 I2224	C2201-M2205 WeakPolarHBondContact O-CB 3.21Å; C2201-M2205 PolarHBondContact O-N 3.05Å; C2201-M2205 VanDerWaalsContact O-N 3.1Å; Q2203-M2205 VanDerWaalsContact C-N 3.31Å; Q2203-M2205 PolarHBondContact O-N 3.29Å; M2205-R2209 VanDerWaalsContact O-CB 3.28Å; M2205-R2209 WeakPolarHBondContact O-CB 3.37Å; M2205-R2209 PolarHBondContact O-N 3.42Å; M2205-I2224 HydrophobicContact CE-CB 3.73Å; M2205-I2224 HydrophobicContact CE-CG1 3.73Å
2206	E	86.7	Confident	87.5	Confident	70 Å²	70	47.5 Å²	47.5	33%	0.327	25%	0.25	S	C	.	.	H	α-helix	trans	-80.3	-33.6	178	-180	55.2	-148.7	0	0	112.3	F2202 Q2203 L2204 R2209 Q2210	F2202-E2206 PolarHBondContact O-N 2.93Å; Q2203-E2206 PolarHBondContact O-N 3.34Å; L2204-E2206 VanDerWaalsContact C-N 3.27Å; L2204-E2206 PolarHBondContact O-N 3.3Å; E2206-R2209 VanDerWaalsContact CD-NH1 3.29Å; E2206-R2209 PolarHBondContact O-N 3.49Å; E2206-R2209 IonicContact OE1-NH1 3.98Å; E2206-R2209 PolarHBondContact OE1-NH1 2.66Å; E2206-R2209 WeakPolarHBondContact OE2-CD 3.45Å; E2206-R2209 IonicContact OE2-CZ 2.67Å; E2206-R2209 IonicContact OE2-NE 2.85Å; E2206-R2209 IonicContact OE2-NH1 2.7Å; E2206-R2209 PolarHBondContact OE2-NH1 3.16Å; E2206-Q2210 WeakPolarHBondContact O-CG 3.45Å; E2206-Q2210 PolarHBondContact O-N 3.18Å; E2206-Q2210 PolarHBondContact OE1-NE2 3.5Å
2207	E	89.4	Confident	86.8	Confident	35 Å²	35	48.2 Å²	48.2	16%	0.164	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-48.8	171	-68.8	-176.5	172.4	0	0	111.7	R2113 H2136 Q2203 L2204 R2209 Q2210	R2113-E2207 IonicContact CZ-OE1 2.71Å; R2113-E2207 IonicContact CZ-OE2 3.34Å; R2113-E2207 IonicContact NH1-OE1 3.69Å; R2113-E2207 PolarHBondContact NH1-OE1 3.46Å; R2113-E2207 IonicContact NH1-OE2 3.1Å; R2113-E2207 PolarHBondContact NH1-OE2 2.77Å; R2113-E2207 IonicContact NH2-OE1 2.94Å; R2113-E2207 IonicContact NH2-OE2 2.69Å; R2113-E2207 PolarHBondContact NH2-OE2 3.36Å; H2136-E2207 IonicContact CE1-OE2 2.7Å; H2136-E2207 IonicContact NE2-OE2 3.14Å; H2136-E2207 PolarHBondContact NE2-OE2 3.27Å; H2136-E2207 VanDerWaalsContact NE2-OE2 3.09Å; Q2203-E2207 HydrophobicContact CG-CG 4.29Å; Q2203-E2207 PolarHBondContact NE2-OE1 2.98Å; Q2203-E2207 PolarHBondContact O-N 3.39Å; L2204-E2207 PolarHBondContact O-N 3.14Å; E2207-R2209 VanDerWaalsContact C-N 3.29Å; E2207-R2209 PolarHBondContact O-N 2.93Å; E2207-Q2210 WeakPolarHBondContact O-CB 3.36Å; E2207-Q2210 PolarHBondContact O-N 3.04Å
2208	F	87.1	Confident	86	Confident	7 Å²	7	48.8 Å²	48.8	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-60.4	-38.6	177.8	-76.3	-49.7	0	0	0	112.3	I2009 H2136 L2204 Q2210 L2211 N2217	I2009-F2208 HydrophobicContact CB-CE2 3.83Å; I2009-F2208 HydrophobicContact CD1-CD2 3.81Å; I2009-F2208 HydrophobicContact CD1-CE2 4Å; I2009-F2208 HydrophobicContact CG1-CD2 4.23Å; I2009-F2208 HydrophobicContact CG1-CE2 3.98Å; H2136-F2208 HydrophobicContact CB-CE1 4.31Å; H2136-F2208 AromaticContact CE1-CE1 3.45Å; H2136-F2208 VanDerWaalsContact CE1-CE1 3.45Å; H2136-F2208 WeakPolarHBondContact CE1-CE1 3.45Å; H2136-F2208 AromaticContact CE1-CZ 3.62Å; H2136-F2208 AromaticContact CG-CE1 3.73Å; H2136-F2208 AromaticContact ND1-CE1 3.17Å; H2136-F2208 WeakPolarHBondContact ND1-CE1 3.35Å; H2136-F2208 AromaticContact ND1-CZ 3.59Å; L2204-F2208 HydrophobicContact CB-CD2 4.19Å; L2204-F2208 HydrophobicContact CB-CE2 3.96Å; L2204-F2208 WeakPolarHBondContact O-CB 3.35Å; L2204-F2208 WeakPolarHBondContact O-CD2 3.46Å; L2204-F2208 WeakPolarHBondContact O-CG 3.43Å; L2204-F2208 PolarHBondContact O-N 2.93Å; F2208-Q2210 PolarHBondContact O-N 3.16Å; F2208-L2211 HydrophobicContact CD1-CD1 3.79Å; F2208-L2211 HydrophobicContact CE1-CD1 4.49Å; F2208-L2211 WeakPolarHBondContact O-CB 3.48Å; F2208-L2211 PolarHBondContact O-N 2.92Å; F2208-N2217 WeakPolarHBondContact CB-O 3.31Å; F2208-N2217 HydrophobicContact CD1-CB 3.4Å; F2208-N2217 HydrophobicContact CE1-CB 3.53Å; F2208-N2217 HydrophobicContact CG-CB 4.09Å; F2208-N2217 HydrophobicContact CZ-CB 4.32Å
2209	R	84.8	Confident	85.2	Confident	26 Å²	26	52 Å²	52	10%	0.098	27%	0.272	C	S	.	.	H	α-helix	trans	-62.6	-20.6	173.8	177.7	177.1	169.7	-93.6	-18.2	113.6	C1540 T1542 C1562 E1565 M2205 E2206 E2207	C1540-R2209 HydrophobicContact CB-CG 4.26Å; T1542-R2209 HydrophobicContact CG2-CB 4.16Å; T1542-R2209 HydrophobicContact CG2-CG 4.03Å; C1562-R2209 PolarHBondContact SG-NH2 3.48Å; E1565-R2209 IonicContact OE1-CZ 3.4Å; E1565-R2209 IonicContact OE1-NH1 3.81Å; E1565-R2209 IonicContact OE1-NH2 2.7Å; E1565-R2209 PolarHBondContact OE1-NH2 2.59Å; E1565-R2209 IonicContact OE2-NH2 3.19Å; M2205-R2209 VanDerWaalsContact O-CB 3.28Å; M2205-R2209 WeakPolarHBondContact O-CB 3.37Å; M2205-R2209 PolarHBondContact O-N 3.42Å; E2206-R2209 VanDerWaalsContact CD-NH1 3.29Å; E2206-R2209 PolarHBondContact O-N 3.49Å; E2206-R2209 IonicContact OE1-NH1 3.98Å; E2206-R2209 PolarHBondContact OE1-NH1 2.66Å; E2206-R2209 WeakPolarHBondContact OE2-CD 3.45Å; E2206-R2209 IonicContact OE2-CZ 2.67Å; E2206-R2209 IonicContact OE2-NE 2.85Å; E2206-R2209 IonicContact OE2-NH1 2.7Å; E2206-R2209 PolarHBondContact OE2-NH1 3.16Å; E2207-R2209 VanDerWaalsContact C-N 3.29Å; E2207-R2209 PolarHBondContact O-N 2.93Å
2210	Q	82.5	Confident	84.4	Confident	137 Å²	137	49.3 Å²	49.3	64%	0.64	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-7.2	178.5	-69.4	175.1	32.3	0	0	114	E2206 E2207 F2208	E2206-Q2210 WeakPolarHBondContact O-CG 3.45Å; E2206-Q2210 PolarHBondContact O-N 3.18Å; E2206-Q2210 PolarHBondContact OE1-NE2 3.5Å; E2207-Q2210 WeakPolarHBondContact O-CB 3.36Å; E2207-Q2210 PolarHBondContact O-N 3.04Å; F2208-Q2210 PolarHBondContact O-N 3.16Å
2211	L	83.2	Confident	83.7	Confident	17 Å²	17	52.3 Å²	52.3	9%	0.089	27%	0.267	C	S	.	.	S	Bend	trans	-71.8	172.2	174	-60.1	178.9	0	0	0	111.9	D2133 H2136 F2208 H2215	D2133-L2211 HydrophobicContact CB-CD2 4.14Å; H2136-L2211 HydrophobicContact CB-CD1 3.84Å; F2208-L2211 HydrophobicContact CD1-CD1 3.79Å; F2208-L2211 HydrophobicContact CE1-CD1 4.49Å; F2208-L2211 WeakPolarHBondContact O-CB 3.48Å; F2208-L2211 PolarHBondContact O-N 2.92Å; L2211-H2215 HydrophobicContact CB-CB 4.14Å; L2211-H2215 VanDerWaalsContact CD1-ND1 3.25Å; L2211-H2215 WeakPolarHBondContact CD1-ND1 3.38Å
2212	S	80.4	Confident	83.2	Confident	51 Å²	51	52.5 Å²	52.5	36%	0.357	27%	0.268	S	S	.	.			trans	-56.3	138.2	173.1	-179.1	0	0	0	0	111.5	T2214 H2215	S2212-T2214 PolarHBondContact O-N 2.89Å; S2212-T2214 PolarHBondContact OG-N 2.8Å; S2212-T2214 PolarHBondContact OG-OG1 3.29Å; S2212-H2215 VanDerWaalsContact O-CB 3.23Å; S2212-H2215 WeakPolarHBondContact O-CB 3.02Å; S2212-H2215 PolarHBondContact O-N 3.03Å
2213	P	76.3	Confident	83.1	Confident	101 Å²	101	50.7 Å²	50.7	66%	0.656	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-1.3	169.7	-25.2	35.4	0	0	0	115.5
2214	T	78.4	Confident	83.1	Confident	130 Å²	130	48.4 Å²	48.4	80%	0.798	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-1.8	170.6	61.8	0	0	0	0	113.6	S2212	S2212-T2214 PolarHBondContact O-N 2.89Å; S2212-T2214 PolarHBondContact OG-N 2.8Å; S2212-T2214 PolarHBondContact OG-OG1 3.29Å
2215	H	80.9	Confident	83	Confident	32 Å²	32	50.3 Å²	50.3	15%	0.148	26%	0.257	C	S	.	.	S	Bend	trans	-82.3	139.6	-178.3	-173.7	-100.1	0	0	0	111.3	H2136 D2137 L2211 S2212 N2217 H2218	H2136-H2215 PolarHBondContact O-NE2 3.02Å; D2137-H2215 IonicContact OD1-CD2 2.63Å; D2137-H2215 PolarHBondContact OD1-CD2 2.81Å; D2137-H2215 VanDerWaalsContact OD1-CD2 3.26Å; D2137-H2215 IonicContact OD1-NE2 3.27Å; L2211-H2215 HydrophobicContact CB-CB 4.14Å; L2211-H2215 VanDerWaalsContact CD1-ND1 3.25Å; L2211-H2215 WeakPolarHBondContact CD1-ND1 3.38Å; S2212-H2215 VanDerWaalsContact O-CB 3.23Å; S2212-H2215 WeakPolarHBondContact O-CB 3.02Å; S2212-H2215 PolarHBondContact O-N 3.03Å; H2215-N2217 PolarHBondContact ND1-N 3.25Å; H2215-N2217 PolarHBondContact O-N 3.26Å; H2215-H2218 HydrophobicContact CB-CB 4.5Å; H2215-H2218 WeakPolarHBondContact O-CB 3.37Å; H2215-H2218 PolarHBondContact O-N 3.36Å
2216	Q	76.5	Confident	83.2	Confident	165 Å²	165	49.6 Å²	49.6	77%	0.771	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16	-172.6	-177.4	169.8	-19.3	0	0	114.3	K2221	Q2216-K2221 WeakPolarHBondContact O-CE 3.29Å; Q2216-K2221 PolarHBondContact O-NZ 3.43Å
2217	N	81.4	Confident	83.4	Confident	34 Å²	34	46.2 Å²	46.2	18%	0.182	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	2.5	176.8	-62	-20.3	0	0	0	114.4	F2208 H2215 E2219 K2221	F2208-N2217 WeakPolarHBondContact CB-O 3.31Å; F2208-N2217 HydrophobicContact CD1-CB 3.4Å; F2208-N2217 HydrophobicContact CE1-CB 3.53Å; F2208-N2217 HydrophobicContact CG-CB 4.09Å; F2208-N2217 HydrophobicContact CZ-CB 4.32Å; H2215-N2217 PolarHBondContact ND1-N 3.25Å; H2215-N2217 PolarHBondContact O-N 3.26Å; N2217-E2219 VanDerWaalsContact C-N 3.34Å; N2217-E2219 PolarHBondContact O-N 3.27Å; N2217-K2221 PolarHBondContact OD1-NZ 3.39Å
2218	H	81.4	Confident	83.6	Confident	13 Å²	13	44.6 Å²	44.6	6%	0.06	23%	0.231	C	C	.	.			trans	-64.6	-32.8	-178.6	166.2	-82.8	0	0	0	113.6	C1540 H2215 D2220	C1540-H2218 PolarHBondContact O-CE1 2.97Å; C1540-H2218 VanDerWaalsContact O-CE1 3.24Å; H2215-H2218 HydrophobicContact CB-CB 4.5Å; H2215-H2218 WeakPolarHBondContact O-CB 3.37Å; H2215-H2218 PolarHBondContact O-N 3.36Å; H2218-D2220 PolarHBondContact O-N 3.47Å
2219	E	75.9	Confident	83.9	Confident	67 Å²	67	44.3 Å²	44.3	31%	0.313	23%	0.229	S	C	.	.	S	Bend	trans	-71.2	126.3	169.2	-162.2	-173.1	147.4	0	0	109.2	R1534 M1536 E1541 N2217 K2221	R1534-E2219 IonicContact NH1-OE1 2.74Å; R1534-E2219 PolarHBondContact NH1-OE1 2.71Å; M1536-E2219 HydrophobicContact CE-CG 3.86Å; M1536-E2219 WeakPolarHBondContact CE-OE1 3.26Å; E1541-E2219 HydrophobicContact CB-CG 4.38Å; N2217-E2219 VanDerWaalsContact C-N 3.34Å; N2217-E2219 PolarHBondContact O-N 3.27Å; E2219-K2221 WeakPolarHBondContact O-CG 3.05Å; E2219-K2221 PolarHBondContact O-N 2.87Å
2220	D	78.1	Confident	84.1	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.032	23%	0.226	C	C	.	.			trans	-49.4	131	164.3	161.7	10.8	0	0	0	108.9	R1534 T1542 T1543 H2218 L2222 Q2223	R1534-D2220 PolarHBondContact NH1-O 2.73Å; R1534-D2220 VanDerWaalsContact NH2-C 3.31Å; R1534-D2220 PolarHBondContact NH2-O 3.26Å; R1534-D2220 IonicContact NH2-OD1 3.13Å; R1534-D2220 PolarHBondContact NH2-OD1 3.38Å; R1534-D2220 VanDerWaalsContact NH2-OD1 3.14Å; R1534-D2220 IonicContact NH2-OD2 3.13Å; R1534-D2220 PolarHBondContact NH2-OD2 2.89Å; T1542-D2220 HydrophobicContact CG2-CB 3.96Å; T1543-D2220 WeakPolarHBondContact CB-OD2 3.22Å; T1543-D2220 PolarHBondContact N-OD2 3.4Å; T1543-D2220 VanDerWaalsContact N-OD2 3.08Å; T1543-D2220 PolarHBondContact OG1-OD2 3.31Å; H2218-D2220 PolarHBondContact O-N 3.47Å; D2220-L2222 PolarHBondContact OD1-N 2.97Å; D2220-Q2223 PolarHBondContact OD1-N 3.28Å
2221	K	79	Confident	84.6	Confident	84 Å²	84	36.7 Å²	36.7	37%	0.365	20%	0.195	S	C	.	.			trans	-105.1	-26.2	-178.9	-65.8	177.2	-176	176	0	113.7	Q2216 N2217 E2219	Q2216-K2221 WeakPolarHBondContact O-CE 3.29Å; Q2216-K2221 PolarHBondContact O-NZ 3.43Å; N2217-K2221 PolarHBondContact OD1-NZ 3.39Å; E2219-K2221 WeakPolarHBondContact O-CG 3.05Å; E2219-K2221 PolarHBondContact O-N 2.87Å
2222	L	83.5	Confident	85.1	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.021	19%	0.191	C	C	.	.	S	Bend	trans	-99.7	-29.5	-165.8	-63.6	-172.5	0	0	0	114.9	P1982 L1984 I2009 A2010 V2193 D2220 I2224 M2227	P1982-L2222 HydrophobicContact CB-CD2 4.14Å; P1982-L2222 HydrophobicContact CG-CD2 4.46Å; L1984-L2222 HydrophobicContact CD2-CD2 3.63Å; I2009-L2222 HydrophobicContact CB-CD1 4.34Å; I2009-L2222 HydrophobicContact CD1-CD1 4.37Å; I2009-L2222 HydrophobicContact CD1-CG 4.32Å; I2009-L2222 HydrophobicContact CG1-CD1 3.9Å; I2009-L2222 HydrophobicContact CG1-CG 4.34Å; I2009-L2222 HydrophobicContact CG2-CD1 3.93Å; I2009-L2222 HydrophobicContact CG2-CD2 4.39Å; I2009-L2222 HydrophobicContact CG2-CG 4.02Å; I2009-L2222 WeakPolarHBondContact O-CD1 3.34Å; A2010-L2222 HydrophobicContact CB-CD1 4.04Å; A2010-L2222 HydrophobicContact CB-CD2 4.42Å; V2193-L2222 HydrophobicContact CG2-CD1 4.2Å; D2220-L2222 PolarHBondContact OD1-N 2.97Å; L2222-I2224 VanDerWaalsContact C-N 3.34Å; L2222-I2224 HydrophobicContact CB-CD1 3.87Å; L2222-I2224 HydrophobicContact CB-CG1 3.91Å; L2222-I2224 HydrophobicContact CD1-CD1 3.63Å; L2222-I2224 HydrophobicContact CD1-CG1 4.16Å; L2222-I2224 HydrophobicContact CG-CD1 4.44Å; L2222-M2227 HydrophobicContact CB-SD 4.35Å
2223	Q	89	Confident	85.6	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.037	17%	0.174	C	C	.	.			trans	61.1	33.9	-170.1	-42.3	174.6	39.9	0	0	114.2	T1543 V1980 D2220 K2225 N2226 M2227	T1543-Q2223 HydrophobicContact CG2-CB 4.3Å; T1543-Q2223 HydrophobicContact CG2-CG 4.16Å; T1543-Q2223 WeakPolarHBondContact OG1-CG 3.48Å; V1980-Q2223 PolarHBondContact O-NE2 2.79Å; D2220-Q2223 PolarHBondContact OD1-N 3.28Å; Q2223-K2225 PolarHBondContact O-N 2.85Å; Q2223-N2226 HydrophobicContact CB-CB 4.24Å; Q2223-N2226 WeakPolarHBondContact O-CA 3.36Å; Q2223-N2226 WeakPolarHBondContact O-CB 3.44Å; Q2223-N2226 PolarHBondContact O-N 3.39Å; Q2223-N2226 PolarHBondContact OE1-ND2 3.23Å; Q2223-M2227 PolarHBondContact O-N 3.45Å
2224	I	90.8	Very high	86.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-39.9	-41.5	-174.6	-64.5	-65.8	0	0	0	114.9	V2193 L2198 C2201 F2202 M2205 L2222 N2226 M2227 L2228	V2193-I2224 HydrophobicContact CG1-CD1 3.84Å; V2193-I2224 HydrophobicContact CG2-CD1 4.43Å; L2198-I2224 HydrophobicContact CD2-CD1 4.45Å; L2198-I2224 HydrophobicContact CD2-CG2 3.73Å; C2201-I2224 HydrophobicContact CB-CD1 3.73Å; C2201-I2224 HydrophobicContact CB-CG1 3.92Å; F2202-I2224 HydrophobicContact CD2-CG2 3.83Å; F2202-I2224 HydrophobicContact CE1-CG2 4.35Å; F2202-I2224 HydrophobicContact CE2-CG2 3.48Å; F2202-I2224 VanDerWaalsContact CE2-CG2 3.48Å; F2202-I2224 HydrophobicContact CG-CG2 4.4Å; F2202-I2224 HydrophobicContact CZ-CG2 3.77Å; M2205-I2224 HydrophobicContact CE-CB 3.73Å; M2205-I2224 HydrophobicContact CE-CG1 3.73Å; L2222-I2224 VanDerWaalsContact C-N 3.34Å; L2222-I2224 HydrophobicContact CB-CD1 3.87Å; L2222-I2224 HydrophobicContact CB-CG1 3.91Å; L2222-I2224 HydrophobicContact CD1-CD1 3.63Å; L2222-I2224 HydrophobicContact CD1-CG1 4.16Å; L2222-I2224 HydrophobicContact CG-CD1 4.44Å; I2224-N2226 VanDerWaalsContact C-N 3.32Å; I2224-N2226 PolarHBondContact O-N 3.2Å; I2224-M2227 HydrophobicContact CD1-SD 4.02Å; I2224-M2227 WeakPolarHBondContact O-CB 3.35Å; I2224-M2227 PolarHBondContact O-N 3.32Å; I2224-M2227 VanDerWaalsContact O-N 3.15Å; I2224-L2228 WeakPolarHBondContact O-CB 3.25Å; I2224-L2228 PolarHBondContact O-N 3.42Å
2225	K	91.2	Very high	87	Confident	46 Å²	46	22.7 Å²	22.7	20%	0.2	11%	0.106	C	C	.	.	H	α-helix	trans	-59	-38	177.6	-68.6	-177.7	177.1	-176	0	113.4	L1476 F1545 F2202 Q2223 F2229	L1476-K2225 HydrophobicContact CD1-CD 4.01Å; L1476-K2225 HydrophobicContact CD1-CG 4.19Å; L1476-K2225 HydrophobicContact CD2-CB 4.24Å; L1476-K2225 HydrophobicContact CD2-CG 4.31Å; F1545-K2225 HydrophobicContact CB-CB 3.66Å; F1545-K2225 HydrophobicContact CB-CD 3.68Å; F1545-K2225 HydrophobicContact CB-CG 4.29Å; F1545-K2225 HydrophobicContact CD2-CB 3.86Å; F1545-K2225 HydrophobicContact CG-CB 3.76Å; F1545-K2225 HydrophobicContact CG-CD 4.3Å; F2202-K2225 HydrophobicContact CE1-CD 4.36Å; F2202-K2225 HydrophobicContact CE1-CG 3.56Å; F2202-K2225 HydrophobicContact CZ-CG 3.79Å; Q2223-K2225 PolarHBondContact O-N 2.85Å; K2225-F2229 WeakPolarHBondContact O-CB 3.44Å; K2225-F2229 PolarHBondContact O-N 2.82Å; K2225-F2229 VanDerWaalsContact O-N 3.13Å
2226	N	90.1	Very high	87.6	Confident	8 Å²	8	21.2 Å²	21.2	4%	0.043	10%	0.099	C	C	.	.	H	α-helix	trans	-68.6	-44.2	174.2	-64.7	-10.2	0	0	0	110.6	F1545 L1975 Q2223 I2224 F2229 H2230	F1545-N2226 WeakPolarHBondContact CD2-OD1 3.31Å; L1975-N2226 HydrophobicContact CD2-CB 3.84Å; Q2223-N2226 HydrophobicContact CB-CB 4.24Å; Q2223-N2226 WeakPolarHBondContact O-CA 3.36Å; Q2223-N2226 WeakPolarHBondContact O-CB 3.44Å; Q2223-N2226 PolarHBondContact O-N 3.39Å; Q2223-N2226 PolarHBondContact OE1-ND2 3.23Å; I2224-N2226 VanDerWaalsContact C-N 3.32Å; I2224-N2226 PolarHBondContact O-N 3.2Å; N2226-F2229 PolarHBondContact O-N 3.47Å; N2226-H2230 PolarHBondContact O-CD2 3.4Å; N2226-H2230 VanDerWaalsContact O-CD2 3.28Å; N2226-H2230 PolarHBondContact O-N 2.71Å
2227	M	91.9	Very high	88.2	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-61.4	-48	-179.1	-58.1	174	66	0	0	111.4	L1971 A1972 L1975 V2193 L2222 Q2223 I2224 F2229 H2230 G2231	L1971-M2227 VanDerWaalsContact C-CE 3.48Å; L1971-M2227 HydrophobicContact CB-CB 4.36Å; L1971-M2227 HydrophobicContact CB-CE 4.04Å; A1972-M2227 HydrophobicContact CB-CE 4.04Å; L1975-M2227 HydrophobicContact CD1-CG 3.81Å; L1975-M2227 HydrophobicContact CD2-CB 4.44Å; L1975-M2227 HydrophobicContact CD2-CG 3.92Å; L1975-M2227 HydrophobicContact CG-CG 3.88Å; V2193-M2227 HydrophobicContact CB-CE 3.55Å; V2193-M2227 HydrophobicContact CG1-CE 3.89Å; V2193-M2227 HydrophobicContact CG2-CE 3.57Å; V2193-M2227 HydrophobicContact CG2-SD 4.42Å; L2222-M2227 HydrophobicContact CB-SD 4.35Å; Q2223-M2227 PolarHBondContact O-N 3.45Å; I2224-M2227 HydrophobicContact CD1-SD 4.02Å; I2224-M2227 WeakPolarHBondContact O-CB 3.35Å; I2224-M2227 PolarHBondContact O-N 3.32Å; I2224-M2227 VanDerWaalsContact O-N 3.15Å; M2227-F2229 PolarHBondContact O-N 3.18Å; M2227-H2230 PolarHBondContact O-N 2.97Å; M2227-G2231 PolarHBondContact O-N 3.2Å
2228	L	93.8	Very high	88.7	Confident	1 Å²	1	12.9 Å²	12.9	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-59.5	-45.2	174.4	174.8	57.7	0	0	0	111.8	A1469 L1472 F1473 L1476 L2198 F2202 I2224 I2232	A1469-L2228 HydrophobicContact CB-CD1 3.83Å; L1472-L2228 HydrophobicContact CB-CD2 4.48Å; L1472-L2228 HydrophobicContact CD2-CD2 4.12Å; L1472-L2228 HydrophobicContact CG-CD2 3.81Å; F1473-L2228 HydrophobicContact CB-CD1 4.05Å; F1473-L2228 HydrophobicContact CB-CD2 4.41Å; F1473-L2228 HydrophobicContact CB-CG 4.22Å; F1473-L2228 HydrophobicContact CD2-CG 4.15Å; L1476-L2228 HydrophobicContact CD2-CD2 4.15Å; L2198-L2228 HydrophobicContact CD1-CD1 3.89Å; F2202-L2228 HydrophobicContact CE2-CD2 3.97Å; F2202-L2228 HydrophobicContact CZ-CD2 4.2Å; I2224-L2228 WeakPolarHBondContact O-CB 3.25Å; I2224-L2228 PolarHBondContact O-N 3.42Å; L2228-I2232 HydrophobicContact CD1-CD1 4.47Å; L2228-I2232 HydrophobicContact CD1-CG1 3.78Å; L2228-I2232 WeakPolarHBondContact O-CB 3.5Å; L2228-I2232 VanDerWaalsContact O-CG1 3.31Å; L2228-I2232 WeakPolarHBondContact O-CG1 3.45Å; L2228-I2232 PolarHBondContact O-N 3.11Å; L2228-I2232 VanDerWaalsContact O-N 3.08Å
2229	F	92.4	Very high	89.2	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-60.8	-50.6	179	178.4	-85.4	0	0	0	112.1	W1447 F1473 L1477 F1545 L1630 L1638 K2225 N2226 M2227 K2233	W1447-F2229 HydrophobicContact CB-CZ 4.35Å; W1447-F2229 HydrophobicContact CE3-CD1 4.33Å; W1447-F2229 AromaticContact CE3-CE1 3.7Å; W1447-F2229 HydrophobicContact CE3-CE1 3.7Å; W1447-F2229 AromaticContact CE3-CZ 3.97Å; W1447-F2229 HydrophobicContact CE3-CZ 3.97Å; W1447-F2229 HydrophobicContact CZ3-CE1 4.37Å; W1447-F2229 WeakPolarHBondContact O-CZ 3.44Å; F1473-F2229 HydrophobicContact CE2-CB 4.15Å; F1473-F2229 AromaticContact CE2-CD2 3.65Å; F1473-F2229 HydrophobicContact CE2-CD2 3.65Å; F1473-F2229 HydrophobicContact CE2-CE2 4.43Å; F1473-F2229 HydrophobicContact CE2-CG 4.22Å; F1473-F2229 HydrophobicContact CZ-CD2 4Å; F1473-F2229 HydrophobicContact CZ-CE2 4.36Å; L1477-F2229 HydrophobicContact CD2-CD2 4.49Å; F1545-F2229 HydrophobicContact CE2-CB 3.62Å; F1545-F2229 AromaticContact CE2-CD2 3.96Å; F1545-F2229 HydrophobicContact CE2-CD2 3.96Å; F1545-F2229 AromaticContact CE2-CG 3.85Å; F1545-F2229 HydrophobicContact CE2-CG 3.85Å; F1545-F2229 HydrophobicContact CZ-CB 3.98Å; F1545-F2229 AromaticContact CZ-CD2 3.55Å; F1545-F2229 HydrophobicContact CZ-CD2 3.55Å; F1545-F2229 HydrophobicContact CZ-CE2 4.33Å; F1545-F2229 AromaticContact CZ-CG 3.94Å; F1545-F2229 HydrophobicContact CZ-CG 3.94Å; L1630-F2229 HydrophobicContact CD2-CE2 3.75Å; L1630-F2229 HydrophobicContact CD2-CZ 3.98Å; L1638-F2229 HydrophobicContact CD1-CE2 3.44Å; L1638-F2229 VanDerWaalsContact CD1-CE2 3.44Å; L1638-F2229 HydrophobicContact CD1-CZ 3.67Å; K2225-F2229 WeakPolarHBondContact O-CB 3.44Å; K2225-F2229 PolarHBondContact O-N 2.82Å; K2225-F2229 VanDerWaalsContact O-N 3.13Å; N2226-F2229 PolarHBondContact O-N 3.47Å; M2227-F2229 PolarHBondContact O-N 3.18Å; F2229-K2233 HydrophobicContact CE1-CD 4.16Å; F2229-K2233 VanDerWaalsContact O-CB 3.28Å; F2229-K2233 WeakPolarHBondContact O-CB 3.44Å; F2229-K2233 PolarHBondContact O-N 3.43Å
2230	H	90.3	Very high	89.8	Confident	4 Å²	4	11.5 Å²	11.5	2%	0.019	6%	0.056	C	C	.	.	H	α-helix	trans	-72.3	-38.4	-177.9	-73.3	-74.6	0	0	0	112.8	R1974 F1979 N2226 M2227 I2232 K2233 D2234	R1974-H2230 WeakPolarHBondContact O-CB 3.35Å; F1979-H2230 AromaticContact CD2-NE2 3.92Å; F1979-H2230 AromaticContact CE2-CE1 3.74Å; F1979-H2230 AromaticContact CE2-NE2 3.27Å; F1979-H2230 VanDerWaalsContact CE2-NE2 3.27Å; F1979-H2230 WeakPolarHBondContact CE2-NE2 3.27Å; F1979-H2230 AromaticContact CZ-NE2 3.69Å; N2226-H2230 PolarHBondContact O-CD2 3.4Å; N2226-H2230 VanDerWaalsContact O-CD2 3.28Å; N2226-H2230 PolarHBondContact O-N 2.71Å; M2227-H2230 PolarHBondContact O-N 2.97Å; H2230-I2232 PolarHBondContact O-N 2.9Å; H2230-K2233 PolarHBondContact O-N 2.95Å; H2230-D2234 WeakPolarHBondContact O-CB 3.49Å; H2230-D2234 PolarHBondContact O-N 2.84Å
2231	G	92.9	Very high	90.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-58.9	-44	174.8	0	0	0	0	0	113.1	M2227 A2235	M2227-G2231 PolarHBondContact O-N 3.2Å; G2231-A2235 WeakPolarHBondContact O-CB 3.01Å; G2231-A2235 PolarHBondContact O-N 3.08Å; G2231-A2235 VanDerWaalsContact O-N 3.08Å
2232	I	93.7	Very high	90.2	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-73	-39.3	175.6	-61.8	-80.4	0	0	0	111.4	L1465 L1466 A1469 F1473 L1642 L2228 H2230 D2234 A2235 L2236	L1465-I2232 HydrophobicContact CD2-CD1 3.47Å; L1465-I2232 VanDerWaalsContact CD2-CD1 3.47Å; L1465-I2232 HydrophobicContact CD2-CG1 3.95Å; L1466-I2232 HydrophobicContact CD2-CD1 3.83Å; L1466-I2232 HydrophobicContact CD2-CG2 3.92Å; A1469-I2232 HydrophobicContact CB-CD1 4.1Å; F1473-I2232 HydrophobicContact CB-CD1 4.38Å; F1473-I2232 HydrophobicContact CB-CG1 3.91Å; F1473-I2232 HydrophobicContact CB-CG2 4.5Å; F1473-I2232 HydrophobicContact CD1-CB 3.94Å; F1473-I2232 HydrophobicContact CD1-CG1 4.25Å; F1473-I2232 HydrophobicContact CD1-CG2 3.33Å; F1473-I2232 HydrophobicContact CD2-CB 4.32Å; F1473-I2232 HydrophobicContact CD2-CG1 4.37Å; F1473-I2232 HydrophobicContact CE1-CB 4.12Å; F1473-I2232 HydrophobicContact CE1-CG2 3.48Å; F1473-I2232 VanDerWaalsContact CE1-CG2 3.48Å; F1473-I2232 HydrophobicContact CG-CB 4.01Å; F1473-I2232 HydrophobicContact CG-CG1 3.93Å; F1473-I2232 HydrophobicContact CG-CG2 3.91Å; F1473-I2232 HydrophobicContact CZ-CB 4.39Å; F1473-I2232 HydrophobicContact CZ-CG2 4.19Å; L1642-I2232 HydrophobicContact CD1-CG2 4.25Å; L2228-I2232 HydrophobicContact CD1-CD1 4.47Å; L2228-I2232 HydrophobicContact CD1-CG1 3.78Å; L2228-I2232 WeakPolarHBondContact O-CB 3.5Å; L2228-I2232 VanDerWaalsContact O-CG1 3.31Å; L2228-I2232 WeakPolarHBondContact O-CG1 3.45Å; L2228-I2232 PolarHBondContact O-N 3.11Å; L2228-I2232 VanDerWaalsContact O-N 3.08Å; H2230-I2232 PolarHBondContact O-N 2.9Å; I2232-D2234 VanDerWaalsContact C-N 3.29Å; I2232-D2234 PolarHBondContact O-N 3.19Å; I2232-A2235 PolarHBondContact O-N 2.87Å; I2232-L2236 HydrophobicContact CG2-CD1 3.69Å; I2232-L2236 HydrophobicContact CG2-CG 3.98Å; I2232-L2236 WeakPolarHBondContact O-CB 3.46Å; I2232-L2236 VanDerWaalsContact O-CG 3.25Å; I2232-L2236 WeakPolarHBondContact O-CG 3.44Å; I2232-L2236 PolarHBondContact O-N 3.23Å
2233	K	90.6	Very high	89.5	Confident	2 Å²	2	12.7 Å²	12.7	1%	0.009	7%	0.07	C	C	.	.	H	α-helix	trans	-55.8	-46.1	176.7	-165.7	-165.8	84.5	149.9	0	111.3	L1446 W1447 E1448 M1449 F2229 H2230 S2237	L1446-K2233 PolarHBondContact O-NZ 3.42Å; W1447-K2233 WeakPolarHBondContact O-CD 3.39Å; E1448-K2233 WeakPolarHBondContact O-CD 3.43Å; E1448-K2233 WeakPolarHBondContact O-CE 3.28Å; E1448-K2233 PolarHBondContact O-NZ 2.77Å; M1449-K2233 HydrophobicContact CG-CG 3.9Å; F2229-K2233 HydrophobicContact CE1-CD 4.16Å; F2229-K2233 VanDerWaalsContact O-CB 3.28Å; F2229-K2233 WeakPolarHBondContact O-CB 3.44Å; F2229-K2233 PolarHBondContact O-N 3.43Å; H2230-K2233 PolarHBondContact O-N 2.95Å; K2233-S2237 WeakPolarHBondContact O-CB 3.39Å; K2233-S2237 PolarHBondContact O-N 2.93Å
2234	D	90.3	Very high	88.1	Confident	3 Å²	3	15.1 Å²	15.1	2%	0.016	8%	0.084	C	C	.	.	H	α-helix	trans	-72.9	-38.7	-178.3	-69	4.7	0	0	0	111.2	S1454 H2230 I2232 S2237 V2238	S1454-D2234 WeakPolarHBondContact CB-OD2 3.28Å; S1454-D2234 PolarHBondContact OG-OD2 2.93Å; H2230-D2234 WeakPolarHBondContact O-CB 3.49Å; H2230-D2234 PolarHBondContact O-N 2.84Å; I2232-D2234 VanDerWaalsContact C-N 3.29Å; I2232-D2234 PolarHBondContact O-N 3.19Å; D2234-S2237 WeakPolarHBondContact O-CB 3.45Å; D2234-S2237 PolarHBondContact O-N 3.03Å; D2234-V2238 PolarHBondContact O-N 2.7Å
2235	A	93.3	Very high	86.5	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.4	-46.1	172.4	0	0	0	0	0	112.8	L1457 A1462 L1465 G2231 I2232 S2237 V2238 L2239	L1457-A2235 HydrophobicContact CD2-CB 3.99Å; A1462-A2235 HydrophobicContact CB-CB 4.05Å; L1465-A2235 HydrophobicContact CB-CB 4.5Å; L1465-A2235 HydrophobicContact CD2-CB 4.34Å; G2231-A2235 WeakPolarHBondContact O-CB 3.01Å; G2231-A2235 PolarHBondContact O-N 3.08Å; G2231-A2235 VanDerWaalsContact O-N 3.08Å; I2232-A2235 PolarHBondContact O-N 2.87Å; A2235-S2237 VanDerWaalsContact C-N 3.29Å; A2235-S2237 PolarHBondContact O-N 2.93Å; A2235-V2238 PolarHBondContact O-N 3.2Å; A2235-L2239 WeakPolarHBondContact O-CB 2.96Å; A2235-L2239 WeakPolarHBondContact O-CD1 3.29Å; A2235-L2239 VanDerWaalsContact O-CG 3.31Å; A2235-L2239 WeakPolarHBondContact O-CG 3.43Å; A2235-L2239 PolarHBondContact O-N 3.14Å; A2235-L2239 VanDerWaalsContact O-N 3.09Å
2236	L	92.8	Very high	84.6	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64	-34.8	174.3	-65.3	170.5	0	0	0	111.5	M1449 L1466 L1642 I1645 I2232 L2239 L2240	M1449-L2236 VanDerWaalsContact CE-C 3.44Å; M1449-L2236 HydrophobicContact CE-CB 3.44Å; M1449-L2236 VanDerWaalsContact CE-CB 3.44Å; M1449-L2236 WeakPolarHBondContact CE-O 3.5Å; M1449-L2236 HydrophobicContact SD-CB 4.22Å; L1466-L2236 HydrophobicContact CD1-CD2 3.9Å; L1466-L2236 HydrophobicContact CD2-CD2 3.79Å; L1466-L2236 HydrophobicContact CD2-CG 4.12Å; L1466-L2236 HydrophobicContact CG-CD2 4.49Å; L1642-L2236 HydrophobicContact CB-CD1 4.4Å; L1642-L2236 HydrophobicContact CD1-CD1 4.33Å; L1642-L2236 HydrophobicContact CD1-CD2 4.11Å; I1645-L2236 HydrophobicContact CB-CD2 4.06Å; I1645-L2236 HydrophobicContact CD1-CB 4.11Å; I1645-L2236 HydrophobicContact CD1-CD2 3.71Å; I1645-L2236 HydrophobicContact CD1-CG 4.47Å; I1645-L2236 HydrophobicContact CG1-CD2 4.5Å; I1645-L2236 HydrophobicContact CG2-CD2 4.04Å; I2232-L2236 HydrophobicContact CG2-CD1 3.69Å; I2232-L2236 HydrophobicContact CG2-CG 3.98Å; I2232-L2236 WeakPolarHBondContact O-CB 3.46Å; I2232-L2236 VanDerWaalsContact O-CG 3.25Å; I2232-L2236 WeakPolarHBondContact O-CG 3.44Å; I2232-L2236 PolarHBondContact O-N 3.23Å; L2236-L2239 PolarHBondContact O-N 3.26Å; L2236-L2240 PolarHBondContact O-N 3.4Å
2237	S	89.9	Confident	82.4	Confident	7 Å²	7	24.7 Å²	24.7	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-47.4	177.6	-167.5	0	0	0	0	111.7	K2233 D2234 A2235 L2239 L2240 T2241	K2233-S2237 WeakPolarHBondContact O-CB 3.39Å; K2233-S2237 PolarHBondContact O-N 2.93Å; D2234-S2237 WeakPolarHBondContact O-CB 3.45Å; D2234-S2237 PolarHBondContact O-N 3.03Å; A2235-S2237 VanDerWaalsContact C-N 3.29Å; A2235-S2237 PolarHBondContact O-N 2.93Å; S2237-L2239 VanDerWaalsContact C-N 3.28Å; S2237-L2239 PolarHBondContact O-N 3.32Å; S2237-L2240 PolarHBondContact O-N 2.66Å; S2237-T2241 PolarHBondContact O-N 3.43Å; S2237-T2241 VanDerWaalsContact O-N 3.17Å; S2237-T2241 PolarHBondContact O-OG1 3.19Å
2238	V	91.4	Very high	79.9	Confident	18 Å²	18	28.2 Å²	28.2	11%	0.109	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-37.3	176.8	168.2	0	0	0	0	111.5	L1457 A1462 D2234 A2235 T2241 S2242	L1457-V2238 HydrophobicContact CB-CG2 4.22Å; L1457-V2238 HydrophobicContact CD2-CG2 4.3Å; A1462-V2238 HydrophobicContact CB-CB 4.44Å; A1462-V2238 HydrophobicContact CB-CG1 4.27Å; D2234-V2238 PolarHBondContact O-N 2.7Å; A2235-V2238 PolarHBondContact O-N 3.2Å; V2238-T2241 PolarHBondContact O-OG1 3.37Å; V2238-T2241 VanDerWaalsContact O-OG1 3.08Å; V2238-S2242 VanDerWaalsContact O-CB 3.31Å; V2238-S2242 WeakPolarHBondContact O-CB 3.49Å; V2238-S2242 PolarHBondContact O-N 2.72Å; V2238-S2242 PolarHBondContact O-OG 3.21Å
2239	L	92.3	Very high	77.3	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-75.3	-27.7	-179	-73.6	167.1	0	0	0	113.5	T1459 A1462 K1463 L1466 I1645 Y1649 A2235 L2236 S2237 N2243	T1459-L2239 HydrophobicContact CG2-CD2 3.63Å; A1462-L2239 HydrophobicContact CB-CD1 3.92Å; A1462-L2239 HydrophobicContact CB-CD2 4.35Å; A1462-L2239 HydrophobicContact CB-CG 3.86Å; K1463-L2239 HydrophobicContact CG-CD2 3.87Å; L1466-L2239 HydrophobicContact CD1-CD1 3.37Å; L1466-L2239 HydrophobicContact CG-CD1 4.2Å; I1645-L2239 HydrophobicContact CG2-CB 3.89Å; I1645-L2239 HydrophobicContact CG2-CD1 4.2Å; Y1649-L2239 HydrophobicContact CD2-CB 4.45Å; Y1649-L2239 HydrophobicContact CD2-CD2 3.95Å; Y1649-L2239 HydrophobicContact CE1-CD2 4.49Å; Y1649-L2239 HydrophobicContact CE2-CB 3.83Å; Y1649-L2239 HydrophobicContact CE2-CD2 3.56Å; Y1649-L2239 HydrophobicContact CE2-CG 4.2Å; Y1649-L2239 PolarHBondContact OH-O 2.99Å; A2235-L2239 WeakPolarHBondContact O-CB 2.96Å; A2235-L2239 WeakPolarHBondContact O-CD1 3.29Å; A2235-L2239 VanDerWaalsContact O-CG 3.31Å; A2235-L2239 WeakPolarHBondContact O-CG 3.43Å; A2235-L2239 PolarHBondContact O-N 3.14Å; A2235-L2239 VanDerWaalsContact O-N 3.09Å; L2236-L2239 PolarHBondContact O-N 3.26Å; S2237-L2239 VanDerWaalsContact C-N 3.28Å; S2237-L2239 PolarHBondContact O-N 3.32Å; L2239-N2243 PolarHBondContact O-N 2.86Å
2240	L	88.4	Confident	74.6	Confident	50 Å²	50	38 Å²	38	26%	0.262	21%	0.208	S	C	.	.	H	α-helix	trans	-68.3	-53.6	166.2	-73	-175.2	0	0	0	111.2	M1449 I1645 L2236 S2237 S2242 N2243 D2244	M1449-L2240 HydrophobicContact CE-CD1 3.48Å; M1449-L2240 VanDerWaalsContact CE-CD1 3.48Å; M1449-L2240 HydrophobicContact CE-CG 4.04Å; I1645-L2240 HydrophobicContact CD1-CD1 4.43Å; I1645-L2240 HydrophobicContact CD1-CD2 3.66Å; I1645-L2240 HydrophobicContact CD1-CG 3.77Å; I1645-L2240 HydrophobicContact CG1-CD2 3.89Å; I1645-L2240 HydrophobicContact CG1-CG 4.5Å; L2236-L2240 PolarHBondContact O-N 3.4Å; S2237-L2240 PolarHBondContact O-N 2.66Å; L2240-S2242 PolarHBondContact O-N 3.33Å; L2240-S2242 VanDerWaalsContact O-N 3.11Å; L2240-N2243 WeakPolarHBondContact O-CA 3.36Å; L2240-N2243 WeakPolarHBondContact O-CB 3.41Å; L2240-N2243 PolarHBondContact O-N 3.45Å; L2240-D2244 PolarHBondContact O-N 3.44Å
2241	T	84	Confident	71.9	Confident	73 Å²	73	44.6 Å²	44.6	45%	0.448	24%	0.243	S	C	.	.	H	α-helix	trans	-62.3	-26	-179.1	54.2	0	0	0	0	113.2	S2237 V2238 N2245	S2237-T2241 PolarHBondContact O-N 3.43Å; S2237-T2241 VanDerWaalsContact O-N 3.17Å; S2237-T2241 PolarHBondContact O-OG1 3.19Å; V2238-T2241 PolarHBondContact O-OG1 3.37Å; V2238-T2241 VanDerWaalsContact O-OG1 3.08Å; T2241-N2245 PolarHBondContact O-ND2 3.39Å
2242	S	81.9	Confident	69	Low	20 Å²	20	51.5 Å²	51.5	14%	0.14	28%	0.28	C	S	.	.	H	α-helix	trans	-73	-32.4	171.5	-58.6	0	0	0	0	112.9	T1459 V2238 L2240	T1459-S2242 WeakPolarHBondContact CG2-OG 3.49Å; T1459-S2242 PolarHBondContact OG1-OG 3.26Å; V2238-S2242 VanDerWaalsContact O-CB 3.31Å; V2238-S2242 WeakPolarHBondContact O-CB 3.49Å; V2238-S2242 PolarHBondContact O-N 2.72Å; V2238-S2242 PolarHBondContact O-OG 3.21Å; L2240-S2242 PolarHBondContact O-N 3.33Å; L2240-S2242 VanDerWaalsContact O-N 3.11Å
2243	N	68.1	Low	65.8	Low	25 Å²	25	58 Å²	58	13%	0.134	32%	0.316	C	S	.	.	H	α-helix	trans	-72.2	-44.3	176.4	168.9	89	0	0	0	111.3	Y1648 L2239 L2240 N2245 N2246 N2247	Y1648-N2243 PolarHBondContact OH-OD1 3.49Å; L2239-N2243 PolarHBondContact O-N 2.86Å; L2240-N2243 WeakPolarHBondContact O-CA 3.36Å; L2240-N2243 WeakPolarHBondContact O-CB 3.41Å; L2240-N2243 PolarHBondContact O-N 3.45Å; N2243-N2245 PolarHBondContact O-N 2.94Å; N2243-N2246 WeakPolarHBondContact O-CB 3.36Å; N2243-N2246 PolarHBondContact O-N 2.9Å; N2243-N2246 VanDerWaalsContact O-N 3.08Å; N2243-N2247 PolarHBondContact ND2-ND2 3.39Å; N2243-N2247 PolarHBondContact O-N 3.13Å
2244	D	60.6	Low	62.8	Low	60 Å²	60	65.5 Å²	65.5	32%	0.321	36%	0.355	S	S	.	.	H	α-helix	trans	-68.4	-37.8	-171.5	-53.4	-24.2	0	0	0	111.1	L2240 N2246 N2247 N2248	L2240-D2244 PolarHBondContact O-N 3.44Å; D2244-N2246 PolarHBondContact O-N 3.25Å; D2244-N2247 PolarHBondContact O-N 3.28Å; D2244-N2248 PolarHBondContact O-N 2.8Å; D2244-N2248 VanDerWaalsContact O-N 3.08Å
2245	N	56.9	Low	59.7	Low	101 Å²	101	69.7 Å²	69.7	54%	0.54	39%	0.385	S	S	.	.	H	α-helix	trans	-62.2	-39.6	170.2	-69.8	-8.8	0	0	0	112.8	T2241 N2243 N2249	T2241-N2245 PolarHBondContact O-ND2 3.39Å; N2243-N2245 PolarHBondContact O-N 2.94Å; N2245-N2249 PolarHBondContact O-N 3.02Å; N2245-N2249 VanDerWaalsContact O-N 3.17Å; N2245-N2249 PolarHBondContact O-OD1 3.5Å
2246	N	51.5	Low	56.8	Low	83 Å²	83	75.8 Å²	75.8	44%	0.444	42%	0.422	S	S	.	.	H	α-helix	trans	-69.4	-39	177.6	-77.7	4.2	0	0	0	111.9	N2243 D2244 N2248 N2249 N2250	N2243-N2246 WeakPolarHBondContact O-CB 3.36Å; N2243-N2246 PolarHBondContact O-N 2.9Å; N2243-N2246 VanDerWaalsContact O-N 3.08Å; D2244-N2246 PolarHBondContact O-N 3.25Å; N2246-N2248 VanDerWaalsContact C-N 3.35Å; N2246-N2249 PolarHBondContact O-N 3.27Å; N2246-N2250 WeakPolarHBondContact O-CB 3.38Å; N2246-N2250 PolarHBondContact O-N 3.29Å; N2246-N2250 PolarHBondContact O-ND2 3.02Å
2247	N	44.4	Very low	53.6	Low	71 Å²	71	82.9 Å²	82.9	38%	0.38	46%	0.461	S	S	.	.	H	α-helix	trans	-69.1	-32.7	178.6	-77.4	-5	0	0	0	112.5	N2243 D2244	N2243-N2247 PolarHBondContact ND2-ND2 3.39Å; N2243-N2247 PolarHBondContact O-N 3.13Å; D2244-N2247 PolarHBondContact O-N 3.28Å
2248	N	39.3	Very low	50.8	Low	73 Å²	73	90.6 Å²	90.6	39%	0.39	50%	0.501	S	S	.	.	H	α-helix	trans	-68.5	-46.5	172.7	-71.8	-10.1	0	0	0	111.3	D2244 N2246 N2250 N2251	D2244-N2248 PolarHBondContact O-N 2.8Å; D2244-N2248 VanDerWaalsContact O-N 3.08Å; N2246-N2248 VanDerWaalsContact C-N 3.35Å; N2248-N2250 VanDerWaalsContact C-N 3.32Å; N2248-N2250 PolarHBondContact O-N 3.46Å; N2248-N2251 PolarHBondContact O-N 2.83Å
2249	N	38.3	Very low	47.9	Very low	98 Å²	98	95.9 Å²	95.9	52%	0.524	52%	0.523	S	S	.	.	H	α-helix	trans	-63.4	-35.2	178	-68.5	7.1	0	0	0	113	N2245 N2246 N2251 D2252 D2253	N2245-N2249 PolarHBondContact O-N 3.02Å; N2245-N2249 VanDerWaalsContact O-N 3.17Å; N2245-N2249 PolarHBondContact O-OD1 3.5Å; N2246-N2249 PolarHBondContact O-N 3.27Å; N2249-N2251 PolarHBondContact O-N 3.22Å; N2249-N2251 VanDerWaalsContact O-N 3.1Å; N2249-D2252 PolarHBondContact O-N 3.21Å; N2249-D2252 VanDerWaalsContact O-N 3.14Å; N2249-D2253 PolarHBondContact O-N 3.34Å
2250	N	35.3	Very low	44.8	Very low	108 Å²	108	101 Å²	101	58%	0.578	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-5	179.6	-75.2	-21.5	0	0	0	114.7	N2246 N2248	N2246-N2250 WeakPolarHBondContact O-CB 3.38Å; N2246-N2250 PolarHBondContact O-N 3.29Å; N2246-N2250 PolarHBondContact O-ND2 3.02Å; N2248-N2250 VanDerWaalsContact C-N 3.32Å; N2248-N2250 PolarHBondContact O-N 3.46Å
2251	N	33.1	Very low	41.9	Very low	143 Å²	143	103.2 Å²	103.2	77%	0.765	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-13.4	172.7	-80	-33.6	0	0	0	114	N2248 N2249	N2248-N2251 PolarHBondContact O-N 2.83Å; N2249-N2251 PolarHBondContact O-N 3.22Å; N2249-N2251 VanDerWaalsContact O-N 3.1Å
2252	D	32.8	Very low	39.1	Very low	145 Å²	145	106.3 Å²	106.3	78%	0.775	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-34.6	175	-78.1	-41.4	0	0	0	112.3	N2249 N2254	N2249-D2252 PolarHBondContact O-N 3.21Å; N2249-D2252 VanDerWaalsContact O-N 3.14Å; D2252-N2254 PolarHBondContact O-N 3.19Å; D2252-N2254 VanDerWaalsContact O-N 3.13Å
2253	D	27.6	Very low	36.3	Very low	138 Å²	138	110.6 Å²	110.6	74%	0.738	60%	0.597	S	S	*	*			trans	-88.7	68.1	-178	-83	-40.4	0	0	0	113.5	N2249	N2249-D2253 PolarHBondContact O-N 3.34Å
2254	N	25.8	Very low	34.3	Very low	158 Å²	158	115.3 Å²	115.3	85%	0.845	62%	0.622	S	S	*	*			trans	-126.9	44.7	166.4	-143.6	-13.1	0	0	0	113.2	D2252	D2252-N2254 PolarHBondContact O-N 3.19Å; D2252-N2254 VanDerWaalsContact O-N 3.13Å
2255	S	27	Very low	32.5	Very low	92 Å²	92	121 Å²	121	64%	0.643	65%	0.651	S	S	*	*	S	Bend	trans	-129.1	126	165	174.6	0	0	0	0	110.6
2256	T	31.6	Very low	30.8	Very low	127 Å²	127	123.1 Å²	123.1	78%	0.779	66%	0.658	S	S	*	*			trans	55.7	78.1	169.4	49.3	0	0	0	0	116.4	N2258	T2256-N2258 PolarHBondContact O-N 2.97Å
2257	N	25.7	Very low	29.4	Very low	150 Å²	150	124.3 Å²	124.3	80%	0.802	67%	0.673	S	S	*	*			trans	-52.2	124.7	137.8	-102.1	-70.6	0	0	0	109.1
2258	N	30.7	Very low	28.4	Very low	169 Å²	169	129.1 Å²	129.1	90%	0.904	69%	0.693	S	S	*	*			trans	-134.9	131.3	148.3	-125	-13.1	0	0	0	107.6	T2256	T2256-N2258 PolarHBondContact O-N 2.97Å
2259	K	31.4	Very low	27.7	Very low	129 Å²	129	131.6 Å²	131.6	56%	0.561	71%	0.711	S	S	*	*			trans	-90.6	145.5	-154.9	-88	170.1	155.7	-85.2	0	114
2260	E	26	Very low	27.1	Very low	109 Å²	109	131 Å²	131	51%	0.509	71%	0.707	S	S	.	*			trans	45.2	115.8	131.1	-56.5	159	172.3	0	0	115.9
2261	N	27.4	Very low	26.5	Very low	96 Å²	96	130.9 Å²	130.9	51%	0.513	72%	0.715	S	S	.	*				-164	132.1	53.7	-73.2	-76.3	0	0	0	109.9	M1765	M1765-N2261 WeakPolarHBondContact CB-OD1 3.39Å; M1765-N2261 VanDerWaalsContact CE-OD1 3.29Å; M1765-N2261 WeakPolarHBondContact CE-OD1 3.21Å; M1765-N2261 HydrophobicContact CG-CB 4.33Å; M1765-N2261 HydrophobicContact SD-CB 3.71Å; M1765-N2261 VanDerWaalsContact SD-CG 3.6Å; M1765-N2261 PolarHBondContact SD-OD1 2.85Å
2262	L	25.3	Very low	26.1	Very low	137 Å²	137	133 Å²	133	72%	0.717	72%	0.721	S	S	*	*				90	145.1	63	-151.6	86.8	0	0	0	113.7	M1765	M1765-L2262 HydrophobicContact CE-CB 4.31Å; M1765-L2262 HydrophobicContact CE-CD2 3.35Å; M1765-L2262 HydrophobicContact CE-CG 4.42Å; M1765-L2262 HydrophobicContact SD-CB 3.98Å; M1765-L2262 HydrophobicContact SD-CD2 3.94Å
2263	V	23.8	Very low	25.7	Very low	110 Å²	110	130.2 Å²	130.2	67%	0.667	71%	0.705	S	S	*	*			trans	76.5	91.8	170	-162.3	0	0	0	0	115.9
2264	N	25.8	Very low	25.5	Very low	125 Å²	125	132.7 Å²	132.7	67%	0.668	70%	0.704	S	S	*	*				-149.3	131.4	93.6	-139.4	8.8	0	0	0	113	Q2266	N2264-Q2266 PolarHBondContact ND2-OE1 2.84Å
2265	L	22.4	Very low	25.6	Very low	179 Å²	179	130.4 Å²	130.4	94%	0.937	70%	0.701	S	S	*	*			trans	-108.6	89.5	173.8	-119.2	171.3	0	0	0	106.7
2266	Q	22.1	Very low	25.6	Very low	145 Å²	145	133.1 Å²	133.1	68%	0.678	70%	0.703	S	S	*	*			trans	-148.3	115.8	-178.1	-132.3	157.7	1.7	0	0	112.7	N2264	N2264-Q2266 PolarHBondContact ND2-OE1 2.84Å
2267	S	22.6	Very low	25.2	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	70%	0.701	S	S	*	*			trans	35.3	105.6	152.1	56.8	0	0	0	0	119.6
2268	E	23.3	Very low	25.3	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	70%	0.703	S	S	*	*			trans	-152	108.2	146.9	-135.6	168.2	-140.7	0	0	113
2269	V	24.2	Very low	25.2	Very low	125 Å²	125	134.1 Å²	134.1	76%	0.758	69%	0.691	S	S	*	*			trans	-158.8	119.3	169.5	175.4	0	0	0	0	104.2
2270	N	24.6	Very low	24.8	Very low	84 Å²	84	139.2 Å²	139.2	45%	0.449	71%	0.707	S	S	.	*			cis	-145.4	150.6	-0.7	-100.5	-5.9	0	0	0	110.2	I2293 N2295	N2270-I2293 PolarHBondContact ND2-O 2.81Å; N2270-I2293 VanDerWaalsContact ND2-O 3.07Å; N2270-N2295 WeakPolarHBondContact CB-OD1 3.34Å; N2270-N2295 PolarHBondContact O-ND2 2.79Å; N2270-N2295 PolarHBondContact O-OD1 3.06Å
2271	S	23.5	Very low	24.9	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	72%	0.72	S	S	*	*			trans	-163.1	147.6	150.8	71.7	0	0	0	0	108.1
2272	E	24.6	Very low	24.7	Very low	187 Å²	187	144.5 Å²	144.5	87%	0.874	74%	0.736	S	S	*	*			cis	-134.3	-174	-0.1	-64.4	-174.5	109.9	0	0	110.9
2273	L	23.6	Very low	24.5	Very low	87 Å²	87	142.8 Å²	142.8	46%	0.455	74%	0.736	S	S	.	*			trans	-127.4	116.4	176.8	-169.9	73.9	0	0	0	114.2	I2292 N2294	L2273-I2292 HydrophobicContact CD2-CG2 4.32Å; L2273-N2294 WeakPolarHBondContact CB-ND2 3.25Å
2274	R	25.2	Very low	24.5	Very low	189 Å²	189	143.9 Å²	143.9	71%	0.713	74%	0.743	S	S	*	*			trans	71.1	122.5	155.8	-73.2	173.5	179.9	-162.5	4.6	122.1
2275	S	27	Very low	24.4	Very low	111 Å²	111	143.5 Å²	143.5	78%	0.776	75%	0.745	S	S	*	*				-141.3	123.5	112.3	56.2	0	0	0	0	108.5
2276	H	26.1	Very low	24.4	Very low	148 Å²	148	139.5 Å²	139.5	69%	0.685	73%	0.732	S	S	*	*				62.6	127.4	88.1	-71.6	-14.2	0	0	0	114.6
2277	T	24.3	Very low	24.3	Very low	120 Å²	120	135.1 Å²	135.1	74%	0.736	72%	0.717	S	S	*	*			cis	-165	167.4	3.1	5.1	0	0	0	0	113
2278	R	27.3	Very low	24.3	Very low	224 Å²	224	133.3 Å²	133.3	85%	0.845	70%	0.702	S	S	*	*			trans	101.4	134.7	164.6	-60.5	-166.3	168.5	116.1	-2.8	117
2279	D	27.9	Very low	24.2	Very low	123 Å²	123	129.2 Å²	129.2	66%	0.658	69%	0.693	S	S	*	*			cis	-154.8	119.7	-22.9	-88.4	-42.5	0	0	0	106
2280	R	24.3	Very low	24	Very low	237 Å²	237	128.5 Å²	128.5	89%	0.894	68%	0.681	S	S	*	*				54.4	146.5	100.7	-79.5	-170	170.4	-155.8	-2.8	117
2281	P	28.4	Very low	23.9	Very low	120 Å²	120	130.4 Å²	130.4	78%	0.779	69%	0.69	S	S	*	*			cis	-128.5	172.7	14.3	41.7	-26.9	0	0	0	116.7
2282	F	22.3	Very low	23.8	Very low	196 Å²	196	129.9 Å²	129.9	86%	0.86	68%	0.677	S	S	*	*			trans	-104.2	160.3	168.6	-102	-100.5	0	0	0	111.3
2283	S	22.1	Very low	23.7	Very low	101 Å²	101	125.7 Å²	125.7	71%	0.706	66%	0.66	S	S	*	*			trans	-141.9	111.9	159.3	61.4	0	0	0	0	113.3
2284	T	23.3	Very low	23.8	Very low	133 Å²	133	125.7 Å²	125.7	82%	0.816	66%	0.661	S	S	*	*			trans	50.9	95.4	151	57.9	0	0	0	0	119.9
2285	T	23.1	Very low	23.7	Very low	117 Å²	117	119.9 Å²	119.9	72%	0.718	64%	0.643	S	S	*	*			trans	-143.5	166.5	138.4	6.4	0	0	0	0	111.1	R519	R519-T2285 PolarHBondContact O-OG1 3.22Å
2286	S	22.1	Very low	23.5	Very low	95 Å²	95	120.4 Å²	120.4	66%	0.664	64%	0.638	S	S	*	*			trans	-67.4	170.6	172.9	51.2	0	0	0	0	113.7
2287	S	21.3	Very low	23.5	Very low	52 Å²	52	121.5 Å²	121.5	36%	0.364	64%	0.643	S	S	.	*			trans	110.2	153.7	154.1	77.2	0	0	0	0	118.1	A521 I522	A521-S2287 PolarHBondContact N-OG 2.68Å; I522-S2287 CarbonylContact C-O 3.55Å; I522-S2287 VanDerWaalsContact CA-O 3.25Å; I522-S2287 WeakPolarHBondContact CA-O 3.21Å
2288	T	21.5	Very low	23.4	Very low	72 Å²	72	125.7 Å²	125.7	44%	0.442	65%	0.645	S	S	.	*			trans	71.2	130.2	164.7	-167.4	0	0	0	0	118.6	A521 I522 L523	A521-T2288 HydrophobicContact CB-CG2 3.9Å; I522-T2288 VanDerWaalsContact CG1-O 3.26Å; I522-T2288 WeakPolarHBondContact CG1-O 3.42Å; L523-T2288 WeakPolarHBondContact CB-O 3.28Å; L523-T2288 WeakPolarHBondContact CG-O 3.29Å; L523-T2288 PolarHBondContact N-O 2.99Å
2289	S	20.7	Very low	23.3	Very low	86 Å²	86	120.6 Å²	120.6	60%	0.601	63%	0.632	S	S	*	*			trans	-61.6	133.4	161.3	-44.1	0	0	0	0	110.2	I522	I522-S2289 WeakPolarHBondContact CD1-O 3.16Å; I522-S2289 WeakPolarHBondContact CG1-O 3.43Å
2290	E	20.4	Very low	23	Very low	110 Å²	110	118.5 Å²	118.5	51%	0.514	62%	0.62	S	S	.	*			trans	-90.6	103.5	157.3	-156.1	163	-117.4	0	0	106.4	I522 I2292	I522-E2290 HydrophobicContact CB-CB 4.43Å; I522-E2290 HydrophobicContact CD1-CB 3.94Å; I522-E2290 HydrophobicContact CD1-CG 3.99Å; I522-E2290 HydrophobicContact CG1-CB 3.8Å; I522-E2290 HydrophobicContact CG1-CG 4.34Å; I522-E2290 HydrophobicContact CG2-CB 3.79Å; I522-E2290 HydrophobicContact CG2-CG 4.16Å; E2290-I2292 HydrophobicContact CG-CG1 4.14Å; E2290-I2292 PolarHBondContact O-N 3.34Å
2291	I	22.7	Very low	23	Very low	123 Å²	123	111.4 Å²	111.4	63%	0.631	61%	0.607	S	S	*	*			trans	-75.3	86.4	168.8	-65.7	-178.7	0	0	0	106.6	I2293	I2291-I2293 HydrophobicContact CG2-CB 4.38Å; I2291-I2293 HydrophobicContact CG2-CD1 3.51Å; I2291-I2293 HydrophobicContact CG2-CG1 3.52Å; I2291-I2293 PolarHBondContact O-N 2.67Å
2292	I	22.1	Very low	22.7	Very low	96 Å²	96	113 Å²	113	49%	0.492	61%	0.609	S	S	.	*			trans	-71.8	82.1	160.1	-57.9	-179.8	0	0	0	106.7	L2273 E2290 N2294	L2273-I2292 HydrophobicContact CD2-CG2 4.32Å; E2290-I2292 HydrophobicContact CG-CG1 4.14Å; E2290-I2292 PolarHBondContact O-N 3.34Å; I2292-N2294 HydrophobicContact CG2-CB 4.18Å; I2292-N2294 PolarHBondContact O-N 3.34Å
2293	I	22.3	Very low	22.8	Very low	100 Å²	100	111.1 Å²	111.1	51%	0.513	61%	0.608	S	S	.	*			trans	-74	85.8	153.4	-73	157.1	0	0	0	106.1	N2270 I2291	N2270-I2293 PolarHBondContact ND2-O 2.81Å; N2270-I2293 VanDerWaalsContact ND2-O 3.07Å; I2291-I2293 HydrophobicContact CG2-CB 4.38Å; I2291-I2293 HydrophobicContact CG2-CD1 3.51Å; I2291-I2293 HydrophobicContact CG2-CG1 3.52Å; I2291-I2293 PolarHBondContact O-N 2.67Å
2294	N	24.4	Very low	22.9	Very low	87 Å²	87	111.3 Å²	111.3	47%	0.465	61%	0.609	S	S	.	*			trans	-94.4	99.6	143.9	-97	38.6	0	0	0	106.7	L2273 I2292	L2273-N2294 WeakPolarHBondContact CB-ND2 3.25Å; I2292-N2294 HydrophobicContact CG2-CB 4.18Å; I2292-N2294 PolarHBondContact O-N 3.34Å
2295	N	24.5	Very low	22.9	Very low	66 Å²	66	110.6 Å²	110.6	35%	0.353	60%	0.604	S	S	.	*			trans	33.7	118.2	135.2	-55.3	24	0	0	0	118.1	N2270	N2270-N2295 WeakPolarHBondContact CB-OD1 3.34Å; N2270-N2295 PolarHBondContact O-ND2 2.79Å; N2270-N2295 PolarHBondContact O-OD1 3.06Å
2296	D	22.7	Very low	22.9	Very low	122 Å²	122	112.6 Å²	112.6	65%	0.652	61%	0.609	S	S	*	*				49.8	99.5	121.4	-48.3	-49	0	0	0	118.5
2297	H	24.9	Very low	22.9	Very low	172 Å²	172	116.8 Å²	116.8	80%	0.796	62%	0.615	S	S	*	*				177.2	132.1	84.6	-88.4	-54.7	0	0	0	113.6
2298	R	23	Very low	23.2	Very low	207 Å²	207	117.3 Å²	117.3	78%	0.781	62%	0.619	S	S	*	*				26.5	136.4	119.8	-141	-166	-178.6	163.9	0.8	119.5
2299	M	24.4	Very low	23.4	Very low	118 Å²	118	119.2 Å²	119.2	58%	0.581	63%	0.627	S	S	*	*			trans	95.8	99.8	156.6	-47.4	-155.5	107.2	0	0	118.9	E2090 S2301	E2090-M2299 WeakPolarHBondContact OE1-CA 3.21Å; E2090-M2299 WeakPolarHBondContact OE2-CA 3.17Å; E2090-M2299 WeakPolarHBondContact OE2-CE 3.22Å; E2090-M2299 WeakPolarHBondContact OE2-CG 3.41Å; M2299-S2301 PolarHBondContact O-N 3.34Å
2300	I	21.9	Very low	23.6	Very low	79 Å²	79	119.6 Å²	119.6	41%	0.405	63%	0.629	S	S	.	*			trans	-78.7	85.2	162.4	-58.7	175.9	0	0	0	108.9	E2090	E2090-I2300 PolarHBondContact OE1-N 2.88Å
2301	S	24	Very low	23.9	Very low	88 Å²	88	125.5 Å²	125.5	62%	0.615	65%	0.647	S	S	*	*			trans	174.8	140.5	145	38.5	0	0	0	0	109.6	M2299	M2299-S2301 PolarHBondContact O-N 3.34Å
2302	N	23.7	Very low	24.1	Very low	152 Å²	152	123.9 Å²	123.9	81%	0.813	65%	0.646	S	S	*	*			cis	-113.8	140.6	20.4	-70	-63	0	0	0	114.6	S2304	N2302-S2304 PolarHBondContact O-N 3.43Å
2303	N	23.9	Very low	24.1	Very low	157 Å²	157	128 Å²	128	84%	0.84	66%	0.664	S	S	*	*			trans	-72.3	113.2	151.7	-95.8	-47.8	0	0	0	109.2
2304	S	23.9	Very low	24.1	Very low	106 Å²	106	127.9 Å²	127.9	74%	0.741	67%	0.672	S	S	*	*			trans	-151	82.2	145.1	51.3	0	0	0	0	111	N2302 I2306	N2302-S2304 PolarHBondContact O-N 3.43Å; S2304-I2306 PolarHBondContact O-N 3.44Å
2305	V	22.9	Very low	24	Very low	117 Å²	117	129.2 Å²	129.2	71%	0.709	69%	0.687	S	S	*	*			trans	-48.4	128.1	144.8	176.4	0	0	0	0	108
2306	I	22.9	Very low	24.2	Very low	160 Å²	160	133.6 Å²	133.6	82%	0.821	71%	0.709	S	S	*	*				-159.7	89.7	128.7	-98.1	151.7	0	0	0	109.1	S2304	S2304-I2306 PolarHBondContact O-N 3.44Å
2307	K	23.8	Very low	24.2	Very low	182 Å²	182	135 Å²	135	79%	0.791	71%	0.712	S	S	*	*			trans	-46.5	146	134.5	-92.3	-171.4	176.6	-172.6	0	110
2308	S	27.1	Very low	24.3	Very low	64 Å²	64	135.5 Å²	135.5	45%	0.448	71%	0.708	S	S	.	*			cis	-173.4	-162.4	-7.6	33.1	0	0	0	0	108.1
2309	D	26.1	Very low	24.3	Very low	112 Å²	112	131.9 Å²	131.9	60%	0.599	70%	0.704	S	S	*	*			trans	78.5	131.9	152.4	-48.3	-49	0	0	0	116.9
2310	S	24.7	Very low	24.2	Very low	93 Å²	93	132.3 Å²	132.3	65%	0.65	71%	0.708	S	S	*	*				-158.2	134.2	72.5	42.2	0	0	0	0	115.3
2311	R	26.1	Very low	24.3	Very low	235 Å²	235	136.2 Å²	136.2	89%	0.887	72%	0.724	S	S	*	*	S	Bend	trans	-177.7	88.1	138.9	-102.9	170.8	179.7	-179.5	-0.1	107.6
2312	S	26	Very low	24.5	Very low	88 Å²	88	137.2 Å²	137.2	62%	0.615	72%	0.723	S	S	*	*				98.2	92.8	82	60.7	0	0	0	0	109.3
2313	E	22	Very low	24.5	Very low	184 Å²	184	138.7 Å²	138.7	86%	0.86	72%	0.718	S	S	*	*				76.9	144.3	67.4	-70	178.8	157.2	0	0	113.9
2314	S	23.3	Very low	24.7	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	71%	0.713	S	S	*	*			cis	-164.5	165.3	-20.3	58.3	0	0	0	0	111.8
2315	S	22.1	Very low	24.7	Very low	114 Å²	114	138.2 Å²	138.2	80%	0.797	71%	0.706	S	S	*	*			trans	55.4	102.4	149.7	-58.1	0	0	0	0	122.4
2316	I	29.3	Very low	24.8	Very low	159 Å²	159	138.5 Å²	138.5	82%	0.815	71%	0.708	S	S	*	*			trans	-142.8	122.7	151.9	-50.7	179.6	0	0	0	104.5
2317	H	22.5	Very low	24.8	Very low	151 Å²	151	138.2 Å²	138.2	70%	0.699	71%	0.708	S	S	*	*				81.1	147.8	50.5	-148.1	-76.8	0	0	0	114
2318	Y	26.6	Very low	24.8	Very low	182 Å²	182	134.7 Å²	134.7	71%	0.714	71%	0.706	S	S	*	*			trans	73.2	137.7	-177.5	-58.9	-79.1	0	0	0	114.7
2319	N	23	Very low	24.6	Very low	132 Å²	132	136 Å²	136	71%	0.706	71%	0.711	S	S	*	*			cis	64.3	130	46.5	-152.5	56.4	0	0	0	109.3
2320	L	22.5	Very low	24.5	Very low	127 Å²	127	135.4 Å²	135.4	67%	0.665	70%	0.703	S	S	*	*			cis	-167.7	175.1	-13.4	-158.3	68.1	0	0	0	104.5
2321	Q	24.9	Very low	24.6	Very low	160 Å²	160	132.9 Å²	132.9	75%	0.748	69%	0.686	S	S	*	*			trans	70	135.6	161.3	-60.4	178.7	-17.8	0	0	116.3
2322	N	27.1	Very low	24.6	Very low	110 Å²	110	125.8 Å²	125.8	59%	0.588	66%	0.664	S	S	*	*			cis	-150.7	130.8	1.7	-101.1	-15.5	0	0	0	113.4
2323	Y	24.4	Very low	24.6	Very low	182 Å²	182	126.5 Å²	126.5	71%	0.714	66%	0.66	S	S	*	*			trans	60	156.8	133.4	-68	-140.9	0	0	0	118.5
2324	H	27.9	Very low	24.8	Very low	157 Å²	157	123.6 Å²	123.6	73%	0.727	66%	0.655	S	S	*	*			cis	-119.1	145.3	-2.4	-92.4	-93.9	0	0	0	108.5
2325	V	24	Very low	25	Very low	97 Å²	97	125.6 Å²	125.6	59%	0.588	66%	0.659	S	S	*	*			cis	85.3	131.8	45.5	171.2	0	0	0	0	113.6
2326	T	24.3	Very low	25.2	Very low	123 Å²	123	127.7 Å²	127.7	76%	0.755	65%	0.649	S	S	*	*			trans	62.4	143.1	175.2	50.7	0	0	0	0	116.4
2327	N	22.6	Very low	25.1	Very low	153 Å²	153	124.1 Å²	124.1	82%	0.818	65%	0.651	S	S	*	*			cis	72.8	64.9	34	-140.2	20.3	0	0	0	113.9
2328	S	23.4	Very low	25.5	Very low	109 Å²	109	118.4 Å²	118.4	76%	0.762	63%	0.633	S	S	*	*			trans	-166	131.9	149	-93.7	0	0	0	0	116.7
2329	V	24.7	Very low	25.5	Very low	91 Å²	91	115.9 Å²	115.9	55%	0.552	62%	0.622	S	S	*	*				56.3	113.4	129.4	-174.2	0	0	0	0	119.8
2330	K	23.7	Very low	25.7	Very low	100 Å²	100	114.9 Å²	114.9	44%	0.435	62%	0.621	S	S	.	*			trans	69.7	156.8	156.8	-73.6	164.5	175.4	179.6	0	116.9	Q220 H233	Q220-K2330 HydrophobicContact CB-CD 4.23Å; Q220-K2330 VanDerWaalsContact CD-CE 3.43Å; Q220-K2330 HydrophobicContact CG-CD 3.71Å; Q220-K2330 HydrophobicContact CG-CG 4.27Å; Q220-K2330 VanDerWaalsContact NE2-NZ 3.15Å; H233-K2330 WeakPolarHBondContact CE1-CD 3.31Å; H233-K2330 VanDerWaalsContact NE2-CD 3.29Å; H233-K2330 WeakPolarHBondContact NE2-CD 3.36Å
2331	S	26	Very low	25.9	Very low	40 Å²	40	120.6 Å²	120.6	28%	0.28	63%	0.634	S	S	.	*			trans	-81.8	-174.6	-169.5	55	0	0	0	0	112.5	H219 Q220	H219-S2331 VanDerWaalsContact CB-C 3.45Å; H219-S2331 WeakPolarHBondContact CB-O 3.28Å; H219-S2331 PolarHBondContact CD2-O 3.21Å; Q220-S2331 VanDerWaalsContact CA-OG 3.27Å; Q220-S2331 WeakPolarHBondContact CA-OG 3.4Å; Q220-S2331 PolarHBondContact N-OG 3.17Å; Q220-S2331 PolarHBondContact O-OG 2.76Å
2332	M	25.5	Very low	26.2	Very low	86 Å²	86	116.5 Å²	116.5	42%	0.424	63%	0.634	S	S	.	*			trans	73.5	111.5	153.1	-65.7	-164.3	-164	0	0	123.5	L218 H219	L218-M2332 VanDerWaalsContact C-SD 3.54Å; L218-M2332 HydrophobicContact CD2-CB 3.5Å; L218-M2332 VanDerWaalsContact CD2-CB 3.5Å; L218-M2332 HydrophobicContact CD2-CG 4.34Å; L218-M2332 HydrophobicContact CD2-SD 4.05Å; H219-M2332 VanDerWaalsContact CB-CA 3.44Å; H219-M2332 HydrophobicContact CB-CB 3.4Å; H219-M2332 VanDerWaalsContact CB-CB 3.4Å; H219-M2332 HydrophobicContact CB-CG 4.13Å; H219-M2332 WeakPolarHBondContact CD2-CA 3.32Å; H219-M2332 VanDerWaalsContact CD2-CB 3.48Å; H219-M2332 WeakPolarHBondContact CD2-CB 3.26Å; H219-M2332 PolarHBondContact CD2-N 3.35Å; H219-M2332 PolarHBondContact CD2-O 3.07Å; H219-M2332 WeakPolarHBondContact CE1-CA 3.25Å; H219-M2332 VanDerWaalsContact CE1-CB 3.4Å; H219-M2332 WeakPolarHBondContact CE1-CB 3.42Å; H219-M2332 PolarHBondContact CE1-N 3.41Å; H219-M2332 VanDerWaalsContact N-CB 3.31Å; H219-M2332 WeakPolarHBondContact ND1-CA 3.21Å; H219-M2332 WeakPolarHBondContact ND1-CB 3.04Å; H219-M2332 WeakPolarHBondContact ND1-CG 3.05Å; H219-M2332 PolarHBondContact ND1-N 3.27Å; H219-M2332 WeakPolarHBondContact NE2-CA 3.47Å; H219-M2332 PolarHBondContact NE2-N 3.34Å
2333	N	26.9	Very low	26.3	Very low	102 Å²	102	118.8 Å²	118.8	55%	0.545	64%	0.635	S	S	.	*			trans	72.3	108.1	134.2	-57.7	-3.3	0	0	0	119.3	L218 H219	L218-N2333 HydrophobicContact CD2-CB 4.39Å; H219-N2333 PolarHBondContact NE2-N 3.25Å
2334	T	26.8	Very low	26.5	Very low	123 Å²	123	113.8 Å²	113.8	76%	0.755	62%	0.624	S	S	*	*				75.2	150	126.7	63.7	0	0	0	0	118.3
2335	N	26.8	Very low	26.4	Very low	139 Å²	139	108.2 Å²	108.2	74%	0.743	61%	0.609	S	S	*	*			cis	-137.7	173.4	16.4	-139.4	-24.7	0	0	0	115.4
2336	R	27.3	Very low	26.4	Very low	159 Å²	159	113.5 Å²	113.5	60%	0.6	62%	0.619	S	S	*	*			trans	-68.9	167.4	-179.4	-55.4	172	-178.6	159.8	2.9	112.7	S499 H500	S499-R2336 PolarHBondContact OG-NH1 2.81Å; S499-R2336 PolarHBondContact OG-NH2 3.41Å; H500-R2336 PolarHBondContact O-NH2 2.74Å
2337	G	27.3	Very low	26.9	Very low	83 Å²	83	113.2 Å²	113.2	86%	0.856	62%	0.619	S	S	*	*			trans	116.4	135.3	151.8	0	0	0	0	0	113.5
2338	G	29.2	Very low	27.4	Very low	31 Å²	31	118 Å²	118	32%	0.32	63%	0.626	S	S	.	*			trans	-148.1	-174.2	-174.6	0	0	0	0	0	116.1	Q491 R492	Q491-G2338 VanDerWaalsContact NE2-C 3.34Å; Q491-G2338 PolarHBondContact OE1-O 2.97Å; R492-G2338 PolarHBondContact NH2-O 2.71Å
2339	R	27.8	Very low	27.2	Very low	130 Å²	130	116.2 Å²	116.2	49%	0.491	62%	0.618	S	S	.	*			trans	72.7	125.4	177.6	-97	-175	-171.1	-172.4	8.7	118.7	D490 Q491	D490-R2339 IonicContact OD1-NE 2.9Å; D490-R2339 IonicContact OD2-CZ 3.6Å; D490-R2339 IonicContact OD2-NE 2.8Å; D490-R2339 PolarHBondContact OD2-NE 2.96Å; D490-R2339 IonicContact OD2-NH2 3.14Å; D490-R2339 PolarHBondContact OD2-NH2 2.77Å; Q491-R2339 PolarHBondContact O-NH2 3.34Å
2340	T	27.2	Very low	27.1	Very low	110 Å²	110	116.3 Å²	116.3	68%	0.675	61%	0.614	S	S	*	*			trans	70.1	138.7	140.5	53.9	0	0	0	0	120.3
2341	R	27.1	Very low	27.5	Very low	247 Å²	247	118.2 Å²	118.2	93%	0.932	63%	0.629	S	S	*	*			cis	-168.1	134.3	-18.1	-122.6	174.1	-173.1	175.2	0.3	107.3
2342	G	30.2	Very low	27.4	Very low	74 Å²	74	119.6 Å²	119.6	76%	0.763	63%	0.633	S	S	*	*			trans	-171.3	139.8	177	0	0	0	0	0	115
2343	R	28.2	Very low	27.4	Very low	159 Å²	159	119.4 Å²	119.4	60%	0.6	64%	0.637	S	S	*	*			trans	-106.5	177.4	174.8	-84.9	172.6	158.2	-146.4	-5.9	108.9	L2352	R2343-L2352 HydrophobicContact CG-CD1 4.11Å; R2343-L2352 HydrophobicContact CG-CD2 4.28Å; R2343-L2352 HydrophobicContact CG-CG 4.35Å; R2343-L2352 VanDerWaalsContact CZ-CD1 3.49Å
2344	P	28.6	Very low	27.4	Very low	76 Å²	76	120.7 Å²	120.7	49%	0.494	64%	0.644	S	S	.	*			cis	-132.3	-167.4	-43.5	40.3	-23.8	0	0	0	111.5	L2352	P2344-L2352 HydrophobicContact CB-CB 4.16Å; P2344-L2352 HydrophobicContact CB-CD1 3.6Å; P2344-L2352 HydrophobicContact CB-CG 3.64Å; P2344-L2352 HydrophobicContact CG-CD1 4.03Å
2345	G	26.9	Very low	27.3	Very low	40 Å²	40	122.7 Å²	122.7	41%	0.412	64%	0.644	S	S	.	*			trans	-176.9	-2.9	174.6	0	0	0	0	0	124.7	I2350	G2345-I2350 CarbonylContact C-O 3.57Å; G2345-I2350 WeakPolarHBondContact CA-O 3.22Å; G2345-I2350 PolarHBondContact N-O 3.24Å
2346	R	24.1	Very low	27.4	Very low	208 Å²	208	123.1 Å²	123.1	79%	0.785	64%	0.642	S	S	*	*			trans	61.4	156.7	-172.5	-103	-169.1	163.1	-171.2	-4.4	115.6	R2348 A2349 I2350	R2346-R2348 CarbonylContact O-C 3.12Å; R2346-R2348 PolarHBondContact O-N 3.48Å; R2346-A2349 CarbonylContact C-O 3.43Å; R2346-A2349 CarbonylContact O-C 3.56Å; R2346-A2349 WeakPolarHBondContact O-CA 3.5Å; R2346-A2349 PolarHBondContact O-N 2.66Å; R2346-I2350 PolarHBondContact N-O 2.99Å
2347	P	33.7	Very low	27.4	Very low	117 Å²	117	121 Å²	121	76%	0.76	64%	0.642	S	S	*	*	S	Bend	trans	-59.8	132.3	-176.6	25.4	-34.2	0	0	0	111.3
2348	R	34.3	Very low	27.6	Very low	253 Å²	253	123.3 Å²	123.3	96%	0.955	63%	0.633	S	S	*	*	S	Bend	trans	74.1	56.1	-133.3	-58.8	176.7	160.6	-157.2	-3.5	112.6	R2346	R2346-R2348 CarbonylContact O-C 3.12Å; R2346-R2348 PolarHBondContact O-N 3.48Å
2349	A	19.2	Very low	27.4	Very low	72 Å²	72	129.9 Å²	129.9	60%	0.595	65%	0.653	S	S	*	*	S	Bend	trans	108.6	-158	-169.7	0	0	0	0	0	113.7	R2346	R2346-A2349 CarbonylContact C-O 3.43Å; R2346-A2349 CarbonylContact O-C 3.56Å; R2346-A2349 WeakPolarHBondContact O-CA 3.5Å; R2346-A2349 PolarHBondContact O-N 2.66Å
2350	I	22.2	Very low	27.4	Very low	93 Å²	93	130 Å²	130	48%	0.477	66%	0.663	S	S	.	*			trans	-94.9	146.8	-145	-61.8	157.4	0	0	0	113.5	G2345 R2346	G2345-I2350 CarbonylContact C-O 3.57Å; G2345-I2350 WeakPolarHBondContact CA-O 3.22Å; G2345-I2350 PolarHBondContact N-O 3.24Å; R2346-I2350 PolarHBondContact N-O 2.99Å
2351	D	32.5	Very low	27.2	Very low	141 Å²	141	129 Å²	129	75%	0.754	66%	0.661	S	S	*	*			trans	-32.6	145.2	168.3	-74.4	-57	0	0	0	115.5
2352	L	24.1	Very low	27	Very low	69 Å²	69	121.5 Å²	121.5	36%	0.361	65%	0.646	S	S	.	*			trans	-170.9	143.6	134	-101.1	-160.2	0	0	0	113.2	R2343 P2344	R2343-L2352 HydrophobicContact CG-CD1 4.11Å; R2343-L2352 HydrophobicContact CG-CD2 4.28Å; R2343-L2352 HydrophobicContact CG-CG 4.35Å; R2343-L2352 VanDerWaalsContact CZ-CD1 3.49Å; P2344-L2352 HydrophobicContact CB-CB 4.16Å; P2344-L2352 HydrophobicContact CB-CD1 3.6Å; P2344-L2352 HydrophobicContact CB-CG 3.64Å; P2344-L2352 HydrophobicContact CG-CD1 4.03Å
2353	T	24.2	Very low	26.7	Very low	82 Å²	82	122.3 Å²	122.3	50%	0.503	64%	0.64	S	S	.	*			trans	69.6	154.8	144.5	51.5	0	0	0	0	119.4	H2355	T2353-H2355 HydrophobicContact CG2-CB 4.46Å
2354	N	28.5	Very low	26.7	Very low	128 Å²	128	120 Å²	120	68%	0.684	65%	0.648	S	S	*	*			cis	-98.2	152	2.6	-75.9	-67.7	0	0	0	112.4	E2356	N2354-E2356 HydrophobicContact CB-CG 4.18Å
2355	H	24.2	Very low	26.6	Very low	166 Å²	166	120.9 Å²	120.9	77%	0.769	66%	0.656	S	S	*	*				57.6	171.2	50.2	-94	-45.9	0	0	0	111.8	T2353	T2353-H2355 HydrophobicContact CG2-CB 4.46Å
2356	E	28.9	Very low	26.8	Very low	148 Å²	148	124.6 Å²	124.6	69%	0.692	67%	0.673	S	S	*	*			trans	80.1	133.1	172.4	-56.7	-127.8	103.1	0	0	116.1	N2354	N2354-E2356 HydrophobicContact CB-CG 4.18Å
2357	N	26.6	Very low	27	Very low	115 Å²	115	120.1 Å²	120.1	62%	0.615	67%	0.671	S	S	*	*			cis	-161.8	-155.3	-24.5	-145.3	-34.5	0	0	0	109.2	K2359	N2357-K2359 PolarHBondContact O-N 2.72Å
2358	I	32.5	Very low	26.8	Very low	130 Å²	130	119.5 Å²	119.5	67%	0.667	67%	0.667	S	S	*	*			trans	36.4	90.8	131	-67.1	163.8	0	0	0	112.7
2359	K	25.1	Very low	26.3	Very low	170 Å²	170	112.2 Å²	112.2	74%	0.739	66%	0.655	S	S	*	*				97.6	174.8	82.4	-107.4	176	165.4	-175.6	0	109.3	N2357	N2357-K2359 PolarHBondContact O-N 2.72Å
2360	L	27.3	Very low	26.6	Very low	131 Å²	131	113.9 Å²	113.9	69%	0.686	66%	0.662	S	S	*	*			trans	30.3	104.9	143.1	-57.8	172.3	0	0	0	114.7
2361	S	22.5	Very low	26.7	Very low	91 Å²	91	114.3 Å²	114.3	64%	0.636	67%	0.673	S	S	*	*				50.1	122	75.7	88.8	0	0	0	0	111
2362	S	23.3	Very low	26.4	Very low	89 Å²	89	115.3 Å²	115.3	62%	0.622	68%	0.677	S	S	*	*			cis	171.6	-166	14.8	35.9	0	0	0	0	105.8
2363	S	24.6	Very low	26.9	Very low	91 Å²	91	117.4 Å²	117.4	64%	0.636	69%	0.694	S	S	*	*			trans	71.6	152.5	134.9	58.3	0	0	0	0	115.4
2364	S	26.9	Very low	27.6	Very low	110 Å²	110	119 Å²	119	77%	0.769	71%	0.707	S	S	*	*	S	Bend	cis	-137.1	147.3	18.6	-59.1	0	0	0	0	108.8
2365	S	26.3	Very low	27.4	Very low	95 Å²	95	118.8 Å²	118.8	66%	0.664	72%	0.715	S	S	*	*			cis	167.4	177.9	1.5	-103.3	0	0	0	0	107.5
2366	P	31.6	Very low	27.6	Very low	117 Å²	117	118 Å²	118	76%	0.76	72%	0.716	S	S	*	*			cis	-130	-130.9	-27.7	34.1	-10.8	0	0	0	110.9
2367	P	29.3	Very low	28	Very low	114 Å²	114	115.9 Å²	115.9	74%	0.74	72%	0.715	S	S	*	*			trans	-126.4	-147.7	-130.8	40.8	-14.9	0	0	0	110.7
2368	P	27.8	Very low	28	Very low	105 Å²	105	117.6 Å²	117.6	68%	0.682	72%	0.722	S	S	*	*			cis	-136.5	-165.7	-7	42.5	-22.9	0	0	0	115.2
2369	S	25.3	Very low	27.9	Very low	100 Å²	100	116.6 Å²	116.6	70%	0.699	73%	0.726	S	S	*	*			trans	64.8	136.9	165.5	40.2	0	0	0	0	116.9
2370	S	25.2	Very low	28.2	Very low	106 Å²	106	113.1 Å²	113.1	74%	0.741	72%	0.715	S	S	*	*			cis	85.4	123.3	28.1	83.7	0	0	0	0	115.9
2371	S	24.3	Very low	28.4	Very low	103 Å²	103	110.3 Å²	110.3	72%	0.72	71%	0.707	S	S	*	*			trans	80.1	131.4	166.8	76.5	0	0	0	0	119.8
2372	I	25.1	Very low	28.9	Very low	162 Å²	162	112.7 Å²	112.7	83%	0.831	71%	0.712	S	S	*	*			trans	77.7	149.4	149.3	-67.1	164.7	0	0	0	116.2
2373	P	36.1	Very low	29.5	Very low	112 Å²	112	114 Å²	114	73%	0.727	71%	0.712	S	S	*	*			trans	-97.1	-169.1	-164.5	42.9	-36.6	0	0	0	112
2374	P	38.6	Very low	29.7	Very low	117 Å²	117	117.4 Å²	117.4	76%	0.76	72%	0.715	S	S	*	*			cis	-139.5	-149.5	7.4	45.9	-25.9	0	0	0	114.8
2375	S	24.2	Very low	30.1	Very low	122 Å²	122	117 Å²	117	85%	0.853	71%	0.71	S	S	*	*			trans	99.9	169.2	163.7	82.4	0	0	0	0	118.2
2376	N	28.4	Very low	30.1	Very low	149 Å²	149	117.7 Å²	117.7	80%	0.797	71%	0.71	S	S	*	*			trans	-126.7	-157.5	-149.9	-157.2	10.4	0	0	0	111.6
2377	P	37.2	Very low	29.9	Very low	104 Å²	104	116.9 Å²	116.9	68%	0.675	70%	0.703	S	S	*	*				-112.2	161.4	-119.1	38.1	-22.3	0	0	0	115.4
2378	M	25.5	Very low	29.9	Very low	152 Å²	152	117.5 Å²	117.5	75%	0.749	71%	0.706	S	S	*	*			trans	-160.1	172.8	152.4	-112.9	-179.2	-178.5	0	0	107.2	N2380	M2378-N2380 PolarHBondContact SD-ND2 3.35Å
2379	S	30.3	Very low	29.8	Very low	109 Å²	109	117.9 Å²	117.9	76%	0.762	71%	0.707	S	S	*	*			cis	-169.4	171.6	26.4	-2.1	0	0	0	0	108.1
2380	N	31.4	Very low	30	Very low	96 Å²	96	121 Å²	121	51%	0.513	71%	0.714	S	S	.	*			cis	-170.6	140.6	-25.6	-107.2	-4.4	0	0	0	106.7	M2378	M2378-N2380 PolarHBondContact SD-ND2 3.35Å
2381	S	31.4	Very low	29.9	Very low	72 Å²	72	121.1 Å²	121.1	50%	0.503	72%	0.716	S	S	.	*				73.1	165.1	90.8	102.6	0	0	0	0	115.3
2382	N	34.8	Very low	29.9	Very low	141 Å²	141	122.2 Å²	122.2	75%	0.754	72%	0.718	S	S	*	*				-171.8	148	121.6	-91.8	0.8	0	0	0	110.6
2383	I	35.8	Very low	29.9	Very low	118 Å²	118	121.6 Å²	121.6	61%	0.605	72%	0.716	S	S	*	*			cis	-165.2	146.2	-21.8	-116.5	179.2	0	0	0	104.4
2384	F	27.7	Very low	29.4	Very low	162 Å²	162	120.4 Å²	120.4	71%	0.711	72%	0.716	S	S	*	*				52.9	172.2	79.4	-74.9	-75.4	0	0	0	114.8
2385	P	34.8	Very low	28.8	Very low	102 Å²	102	121.7 Å²	121.7	66%	0.662	72%	0.721	S	S	*	*			cis	-79.3	-157	2.1	39.8	-41.7	0	0	0	113.1
2386	V	27	Very low	29.1	Very low	108 Å²	108	121.8 Å²	121.8	66%	0.655	72%	0.716	S	S	*	*			cis	-147.7	148	11.7	-106.3	0	0	0	0	108.8
2387	V	26.5	Very low	29	Very low	101 Å²	101	120.9 Å²	120.9	61%	0.612	72%	0.719	S	S	*	*			cis	77.8	122.6	5.8	-165	0	0	0	0	114.2	V2389	V2387-V2389 HydrophobicContact CG1-CG2 3.73Å
2388	P	31.1	Very low	28.4	Very low	126 Å²	126	118.7 Å²	118.7	82%	0.818	71%	0.714	S	S	*	*			cis	-133.3	-170.5	41.8	19	7.6	0	0	0	115.7
2389	V	25.5	Very low	28.3	Very low	114 Å²	114	117.9 Å²	117.9	69%	0.691	72%	0.724	S	S	*	*			cis	-179.8	138	-46.3	144.1	0	0	0	0	108	V2387	V2387-V2389 HydrophobicContact CG1-CG2 3.73Å
2390	L	28.1	Very low	28.3	Very low	164 Å²	164	115.8 Å²	115.8	86%	0.859	72%	0.72	S	S	*	*			trans	172.2	164.4	135.2	-92.2	178.2	0	0	0	110.7
2391	S	23.4	Very low	28	Very low	110 Å²	110	118.7 Å²	118.7	77%	0.769	74%	0.735	S	S	*	*			trans	-146.5	176.8	-166.8	-48.3	0	0	0	0	111.8
2392	V	25.4	Very low	27.7	Very low	126 Å²	126	120.8 Å²	120.8	76%	0.764	75%	0.749	S	S	*	*				164.6	119.8	127.6	157.2	0	0	0	0	113.4
2393	N	25.5	Very low	27.3	Very low	148 Å²	148	122.1 Å²	122.1	79%	0.791	75%	0.754	S	S	*	*			trans	30.9	138.6	144.1	-45.1	-12.2	0	0	0	123.3
2394	A	24.6	Very low	26.9	Very low	88 Å²	88	119.5 Å²	119.5	73%	0.727	75%	0.746	S	S	*	*				152.2	122.5	97.6	0	0	0	0	0	118.2
2395	V	25.8	Very low	26.9	Very low	143 Å²	143	116.5 Å²	116.5	87%	0.867	74%	0.738	S	S	*	*			trans	75.6	160.1	138	-179.1	0	0	0	0	120.4
2396	V	30.7	Very low	26.6	Very low	125 Å²	125	117.8 Å²	117.8	76%	0.758	74%	0.739	S	S	*	*			trans	-126.1	146	-155.7	174.6	0	0	0	0	112.3
2397	P	26.3	Very low	26.6	Very low	130 Å²	130	119.2 Å²	119.2	84%	0.844	74%	0.743	S	S	*	*				-127.1	167.4	119	37.9	-32.5	0	0	0	111.1
2398	G	24.8	Very low	26.6	Very low	57 Å²	57	119.2 Å²	119.2	59%	0.588	75%	0.747	S	S	*	*			cis	148.2	133.4	-4.6	0	0	0	0	0	112.1
2399	S	24.3	Very low	26.5	Very low	136 Å²	136	119.9 Å²	119.9	95%	0.951	75%	0.749	S	S	*	*			trans	62.5	150.1	168	66.9	0	0	0	0	120.8
2400	G	30.1	Very low	26.5	Very low	65 Å²	65	119.5 Å²	119.5	67%	0.67	74%	0.743	S	S	*	*			trans	130.2	103.3	150.1	0	0	0	0	0	117.1
2401	D	23.5	Very low	26.4	Very low	156 Å²	156	116.9 Å²	116.9	83%	0.834	73%	0.73	S	S	*	*			trans	-83.6	124.9	169.5	-68.2	-80	0	0	0	112.2
2402	C	25.7	Very low	26.9	Very low	117 Å²	117	116.4 Å²	116.4	79%	0.791	73%	0.725	S	S	*	*			trans	-169.9	152	179.7	57.4	0	0	0	0	110.1
2403	I	27.3	Very low	27	Very low	168 Å²	168	114.2 Å²	114.2	86%	0.862	73%	0.727	S	S	*	*			cis	-155.3	-177.5	-13.7	-167.5	157.2	0	0	0	107.6
2404	S	27.5	Very low	27.1	Very low	64 Å²	64	116.4 Å²	116.4	45%	0.448	73%	0.729	S	S	.	*			trans	-101.8	161.7	-171.3	62.1	0	0	0	0	116.8
2405	D	27	Very low	27.2	Very low	99 Å²	99	121.5 Å²	121.5	53%	0.529	74%	0.736	S	S	.	*			trans	97.9	121.3	146	-55.7	-45.1	0	0	0	123.9
2406	N	28.3	Very low	27.1	Very low	128 Å²	128	119 Å²	119	68%	0.684	72%	0.724	S	S	*	*			trans	81.8	119.4	140.3	-61.3	-11.2	0	0	0	125.6
2407	D	27.5	Very low	26.9	Very low	139 Å²	139	120.2 Å²	120.2	74%	0.743	73%	0.727	S	S	*	*			trans	77.4	102.6	131.4	-69	-22.9	0	0	0	125.2
2408	S	26.8	Very low	26.8	Very low	101 Å²	101	119 Å²	119	71%	0.706	72%	0.721	S	S	*	*				110.4	150.4	111.5	78.2	0	0	0	0	122
2409	T	28.1	Very low	26.8	Very low	139 Å²	139	124 Å²	124	85%	0.853	73%	0.727	S	S	*	*			trans	84.9	167.5	163	73.8	0	0	0	0	120.8
2410	N	25.9	Very low	26.9	Very low	106 Å²	106	122 Å²	122	57%	0.567	70%	0.701	S	S	*	*			trans	-90.3	150.6	-149.7	-84.6	-39	0	0	0	116.4	T2077	T2077-N2410 PolarHBondContact OG1-ND2 2.83Å
2411	N	26.8	Very low	26.8	Very low	109 Å²	109	124.7 Å²	124.7	58%	0.583	70%	0.699	S	S	*	*				10.2	156.9	129.6	-90.9	-37.9	0	0	0	120.6
2412	P	33.5	Very low	26.9	Very low	101 Å²	101	121.3 Å²	121.3	66%	0.656	69%	0.687	S	S	*	*			cis	-138.5	157.9	-18.2	38	-20.5	0	0	0	115.2
2413	G	27.8	Very low	27	Very low	79 Å²	79	120.3 Å²	120.3	81%	0.814	68%	0.682	S	S	*	*			trans	-157.2	123.8	173.2	0	0	0	0	0	114
2414	K	26.1	Very low	27	Very low	194 Å²	194	120.3 Å²	120.3	84%	0.843	67%	0.671	S	S	*	*			trans	-63.4	133.2	180	-57.4	165.7	-176.6	170.7	0	111.3
2415	F	26.5	Very low	27	Very low	196 Å²	196	123.6 Å²	123.6	86%	0.86	68%	0.684	S	S	*	*				-171.8	180	107.3	-104.9	-67.3	0	0	0	112.6
2416	S	24.5	Very low	27	Very low	90 Å²	90	122.5 Å²	122.5	63%	0.629	68%	0.684	S	S	*	*			trans	-87.6	142.3	-155	-45.2	0	0	0	0	116.3
2417	N	26	Very low	27	Very low	150 Å²	150	123.2 Å²	123.2	80%	0.802	69%	0.687	S	S	*	*			trans	70	134.9	141.1	-61.1	-12.8	0	0	0	122.2
2418	S	24.8	Very low	27	Very low	104 Å²	104	119.4 Å²	119.4	73%	0.727	67%	0.671	S	S	*	*			trans	111.7	95	136.7	-35.7	0	0	0	0	119.7
2419	F	25.7	Very low	27.1	Very low	162 Å²	162	119.7 Å²	119.7	71%	0.711	67%	0.669	S	S	*	*			trans	58.1	109.9	137.7	-72.4	-91.2	0	0	0	122.3
2420	K	26	Very low	27	Very low	94 Å²	94	119.4 Å²	119.4	41%	0.409	66%	0.661	S	S	.	*				40.9	141	104.3	-81.3	179	168.2	168.8	0	118.7	E473 P474	E473-K2420 VanDerWaalsContact CD-CE 3.46Å; E473-K2420 IonicContact OE1-NZ 3.74Å; E473-K2420 PolarHBondContact OE1-NZ 2.63Å; E473-K2420 WeakPolarHBondContact OE2-CE 3.13Å; E473-K2420 IonicContact OE2-NZ 3.14Å; E473-K2420 PolarHBondContact OE2-NZ 2.79Å; E473-K2420 VanDerWaalsContact OE2-NZ 3.12Å; P474-K2420 PolarHBondContact O-NZ 2.9Å
2421	I	27.5	Very low	27.1	Very low	123 Å²	123	119.7 Å²	119.7	63%	0.631	67%	0.671	S	S	*	*			cis	-157.4	146	31.9	-124.3	148.8	0	0	0	112.4
2422	S	26.5	Very low	27.3	Very low	84 Å²	84	119.4 Å²	119.4	59%	0.587	68%	0.677	S	S	*	*			trans	32.8	161.4	146.1	104.6	0	0	0	0	122.8
2423	S	26.7	Very low	27.1	Very low	97 Å²	97	119.4 Å²	119.4	68%	0.678	68%	0.68	S	S	*	*			cis	-176.7	168.6	-2.8	30.8	0	0	0	0	109.5
2424	R	28	Very low	27	Very low	167 Å²	167	120.6 Å²	120.6	63%	0.63	68%	0.676	S	S	*	*			cis	164.7	126	-29.1	176.6	-118.9	70.2	149	-5.5	108.6	S2426	R2424-S2426 PolarHBondContact NH1-OG 2.76Å
2425	D	28.3	Very low	27	Very low	133 Å²	133	114.9 Å²	114.9	71%	0.711	66%	0.66	S	S	*	*			trans	-137.1	-178.7	155.8	-105.7	-19.3	0	0	0	112.4
2426	S	26	Very low	26.8	Very low	77 Å²	77	110.6 Å²	110.6	54%	0.538	66%	0.655	S	S	.	*			trans	-156.3	177.3	-155.6	-57.3	0	0	0	0	115.5	R2424	R2424-S2426 PolarHBondContact NH1-OG 2.76Å
2427	L	28.3	Very low	26.8	Very low	143 Å²	143	109.5 Å²	109.5	75%	0.749	65%	0.647	S	S	*	*			trans	109.8	112.4	-177.7	-63.3	164.1	0	0	0	110.4
2428	S	26.9	Very low	26.8	Very low	58 Å²	58	105.3 Å²	105.3	41%	0.406	63%	0.63	S	S	.	*				78.9	133.4	54.4	79.2	0	0	0	0	112.7
2429	T	29	Very low	26.8	Very low	108 Å²	108	105.8 Å²	105.8	66%	0.663	62%	0.623	S	S	*	*			cis	-145.4	133.3	47.8	43	0	0	0	0	112.9
2430	I	27.2	Very low	26.9	Very low	132 Å²	132	104.3 Å²	104.3	68%	0.677	62%	0.622	S	S	*	*				65.7	114	71.4	-61.1	166.1	0	0	0	114.7
2431	S	27.8	Very low	27.1	Very low	112 Å²	112	106.2 Å²	106.2	78%	0.783	63%	0.628	S	S	*	*				-179.9	143.8	121.7	52	0	0	0	0	111.1
2432	S	30.1	Very low	27	Very low	103 Å²	103	102.9 Å²	102.9	72%	0.72	62%	0.615	S	S	*	*			cis	-169.4	179.2	-18.5	62.3	0	0	0	0	106.3
2433	S	29.3	Very low	27.1	Very low	101 Å²	101	101.9 Å²	101.9	71%	0.706	61%	0.608	S	S	*	*			cis	-175	164.9	11.7	12.7	0	0	0	0	106.9
2434	S	26.8	Very low	27.2	Very low	104 Å²	104	102.3 Å²	102.3	73%	0.727	60%	0.603	S	S	*	*			cis	-179.8	-179.2	-20.5	72.3	0	0	0	0	107
2435	S	24.8	Very low	27.2	Very low	75 Å²	75	100.3 Å²	100.3	52%	0.524	60%	0.603	S	S	.	*			cis	-161.4	146.5	2.4	20.1	0	0	0	0	111.9	R454	R454-S2435 VanDerWaalsContact NH1-C 3.34Å; R454-S2435 PolarHBondContact NH1-O 3.48Å; R454-S2435 PolarHBondContact NH2-O 3.36Å
2436	S	23.6	Very low	27.3	Very low	106 Å²	106	100.5 Å²	100.5	74%	0.741	60%	0.603	S	S	*	*			trans	-99.8	172	146.1	-69.3	0	0	0	0	109.6
2437	S	22.8	Very low	27.5	Very low	66 Å²	66	104.7 Å²	104.7	46%	0.462	61%	0.612	S	S	.	*			trans	171.6	157.8	143.6	57.8	0	0	0	0	115.2	R454	R454-S2437 WeakPolarHBondContact CD-OG 3.18Å; R454-S2437 VanDerWaalsContact CG-O 3.28Å; R454-S2437 WeakPolarHBondContact CG-O 3.28Å
2438	S	27.2	Very low	27.5	Very low	63 Å²	63	104.6 Å²	104.6	44%	0.441	61%	0.612	S	S	.	*			trans	-169.6	168.5	173.7	59.8	0	0	0	0	107	S455 M456	S455-S2438 CarbonylContact O-C 3.58Å; S455-S2438 WeakPolarHBondContact O-CA 3.48Å; S455-S2438 PolarHBondContact O-N 3.29Å; M456-S2438 WeakPolarHBondContact CE-O 2.97Å
2439	L	24.4	Very low	27.5	Very low	114 Å²	114	107.3 Å²	107.3	60%	0.597	62%	0.621	S	S	*	*			cis	-132.1	-57.4	19.8	-59.9	83.8	0	0	0	117.3	S455	S455-L2439 VanDerWaalsContact CB-O 3.29Å; S455-L2439 WeakPolarHBondContact CB-O 3.37Å; S455-L2439 PolarHBondContact O-N 2.89Å; S455-L2439 WeakPolarHBondContact OG-CA 3.37Å; S455-L2439 PolarHBondContact OG-O 2.85Å
2440	L	27.7	Very low	27.4	Very low	130 Å²	130	110 Å²	110	68%	0.681	62%	0.623	S	S	*	*			trans	-153.3	167.4	-152.6	-81.6	170	0	0	0	115.2
2441	Y	30.3	Very low	27.5	Very low	135 Å²	135	108 Å²	108	53%	0.529	62%	0.62	S	S	.	*			trans	-157.2	173.7	151.2	-151.7	-0.5	0	0	0	112.4	D457 Q458 L459	D457-Y2441 WeakPolarHBondContact O-CD2 3.17Å; D457-Y2441 WeakPolarHBondContact O-CE2 2.85Å; Q458-Y2441 VanDerWaalsContact O-CE2 3.28Å; Q458-Y2441 WeakPolarHBondContact O-CE2 3.07Å; Q458-Y2441 PolarHBondContact O-OH 2.86Å; L459-Y2441 PolarHBondContact O-OH 3.36Å; L459-Y2441 VanDerWaalsContact O-OH 3.04Å
2442	S	25	Very low	27.5	Very low	53 Å²	53	108.4 Å²	108.4	37%	0.371	61%	0.614	S	S	.	*			trans	-168.8	171.8	-179.3	-58.9	0	0	0	0	108.1	R466	R466-S2442 PolarHBondContact NH1-OG 3.07Å
2443	S	28.6	Very low	27.2	Very low	62 Å²	62	110.2 Å²	110.2	43%	0.434	61%	0.614	S	S	.	*			cis	-156.7	-172.4	19.9	-49.3	0	0	0	0	110.4
2444	D	29.2	Very low	27	Very low	107 Å²	107	112.2 Å²	112.2	57%	0.572	62%	0.615	S	S	*	*			trans	72.9	148	145.5	-63.5	-18.7	0	0	0	119.9	S465	S465-D2444 WeakPolarHBondContact CB-OD2 3.4Å; S465-D2444 VanDerWaalsContact OG-CG 3.26Å; S465-D2444 PolarHBondContact OG-OD1 3.24Å; S465-D2444 PolarHBondContact OG-OD2 3.12Å
2445	I	27.5	Very low	26.9	Very low	125 Å²	125	112.6 Å²	112.6	64%	0.641	61%	0.613	S	S	*	*			cis	-158.1	178.2	-6.4	-120.9	165.2	0	0	0	110.3
2446	I	31.4	Very low	26.8	Very low	137 Å²	137	114.6 Å²	114.6	70%	0.703	62%	0.622	S	S	*	*			trans	92.5	132.5	175.3	-58	-176.7	0	0	0	115.2
2447	K	29.1	Very low	26.9	Very low	165 Å²	165	117 Å²	117	72%	0.717	63%	0.625	S	S	*	*			cis	-154.4	132.2	-25.3	-98	172.2	-163.8	167.3	0	104
2448	D	28.1	Very low	27	Very low	140 Å²	140	117.6 Å²	117.6	75%	0.749	63%	0.634	S	S	*	*				76.2	152.9	55.7	-169.4	27.7	0	0	0	113.5
2449	I	27.1	Very low	26.8	Very low	116 Å²	116	120.7 Å²	120.7	60%	0.595	65%	0.651	S	S	*	*			trans	81	128.4	170.3	-60	-174.9	0	0	0	116.9
2450	K	27.7	Very low	26.8	Very low	165 Å²	165	119.7 Å²	119.7	72%	0.717	65%	0.653	S	S	*	*			cis	-169.6	144.8	-8.5	-117.4	-177.9	-154.6	169.3	0	115
2451	S	29.1	Very low	26.7	Very low	88 Å²	88	118.3 Å²	118.3	62%	0.615	66%	0.655	S	S	*	*				68.8	169.4	129.3	84.7	0	0	0	0	120.8
2452	N	27.6	Very low	26.5	Very low	122 Å²	122	118.4 Å²	118.4	65%	0.652	67%	0.67	S	S	*	*			cis	-134.8	160.8	3.8	-102.2	-40.6	0	0	0	108.8
2453	I	24.4	Very low	26.5	Very low	141 Å²	141	120.5 Å²	120.5	72%	0.723	68%	0.684	S	S	*	*				61.7	141.9	58.6	-42.4	-177.4	0	0	0	113.8
2454	I	25.7	Very low	26.4	Very low	143 Å²	143	123.9 Å²	123.9	73%	0.733	70%	0.702	S	S	*	*			trans	76.5	133.9	178.4	-42	-179.7	0	0	0	111.9
2455	T	24.6	Very low	26.2	Very low	111 Å²	111	123.9 Å²	123.9	68%	0.681	71%	0.709	S	S	*	*			cis	-135	148	12.5	-12.7	0	0	0	0	106.7
2456	T	22.8	Very low	26.1	Very low	117 Å²	117	124.2 Å²	124.2	72%	0.718	71%	0.713	S	S	*	*			cis	66.6	144	38.2	-29.2	0	0	0	0	113.4
2457	I	25	Very low	25.8	Very low	157 Å²	157	122.9 Å²	122.9	81%	0.805	71%	0.711	S	S	*	*			trans	72.6	127.9	174.7	-52.2	175.8	0	0	0	112.9
2458	A	23.9	Very low	25.5	Very low	78 Å²	78	120.7 Å²	120.7	65%	0.645	71%	0.712	S	S	*	*			cis	-146.9	169.3	4.5	0	0	0	0	0	114.6
2459	T	24	Very low	25.4	Very low	129 Å²	129	120.8 Å²	120.8	79%	0.791	72%	0.717	S	S	*	*			trans	-3.7	153.6	140	59	0	0	0	0	119.1
2460	S	24.7	Very low	25.2	Very low	93 Å²	93	121.5 Å²	121.5	65%	0.65	73%	0.727	S	S	*	*			cis	-168.5	129.7	10.6	22.7	0	0	0	0	108.1
2461	S	24.4	Very low	24.9	Very low	101 Å²	101	119.7 Å²	119.7	71%	0.706	73%	0.73	S	S	*	*				48.9	105.4	85.7	73.9	0	0	0	0	116.5
2462	T	27.7	Very low	24.5	Very low	137 Å²	137	122 Å²	122	84%	0.84	74%	0.735	S	S	*	*				-175.9	133.2	114.7	34.5	0	0	0	0	108.7
2463	S	24.8	Very low	24.3	Very low	96 Å²	96	121.2 Å²	121.2	67%	0.671	74%	0.738	S	S	*	*			cis	90.6	84.4	12.3	89.9	0	0	0	0	118.3
2464	T	26.6	Very low	24.1	Very low	133 Å²	133	120.2 Å²	120.2	82%	0.816	73%	0.734	S	S	*	*			trans	-153.7	126.7	152.5	42.1	0	0	0	0	106.4
2465	C	23.9	Very low	24.1	Very low	107 Å²	107	122 Å²	122	72%	0.723	74%	0.736	S	S	*	*			cis	66.1	132.1	37.2	-57.9	0	0	0	0	112.9
2466	N	26	Very low	24.1	Very low	133 Å²	133	124 Å²	124	71%	0.711	74%	0.742	S	S	*	*			cis	-164	164.3	5.3	-121.4	1.2	0	0	0	113.4
2467	T	24.3	Very low	24.8	Very low	108 Å²	108	123.1 Å²	123.1	66%	0.663	74%	0.738	S	S	*	*			trans	67	133.5	145.2	49.9	0	0	0	0	124.4
2468	T	23.4	Very low	24.9	Very low	120 Å²	120	121.1 Å²	121.1	74%	0.736	73%	0.733	S	S	*	*			trans	84.5	153.8	134.8	48.5	0	0	0	0	123.5
2469	T	25.4	Very low	25.2	Very low	142 Å²	142	122.8 Å²	122.8	87%	0.871	74%	0.736	S	S	*	*			trans	93.2	136.2	167.6	65.7	0	0	0	0	118.5
2470	T	22.9	Very low	25.2	Very low	131 Å²	131	124.7 Å²	124.7	80%	0.804	74%	0.738	S	S	*	*			trans	-84.8	141.9	170	47	0	0	0	0	110.3
2471	V	22.6	Very low	25.4	Very low	127 Å²	127	126.9 Å²	126.9	77%	0.77	74%	0.74	S	S	*	*			trans	-174.6	141.2	141.7	135.1	0	0	0	0	110.2
2472	D	20.8	Very low	25.6	Very low	136 Å²	136	125.9 Å²	125.9	73%	0.727	74%	0.738	S	S	*	*			trans	5.5	156.4	155.3	-40.3	-35.3	0	0	0	123.8
2473	C	21.9	Very low	25.6	Very low	106 Å²	106	126.3 Å²	126.3	72%	0.716	74%	0.735	S	S	*	*			trans	71	111.2	143.9	-80.8	0	0	0	0	122.7
2474	D	21.3	Very low	25.9	Very low	120 Å²	120	127.3 Å²	127.3	64%	0.642	74%	0.737	S	S	*	*				65.1	144.4	120.5	-58.5	-35.2	0	0	0	123.5
2475	K	25.4	Very low	26.1	Very low	179 Å²	179	127.2 Å²	127.2	78%	0.778	74%	0.736	S	S	*	*			trans	74	113	161	-65.7	135.9	-170.9	161.3	0	115.3
2476	I	25.3	Very low	26.3	Very low	155 Å²	155	126.6 Å²	126.6	80%	0.795	73%	0.733	S	S	*	*			cis	64	128.1	19.3	-71.2	172.4	0	0	0	112.9
2477	P	37.4	Very low	26.4	Very low	97 Å²	97	125.2 Å²	125.2	63%	0.63	73%	0.734	S	S	*	*			cis	-148.1	-156.1	-19.1	40.2	-17.9	0	0	0	114.9
2478	T	27	Very low	26.6	Very low	115 Å²	115	124.7 Å²	124.7	71%	0.706	74%	0.735	S	S	*	*			trans	67.9	154.8	148.8	47.5	0	0	0	0	121.3
2479	T	29.4	Very low	27.2	Very low	114 Å²	114	123 Å²	123	70%	0.699	73%	0.728	S	S	*	*			cis	177.4	-171.1	-41.4	34.8	0	0	0	0	108.2
2480	M	24.7	Very low	27.1	Very low	169 Å²	169	122 Å²	122	83%	0.833	72%	0.717	S	S	*	*			trans	91.1	145.4	158.3	-63.9	-165.2	168.7	0	0	118.7
2481	I	28.5	Very low	27.2	Very low	139 Å²	139	122.8 Å²	122.8	71%	0.713	72%	0.715	S	S	*	*			cis	-162	150.5	-15.6	-121.5	171.1	0	0	0	111.5
2482	A	27.7	Very low	27.3	Very low	80 Å²	80	121.3 Å²	121.3	66%	0.661	71%	0.711	S	S	*	*			trans	42.6	166.7	148.6	0	0	0	0	0	122.9
2483	N	28.1	Very low	27.6	Very low	145 Å²	145	120.4 Å²	120.4	78%	0.775	71%	0.71	S	S	*	*			cis	-154.9	149.9	-3.7	-135.2	4	0	0	0	114
2484	V	30.7	Very low	27.9	Very low	117 Å²	117	120.2 Å²	120.2	71%	0.709	71%	0.71	S	S	*	*			trans	36.7	118.1	151.1	179.8	0	0	0	0	121.6
2485	T	30.9	Very low	28.3	Very low	131 Å²	131	119 Å²	119	80%	0.804	72%	0.716	S	S	*	*				-156.4	145.7	124.2	-5.4	0	0	0	0	112.7
2486	S	28.2	Very low	28.6	Very low	94 Å²	94	116.2 Å²	116.2	66%	0.657	72%	0.72	S	S	*	*			trans	-18.8	123.7	169	45.5	0	0	0	0	117.4
2487	S	28.2	Very low	28.9	Very low	105 Å²	105	111.9 Å²	111.9	73%	0.734	71%	0.713	S	S	*	*				69.9	126.3	64.1	80.3	0	0	0	0	113.2
2488	S	29.8	Very low	28.2	Very low	96 Å²	96	115.3 Å²	115.3	67%	0.671	73%	0.725	S	S	*	*			cis	-144.1	-155.2	19.9	-59.9	0	0	0	0	111.6
2489	S	35.7	Very low	28.1	Very low	85 Å²	85	115.5 Å²	115.5	59%	0.594	73%	0.731	S	S	*	*	S	Bend		178.6	-35.3	85.1	28.3	0	0	0	0	116.1	L2491 S2492	S2489-L2491 PolarHBondContact OG-N 3.02Å; S2489-L2491 VanDerWaalsContact OG-N 3.15Å; S2489-L2491 PolarHBondContact OG-O 2.95Å; S2489-S2492 PolarHBondContact OG-O 3.41Å
2490	L	23.1	Very low	28	Very low	121 Å²	121	116 Å²	116	63%	0.634	73%	0.734	S	S	*	*	S	Bend	cis	-46.2	153.6	-25.5	-92	170.3	0	0	0	113.2	R418	R418-L2490 HydrophobicContact CB-CD1 4.46Å
2491	L	24.8	Very low	28	Very low	148 Å²	148	114.7 Å²	114.7	78%	0.775	73%	0.73	S	S	*	*	S	Bend	trans	76.4	107.9	170.6	-65.9	156.5	0	0	0	116.9	S2489	S2489-L2491 PolarHBondContact OG-N 3.02Å; S2489-L2491 VanDerWaalsContact OG-N 3.15Å; S2489-L2491 PolarHBondContact OG-O 2.95Å
2492	S	23.5	Very low	27.8	Very low	96 Å²	96	115.2 Å²	115.2	67%	0.671	73%	0.734	S	S	*	*			trans	74.5	146.4	163.2	81.4	0	0	0	0	116.2	S2489	S2489-S2492 PolarHBondContact OG-O 3.41Å
2493	T	28.2	Very low	27.7	Very low	117 Å²	117	118.8 Å²	118.8	72%	0.718	74%	0.742	S	S	*	*			cis	-133.1	158.4	18.5	47.9	0	0	0	0	114.5
2494	S	28	Very low	27.4	Very low	102 Å²	102	116.2 Å²	116.2	71%	0.713	74%	0.741	S	S	*	*			trans	54.5	118.1	154.4	50.1	0	0	0	0	118.9
2495	A	29.3	Very low	27.3	Very low	93 Å²	93	116.2 Å²	116.2	77%	0.769	74%	0.743	S	S	*	*				61.3	127.9	71.1	0	0	0	0	0	112.8
2496	S	31.7	Very low	27	Very low	122 Å²	122	116.3 Å²	116.3	85%	0.853	74%	0.735	S	S	*	*			cis	-143.4	163.5	39.2	-51.4	0	0	0	0	111.1
2497	G	31.6	Very low	26.9	Very low	64 Å²	64	114 Å²	114	66%	0.66	72%	0.715	S	S	*	*				95.5	85.5	56.7	0	0	0	0	0	110
2498	L	23.7	Very low	26.7	Very low	169 Å²	169	114.9 Å²	114.9	89%	0.885	71%	0.71	S	S	*	*				78	124.8	88.1	-76.8	170.3	0	0	0	116.2
2499	S	24.6	Very low	26.7	Very low	119 Å²	119	114.5 Å²	114.5	83%	0.832	71%	0.705	S	S	*	*			trans	72.4	154.6	165.6	79.8	0	0	0	0	117.3
2500	V	27.8	Very low	26.1	Very low	123 Å²	123	115.1 Å²	115.1	75%	0.745	71%	0.709	S	S	*	*			cis	-141.9	160.2	9.4	-178.6	0	0	0	0	111.2
2501	N	23	Very low	26	Very low	142 Å²	142	115.4 Å²	115.4	76%	0.759	72%	0.716	S	S	*	*			trans	-36.4	154.7	173.5	-48.6	-28.4	0	0	0	120.1
2502	L	26	Very low	26	Very low	150 Å²	150	113.9 Å²	113.9	79%	0.785	72%	0.717	S	S	*	*				-174.9	145	113	-97.7	158.5	0	0	0	114.8
2503	D	25.1	Very low	26	Very low	155 Å²	155	118.4 Å²	118.4	83%	0.829	73%	0.725	S	S	*	*			trans	57.9	156.2	157.6	-59	-24.1	0	0	0	124.5
2504	A	21.5	Very low	26.1	Very low	92 Å²	92	117 Å²	117	76%	0.76	72%	0.718	S	S	*	*			trans	-134.2	149.7	178.5	0	0	0	0	0	110.6
2505	P	29.1	Very low	25.7	Very low	116 Å²	116	114.8 Å²	114.8	75%	0.753	70%	0.702	S	S	*	*				-153.2	-180	95.6	43.1	-24.8	0	0	0	114
2506	Q	24.3	Very low	25.4	Very low	134 Å²	134	111.5 Å²	111.5	63%	0.626	67%	0.673	S	S	*	*			cis	-163.1	-153.1	-18.3	-107.8	-178.5	-16.4	0	0	111.9	N348	N348-Q2506 VanDerWaalsContact C-CD 3.49Å; N348-Q2506 WeakPolarHBondContact O-CB 3.26Å; N348-Q2506 WeakPolarHBondContact O-CG 3.39Å; N348-Q2506 PolarHBondContact O-NE2 2.8Å; N348-Q2506 PolarHBondContact O-OE1 2.86Å
2507	L	25.1	Very low	24.9	Very low	46 Å²	46	109.6 Å²	109.6	24%	0.241	66%	0.66	C	S	.	*			trans	-56	145.8	-175.3	-69.6	175.3	0	0	0	115.6	N348 L350	N348-L2507 VanDerWaalsContact C-CD1 3.44Å; N348-L2507 VanDerWaalsContact O-CG 3.23Å; N348-L2507 WeakPolarHBondContact O-CG 3.48Å; N348-L2507 PolarHBondContact O-N 3.02Å; L350-L2507 CarbonylContact C-O 2.92Å; L350-L2507 VanDerWaalsContact C-O 3.26Å; L350-L2507 VanDerWaalsContact O-O 3.06Å
2508	I	24	Very low	24.5	Very low	123 Å²	123	110.6 Å²	110.6	63%	0.631	66%	0.657	S	S	*	*				63.9	130.6	59.8	-53.9	178.8	0	0	0	110.2
2509	P	30.5	Very low	24.4	Very low	87 Å²	87	112 Å²	112	57%	0.565	66%	0.656	S	S	*	*				-150.8	152.6	51.8	44.6	-24.2	0	0	0	122
2510	S	22.7	Very low	24.4	Very low	99 Å²	99	111.5 Å²	111.5	69%	0.692	65%	0.653	S	S	*	*				80.7	142.8	126	70.4	0	0	0	0	126
2511	V	21.8	Very low	24.6	Very low	126 Å²	126	113.4 Å²	113.4	76%	0.764	66%	0.658	S	S	*	*			trans	57.1	107	148.5	-65.9	0	0	0	0	123.9
2512	S	25.2	Very low	25.1	Very low	116 Å²	116	111.3 Å²	111.3	81%	0.811	65%	0.654	S	S	*	*				-175.4	134.8	124.2	11.1	0	0	0	0	107
2513	F	21.9	Very low	24.9	Very low	192 Å²	192	108.6 Å²	108.6	84%	0.842	65%	0.648	S	S	*	*			cis	56.6	126.8	39.8	-82	-84.7	0	0	0	115.1
2514	P	30.7	Very low	24.9	Very low	86 Å²	86	107.3 Å²	107.3	56%	0.558	65%	0.646	S	S	*	*			cis	-136.8	-160.1	-35	37.2	-18.1	0	0	0	111.6
2515	C	20.5	Very low	25	Very low	57 Å²	57	107.7 Å²	107.7	39%	0.385	64%	0.643	S	S	.	*			trans	12.5	153.1	143.3	-64	0	0	0	0	122.5	D1707 M1708	D1707-C2515 WeakPolarHBondContact O-CB 3.37Å; D1707-C2515 PolarHBondContact O-SG 3.04Å; M1708-C2515 HydrophobicContact CE-CB 4.08Å
2516	S	22.1	Very low	24.6	Very low	23 Å²	23	105 Å²	105	16%	0.161	63%	0.63	C	S	.	*			trans	91.9	108.4	158.2	-22	0	0	0	0	116.9	M1708 G1709	M1708-S2516 VanDerWaalsContact CA-OG 3.28Å; M1708-S2516 WeakPolarHBondContact CA-OG 3.47Å; G1709-S2516 VanDerWaalsContact C-OG 3.32Å; G1709-S2516 WeakPolarHBondContact CA-OG 3.35Å; G1709-S2516 PolarHBondContact N-OG 3.36Å
2517	S	22.4	Very low	24.5	Very low	83 Å²	83	101.7 Å²	101.7	58%	0.58	62%	0.622	S	S	*	*				58.7	141.4	126.4	64.7	0	0	0	0	118.9
2518	S	22.4	Very low	24.4	Very low	84 Å²	84	105 Å²	105	59%	0.587	64%	0.639	S	S	*	*				-167.5	166.2	51.9	-49.6	0	0	0	0	114.9
2519	F	21.9	Very low	24.3	Very low	200 Å²	200	103 Å²	103	88%	0.877	64%	0.636	S	S	*	*			trans	55.4	92.1	152.3	-59	-56.2	0	0	0	119.1
2520	S	25	Very low	23.8	Very low	108 Å²	108	103.5 Å²	103.5	76%	0.755	63%	0.629	S	S	*	*	S	Bend		-130.7	118.5	111.3	64.5	0	0	0	0	110.7
2521	L	31.4	Very low	23.7	Very low	162 Å²	162	103.2 Å²	103.2	85%	0.848	63%	0.627	S	S	*	*	S	Bend	trans	35.1	121.2	142.8	-54.6	169	0	0	0	118.4
2522	S	32.5	Very low	23.7	Very low	98 Å²	98	107.2 Å²	107.2	69%	0.685	63%	0.63	S	S	*	*			cis	-157.1	125.9	1.5	53.3	0	0	0	0	112.8
2523	S	23.7	Very low	23.5	Very low	93 Å²	93	105.2 Å²	105.2	65%	0.65	62%	0.616	S	S	*	*			trans	9.4	117.8	131.5	50.8	0	0	0	0	116.3
2524	T	23.4	Very low	23.5	Very low	129 Å²	129	98.2 Å²	98.2	79%	0.791	59%	0.591	S	S	*	*				59.2	142.4	75.6	73.8	0	0	0	0	113.1
2525	S	23.5	Very low	23.1	Very low	100 Å²	100	97.4 Å²	97.4	70%	0.699	59%	0.588	S	S	*	*			cis	-153.3	152.6	27.9	-37.6	0	0	0	0	113.4
2526	A	22.6	Very low	23.2	Very low	59 Å²	59	99 Å²	99	49%	0.488	60%	0.599	S	S	.	*			trans	31.4	112	131.8	0	0	0	0	0	118.3	T1663	T1663-A2526 VanDerWaalsContact OG1-CB 3.31Å; T1663-A2526 WeakPolarHBondContact OG1-CB 3.17Å
2527	S	21.6	Very low	23.2	Very low	65 Å²	65	102.4 Å²	102.4	46%	0.455	62%	0.623	S	S	.	*				101.3	135.2	70.9	-78.4	0	0	0	0	111.8	T1663	T1663-S2527 VanDerWaalsContact CB-O 3.23Å; T1663-S2527 WeakPolarHBondContact CB-O 3.41Å; T1663-S2527 WeakPolarHBondContact CG2-O 3.41Å
2528	I	23.1	Very low	23.3	Very low	114 Å²	114	102.7 Å²	102.7	59%	0.585	62%	0.622	S	S	*	*			trans	-135.4	138	157.7	-78.5	-178.8	0	0	0	108.1	G1665 F2530	G1665-I2528 WeakPolarHBondContact O-CG2 3.17Å; I2528-F2530 HydrophobicContact CG2-CD2 4.03Å
2529	S	20.7	Very low	23.6	Very low	83 Å²	83	104.6 Å²	104.6	58%	0.58	63%	0.632	S	S	*	*			trans	-103.1	93.2	179.3	62.3	0	0	0	0	112.9
2530	F	21.7	Very low	23.8	Very low	96 Å²	96	99.5 Å²	99.5	42%	0.421	62%	0.621	S	S	.	*			trans	-136.7	159.4	164.6	-90.5	-104.7	0	0	0	107.7	G1665 N1666 A1668 I2528	G1665-F2530 WeakPolarHBondContact O-CD2 3.31Å; G1665-F2530 WeakPolarHBondContact O-CE2 3.07Å; N1666-F2530 HydrophobicContact CB-CE2 4.43Å; N1666-F2530 HydrophobicContact CB-CZ 4.24Å; A1668-F2530 HydrophobicContact CB-CD1 4.42Å; A1668-F2530 HydrophobicContact CB-CE1 3.95Å; I2528-F2530 HydrophobicContact CG2-CD2 4.03Å
2531	S	19.8	Very low	23.7	Very low	93 Å²	93	101.3 Å²	101.3	65%	0.65	62%	0.616	S	S	*	*			cis	170.7	154.5	-20.8	-91.9	0	0	0	0	104.4	S2533	S2531-S2533 PolarHBondContact O-N 3.28Å
2532	Y	21.1	Very low	23.5	Very low	210 Å²	210	99.3 Å²	99.3	82%	0.824	61%	0.61	S	S	*	*			trans	-61.4	128.6	-176.5	-88.3	-108.7	0	0	0	115.2
2533	S	21.7	Very low	23.1	Very low	74 Å²	74	99 Å²	99	52%	0.517	61%	0.608	S	S	.	*			trans	179.3	130.6	139.9	50.5	0	0	0	0	108.9	L1671 S2531	L1671-S2533 WeakPolarHBondContact O-CB 3.06Å; S2531-S2533 PolarHBondContact O-N 3.28Å
2534	S	21.9	Very low	23.3	Very low	46 Å²	46	99.2 Å²	99.2	32%	0.322	61%	0.609	S	S	.	*			cis	87.2	107.1	19.8	85.9	0	0	0	0	117	S1672 N1673	S1672-S2534 PolarHBondContact O-OG 3.01Å; N1673-S2534 PolarHBondContact N-OG 2.67Å
2535	S	21.5	Very low	23.4	Very low	69 Å²	69	95.9 Å²	95.9	48%	0.483	60%	0.595	S	S	.	*			trans	69.6	153.3	169.8	99.9	0	0	0	0	115.6	L1671 S1672	L1671-S2535 WeakPolarHBondContact CD2-O 3.5Å; S1672-S2535 PolarHBondContact O-OG 2.71Å
2536	S	22.3	Very low	23.5	Very low	90 Å²	90	97.3 Å²	97.3	63%	0.629	59%	0.594	S	S	*	*			cis	-163.4	164.9	-13.6	45.6	0	0	0	0	112.1
2537	S	22.6	Very low	23.6	Very low	95 Å²	95	100.1 Å²	100.1	66%	0.664	61%	0.61	S	S	*	*			trans	66.6	132.5	164.2	69.8	0	0	0	0	117.3
2538	T	25.2	Very low	23.6	Very low	89 Å²	89	100.8 Å²	100.8	55%	0.546	62%	0.615	S	S	.	*			cis	65.5	134.2	33.6	78.7	0	0	0	0	114.6	R1780	R1780-T2538 PolarHBondContact NH2-OG1 2.86Å
2539	P	29.1	Very low	23.7	Very low	123 Å²	123	101.3 Å²	101.3	80%	0.799	62%	0.618	S	S	*	*			cis	-117.7	-172.2	27.8	45.3	-33.9	0	0	0	112.2
2540	S	24.7	Very low	23.7	Very low	94 Å²	94	102.4 Å²	102.4	66%	0.657	63%	0.626	S	S	*	*			cis	-161.5	164.5	22.7	52.2	0	0	0	0	113.2
2541	F	24.3	Very low	23.8	Very low	145 Å²	145	101.4 Å²	101.4	64%	0.636	63%	0.631	S	S	*	*			trans	12.9	145.2	137.3	-68.8	-89.1	0	0	0	120.2	R1830	R1830-F2541 VanDerWaalsContact NH2-CZ 3.28Å
2542	V	25.3	Very low	24	Very low	121 Å²	121	100.5 Å²	100.5	73%	0.733	63%	0.629	S	S	*	*			cis	-146.1	158.1	21.8	-165.7	0	0	0	0	110.9
2543	S	25.6	Very low	24.1	Very low	92 Å²	92	96.9 Å²	96.9	64%	0.643	63%	0.633	S	S	*	*			trans	71.2	154.8	159.5	-119.8	0	0	0	0	116.6
2544	S	28.1	Very low	24.2	Very low	96 Å²	96	97.7 Å²	97.7	67%	0.671	64%	0.635	S	S	*	*			cis	-128.8	156	-5.6	-73	0	0	0	0	107.8
2545	A	24.4	Very low	24.3	Very low	60 Å²	60	99 Å²	99	50%	0.496	65%	0.648	S	S	.	*			cis	64.1	146.1	47.7	0	0	0	0	0	113.4
2546	L	26.3	Very low	24.4	Very low	129 Å²	129	102.9 Å²	102.9	68%	0.675	66%	0.659	S	S	*	*			trans	74.3	121.7	-162.2	-52.7	174.9	0	0	0	112.7
2547	S	23.3	Very low	24.6	Very low	119 Å²	119	103.1 Å²	103.1	83%	0.832	65%	0.649	S	S	*	*			cis	58.1	34.6	9.3	94.1	0	0	0	0	115.6
2548	S	22.7	Very low	24.9	Very low	79 Å²	79	104.8 Å²	104.8	55%	0.552	65%	0.646	S	S	*	*			trans	-123.9	127.4	157.7	52.1	0	0	0	0	107.6
2549	L	24.6	Very low	25.1	Very low	125 Å²	125	107.2 Å²	107.2	65%	0.654	65%	0.651	S	S	*	*			cis	-128.8	128.7	-3	-75.4	102.4	0	0	0	112.2	A2552	L2549-A2552 HydrophobicContact CD2-CB 3.69Å
2550	S	21.5	Very low	25	Very low	105 Å²	105	106.6 Å²	106.6	73%	0.734	64%	0.644	S	S	*	*	S	Bend		-69.9	138.8	124.5	-175.5	0	0	0	0	107.8
2551	S	23.4	Very low	25.2	Very low	75 Å²	75	103.4 Å²	103.4	52%	0.524	62%	0.622	S	S	.	*	S	Bend	trans	69.3	53.4	160.1	-45.6	0	0	0	0	118.4
2552	A	24.2	Very low	25.3	Very low	75 Å²	75	100.3 Å²	100.3	62%	0.62	62%	0.615	S	S	*	*	S	Bend	trans	-147.9	114.8	131	0	0	0	0	0	108.1	L2549	L2549-A2552 HydrophobicContact CD2-CB 3.69Å
2553	C	23.7	Very low	25.3	Very low	133 Å²	133	101.6 Å²	101.6	90%	0.899	62%	0.618	S	S	*	*	S	Bend	cis	-87.9	105.6	10.1	-59.6	0	0	0	0	115
2554	T	22.5	Very low	25.3	Very low	91 Å²	91	109 Å²	109	56%	0.558	63%	0.632	S	S	*	*				-65.1	143	108.9	41.4	0	0	0	0	107.7
2555	A	25.3	Very low	25.1	Very low	73 Å²	73	111.2 Å²	111.2	60%	0.603	64%	0.635	S	S	*	*			cis	-143.9	160.8	24	0	0	0	0	0	109.4
2556	Q	23.3	Very low	25.1	Very low	152 Å²	152	115 Å²	115	71%	0.71	65%	0.647	S	S	*	*				46.8	130.1	81.9	-52.3	-173.4	-10.4	0	0	112.8
2557	K	26.6	Very low	25.1	Very low	95 Å²	95	115.1 Å²	115.1	41%	0.413	65%	0.648	S	S	.	*			cis	-165.4	161.7	10.8	-123.9	168.6	-179	-177.5	0	110	H1809 G1810	H1809-K2557 PolarHBondContact O-NZ 3.3Å; G1810-K2557 WeakPolarHBondContact O-CE 3.4Å; G1810-K2557 PolarHBondContact O-NZ 3.09Å
2558	Q	29	Very low	25.2	Very low	130 Å²	130	116.8 Å²	116.8	61%	0.607	65%	0.647	S	S	*	*			trans	75.9	152.8	142.6	-74.4	164.1	-26.3	0	0	118.6
2559	H	29.2	Very low	25.3	Very low	140 Å²	140	118.4 Å²	118.4	65%	0.648	65%	0.654	S	S	*	*			cis	-152.8	155.5	0.3	-130.3	-40.2	0	0	0	114.2
2560	V	26.1	Very low	25.3	Very low	109 Å²	109	118.6 Å²	118.6	66%	0.661	66%	0.655	S	S	*	*			trans	76	142.4	156.1	176.1	0	0	0	0	112.3
2561	S	29.1	Very low	25.5	Very low	27 Å²	27	117.9 Å²	117.9	19%	0.189	64%	0.643	C	S	.	*			cis	-148.3	139.6	34.8	-17.2	0	0	0	0	119.6	D440 L441 R442	D440-S2561 VanDerWaalsContact C-CB 3.43Å; D440-S2561 VanDerWaalsContact O-CB 3.22Å; D440-S2561 WeakPolarHBondContact O-CB 3.46Å; D440-S2561 PolarHBondContact O-OG 2.8Å; L441-S2561 VanDerWaalsContact C-N 3.31Å; L441-S2561 CarbonylContact C-O 3.6Å; L441-S2561 VanDerWaalsContact CA-O 3.28Å; L441-S2561 WeakPolarHBondContact CA-O 3.23Å; L441-S2561 PolarHBondContact N-O 3.41Å; L441-S2561 PolarHBondContact O-N 2.76Å; R442-S2561 PolarHBondContact N-O 3.17Å
2562	T	26.4	Very low	25.5	Very low	80 Å²	80	118 Å²	118	49%	0.491	64%	0.638	S	S	.	*			trans	31.8	116.1	136.4	53.1	0	0	0	0	123.3
2563	N	25.2	Very low	25.6	Very low	149 Å²	149	123.5 Å²	123.5	80%	0.797	64%	0.644	S	S	*	*				48.4	132.2	111.2	-54.1	-15.9	0	0	0	122.3
2564	R	26	Very low	25.6	Very low	246 Å²	246	123.9 Å²	123.9	93%	0.928	64%	0.636	S	S	*	*				-158.7	-174	116	-124.7	-177.1	-178.3	-179.7	0.6	114.5
2565	L	25.2	Very low	25.8	Very low	143 Å²	143	128 Å²	128	75%	0.749	67%	0.669	S	S	*	*			trans	-138.9	155.5	-160.2	-134.9	161.9	0	0	0	107.9
2566	L	24.3	Very low	25.8	Very low	141 Å²	141	130.8 Å²	130.8	74%	0.738	67%	0.672	S	S	*	*			trans	68.7	162.3	171.9	-50.3	165.9	0	0	0	114.6
2567	N	25.9	Very low	26	Very low	130 Å²	130	129.6 Å²	129.6	70%	0.695	67%	0.67	S	S	*	*			cis	-164.5	154.9	-28.2	-111.6	1.7	0	0	0	107.7
2568	L	25.4	Very low	26	Very low	154 Å²	154	131.6 Å²	131.6	81%	0.806	68%	0.684	S	S	*	*			trans	63.4	156.5	160.8	-80.2	164	0	0	0	119.2
2569	T	25	Very low	25.8	Very low	114 Å²	114	131.6 Å²	131.6	70%	0.699	69%	0.689	S	S	*	*			trans	61.1	129.6	158.5	45.5	0	0	0	0	121.4
2570	N	24.7	Very low	25.6	Very low	129 Å²	129	131.1 Å²	131.1	69%	0.69	69%	0.691	S	S	*	*			trans	64.9	124	144.1	-61.6	4.7	0	0	0	121
2571	N	25.3	Very low	25.5	Very low	89 Å²	89	132.6 Å²	132.6	48%	0.476	69%	0.693	S	S	.	*				49.7	126	128.1	-55.7	-5.9	0	0	0	121.1	T412	T412-N2571 HydrophobicContact CG2-CB 4.1Å; T412-N2571 WeakPolarHBondContact CG2-ND2 3.32Å
2572	D	24.4	Very low	25.3	Very low	78 Å²	78	140.1 Å²	140.1	42%	0.417	73%	0.729	S	S	.	*			trans	93.9	120.2	132.2	-73.6	-0.5	0	0	0	121.4	T412 D413	T412-D2572 WeakPolarHBondContact CA-OD2 3.28Å; T412-D2572 PolarHBondContact N-OD2 2.77Å; D413-D2572 PolarHBondContact N-OD2 2.92Å
2573	Y	24.9	Very low	25.2	Very low	190 Å²	190	144.8 Å²	144.8	75%	0.745	75%	0.748	S	S	*	*			trans	81.2	110.7	148.2	-83.1	-117.9	0	0	0	119.9
2574	L	24.6	Very low	25.2	Very low	142 Å²	142	144.4 Å²	144.4	74%	0.743	74%	0.744	S	S	*	*				30.8	131.9	125.5	-62.1	164.4	0	0	0	117.9
2575	S	26.7	Very low	25.1	Very low	177 Å²	177	135.2 Å²	135.2	100%	1.238	73%	0.727	S	S	*	*			cis	-120.3	0	15	61.9	0	0	0	0	113.4

Retrieved 2,575 of 2,575 residues in 3451.4 ms (Link to these results)

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