A0A3Q0KKT7_SCHMA Loading...

Putative 4.1 G protein

AlphaFold DB , UniProt , Accession A0A3Q0KKT7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,543 aa.

						>A0A3Q0KKT7_SCHMA|A0A3Q0KKT7
MSRSQSEVRNDTTKLLLDPTDTYPTRSLTIQSERSSEQIPSISWSVHPTSPLSSKSPTGTLSHENMDGNAGFFMVEVKLLSDEEVPLQMEVTNDCLGRVLFNQVIERLGGIIEKDYFGLRYLDRSKQRQWLEMSKTVYKQLKYVSPRSLNFRVKHYPSDPVNEFRQEKSRYLLYLQLRRDLHSGRLIGRNLEMHVLAACILQAEIGDYDVLLDYLGPEGTLADLKMFANITPKTESKIVEIYKSLKGMSMNDAENKFLENAAKFETYGIEPLYVQDRKGNHFYMGLNHEGVITYRGSRKAHVFSWQKINKISYEGKLFIIQVEWEQRRHTLGFKCPTPESAEALWKWAVDRQCFFTLNRSVDAKESKANGGLFKRRQFYTFTGRCQKELMQLNSSMPAIPQPKKLCFSHVFSLLFLLIRSRSLLNLAKSVHDKRHSQSQNDLDRKYVDSNENLQDSSRMNRLIKGLDHHRSSLETRRNNNELDDLNDNLFMNKRSTDQLSGGIRQQLQSQTLKDQQFSQQQHQHKSSLSTPNLINIPGIHQNDMETNDDNIAEKKSSTIQGDLLTDKKKLINVTIEEKNEPKKSDIMDGEKQRTSTKTDQMNITNIMNLIQSNTDHNNDVNDSLSSGVEANAEATEQPLQVDINLNNIDGGGVSGFCTGSVNTLSSSPLKSVDEDDDDVDENNEFVNDALKQTNNSDTYQKIKVGNWLGANGIKSIRNTEDEPSPITSINQKTDNYNNNNNSETLNNVSNDRLNTKQFISIDSENIVKDDSYSPISTISPMNPYSNDHEETETKFIHTIKPSISYSTSQKIETNPIKSQRKQLNSMKGTIMNPINDNSSTVDLFDENAKQSSMHLSTINRSKSLYFNQNKSITTMTTTTTTATPPTTTRTTGLYSLPKSQSSSYNHIDSINTSKSTIYYPYACTITTIHNTTTTTTTTNNNSNTFSPSLYSSTNYHQLPLHNIKSMKQYTELPRKTTHIYPKLSHIDYTLTNQNDLLLSSSRNDLYNVQYQSRRQSSLGRTKSIKDLSPQPRDWHEINSNIINNNNININPDINNMILDPIETTLSKNKKINYIDYIDTKYNIINNNNNNEPKSISNDLLYNNGYYSYNNIKQLPSNKIFNQSNVTTLIHTNSSYYNISNSMMAQTSSCTTSTSSPSSYQNVSSLAEATKSLNLNKNLFSSNSSSEVILRTQPSTIQNQSLSNSLAYLTQSSNANPKPASNCLIDSSTYFNHQNNRKPTISKLDYNNNDNNRTAGSTAAYLAATGVGAYKLNDSLALLTTRTDYLIESNINNDTTNNTTTNNDNVKYKENPKSVTFNQNNLITIENNENNKKLESQTKTPSYYSIKQTSSYSPSIPPKPSYLQSNNNQSRIIYQSRENNNTTTTTNTTNTTTANNDDEEIIPSRTFSRSGEINSTIPTFEDHAIKSMKRVTDKVQKIMNLDQIDNVTNSIDSIKLLPPLANKSITNNQSNISILSNQLTDTTTNTTTTSNTNDRINNTTYNTTNNTESNTQFISCFQQFFYYFIVAFIVYKLIIWFNLKPTFG
					

Structure Viewer

Loading PAE data...

(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	30.7	Very low	28	Very low	116 Å²	116	116.1 Å²	116.1	57%	0.571	58%	0.579	S	S	*	*				0	143.1	0	-73.7	179.5	162.2	0	0	108.6	I1047 I1049 T1348	M1-I1047 HydrophobicContact CE-CG2 4.3Å; M1-I1049 WeakPolarHBondContact CA-O 3.36Å; M1-I1049 VanDerWaalsContact CG-O 3.3Å; M1-I1049 WeakPolarHBondContact CG-O 3.22Å; M1-I1049 PolarHBondContact N-O 2.61Å; M1-T1348 PolarHBondContact O-OG1 3.18Å
2	S	24.7	Very low	27.9	Very low	61 Å²	61	109.1 Å²	109.1	43%	0.427	55%	0.547	S	S	.	.			cis	-160.9	150.2	-14.8	-86.4	0	0	0	0	111.1	I1049 P1051	S2-I1049 WeakPolarHBondContact OG-CG2 3.47Å; S2-P1051 CarbonylContact C-O 3.55Å; S2-P1051 VanDerWaalsContact C-O 3.25Å
3	R	24.5	Very low	27.9	Very low	157 Å²	157	106.7 Å²	106.7	59%	0.592	54%	0.542	S	S	*	.			trans	-4.7	122.7	159.7	-106.5	132.3	178.9	-160.1	-4.8	116.5	N1050 P1051	R3-N1050 WeakPolarHBondContact CD-O 3.27Å; R3-N1050 PolarHBondContact N-O 3.47Å; R3-P1051 VanDerWaalsContact CA-O 3.24Å; R3-P1051 WeakPolarHBondContact CA-O 3.4Å; R3-P1051 PolarHBondContact N-O 3.28Å
4	S	26.2	Very low	28.1	Very low	39 Å²	39	107.4 Å²	107.4	27%	0.273	54%	0.539	S	S	.	.				81.4	136.4	87.9	88	0	0	0	0	112.2	D1052	S4-D1052 WeakPolarHBondContact CB-OD2 3.19Å
5	Q	28.2	Very low	28.1	Very low	154 Å²	154	106.5 Å²	106.5	72%	0.72	54%	0.536	S	S	*	.				-158.8	137.4	51.2	-102.4	149.7	6.2	0	0	107.2
6	S	27	Very low	28.2	Very low	81 Å²	81	108.6 Å²	108.6	57%	0.566	55%	0.548	S	S	*	.				65.7	152.8	83.9	85.8	0	0	0	0	115.7
7	E	29	Very low	28.3	Very low	157 Å²	157	110.2 Å²	110.2	73%	0.734	56%	0.558	S	S	*	*			trans	85.1	136.2	-179.2	-58	-146.9	104.9	0	0	115.4
8	V	29.7	Very low	28.4	Very low	72 Å²	72	111.6 Å²	111.6	44%	0.436	57%	0.567	S	S	.	*			cis	-161	138.2	-4.8	109.9	0	0	0	0	112.4
9	R	28.3	Very low	29	Very low	195 Å²	195	110.9 Å²	110.9	74%	0.736	57%	0.571	S	S	*	*			trans	60.5	152.7	153.7	-63.7	176.1	-167.4	105.3	7	118.1
10	N	30	Very low	29	Very low	125 Å²	125	110.9 Å²	110.9	67%	0.668	58%	0.576	S	S	*	*			cis	-143.1	143.4	-6.3	-105.3	-3	0	0	0	106.9
11	D	29.4	Very low	29.3	Very low	120 Å²	120	112.9 Å²	112.9	64%	0.642	59%	0.588	S	S	*	*				55.2	130.1	79.4	-83.2	10.9	0	0	0	113.6
12	T	27.4	Very low	29.1	Very low	32 Å²	32	112 Å²	112	20%	0.196	59%	0.589	C	S	.	*			cis	-168.5	132.2	7.3	21.7	0	0	0	0	111.2	Q1233 N1234 N1235	T12-Q1233 WeakPolarHBondContact O-CG 3.21Å; T12-Q1233 PolarHBondContact O-NE2 2.89Å; T12-Q1233 VanDerWaalsContact O-NE2 3.11Å; T12-N1234 WeakPolarHBondContact CB-OD1 3.45Å; T12-N1234 PolarHBondContact O-OD1 2.96Å; T12-N1234 PolarHBondContact OG1-OD1 3.24Å; T12-N1235 HydrophobicContact CG2-CB 4.03Å; T12-N1235 WeakPolarHBondContact CG2-ND2 3.22Å
13	T	28	Very low	29.3	Very low	78 Å²	78	119.9 Å²	119.9	48%	0.479	61%	0.611	S	S	.	*				66.6	145.9	90.9	71.2	0	0	0	0	120.4	N1234 N1235	T13-N1234 VanDerWaalsContact O-CA 3.25Å; T13-N1234 WeakPolarHBondContact O-CA 3.4Å; T13-N1234 PolarHBondContact O-OD1 2.68Å; T13-N1235 WeakPolarHBondContact OG1-CA 3.49Å; T13-N1235 PolarHBondContact OG1-N 2.87Å
14	K	30.2	Very low	29.5	Very low	117 Å²	117	116.8 Å²	116.8	51%	0.509	61%	0.611	S	S	.	*			trans	55.5	177.1	157.6	-55.7	-161.1	-169.7	170.5	0	117.7	Q1233 N1235 R1236	K14-Q1233 CarbonylContact O-C 3.6Å; K14-Q1233 WeakPolarHBondContact O-CA 3.32Å; K14-Q1233 PolarHBondContact O-N 2.83Å; K14-N1235 WeakPolarHBondContact CD-O 3.22Å; K14-N1235 VanDerWaalsContact CE-C 3.43Å; K14-N1235 WeakPolarHBondContact CE-O 3.48Å; K14-N1235 PolarHBondContact NZ-O 2.82Å; K14-R1236 WeakPolarHBondContact CE-O 3.29Å; K14-R1236 PolarHBondContact NZ-O 2.98Å
15	L	27.5	Very low	29.6	Very low	94 Å²	94	122.1 Å²	122.1	49%	0.492	64%	0.643	S	S	.	*			cis	-129.2	140.8	6	-88.8	171.1	0	0	0	109.6
16	L	30.2	Very low	29.5	Very low	139 Å²	139	124.9 Å²	124.9	73%	0.728	65%	0.646	S	S	*	*				66.2	128.4	97.6	-137	83	0	0	0	112.3
17	L	30.1	Very low	29.5	Very low	137 Å²	137	126 Å²	126	72%	0.717	65%	0.654	S	S	*	*			cis	-138.1	142.6	33	-75.1	147.7	0	0	0	110.2
18	D	30.9	Very low	29.4	Very low	134 Å²	134	125.9 Å²	125.9	72%	0.717	66%	0.657	S	S	*	*				72	151.8	76.9	-117.7	4.8	0	0	0	113.3
19	P	39.8	Very low	29.2	Very low	100 Å²	100	128.1 Å²	128.1	65%	0.649	67%	0.672	S	S	*	*			cis	-133.6	164.9	7.8	43.4	-27.2	0	0	0	117.2
20	T	27.8	Very low	29.1	Very low	109 Å²	109	126.4 Å²	126.4	67%	0.669	68%	0.676	S	S	*	*			trans	37.8	126	145	58.5	0	0	0	0	121.4
21	D	35.2	Very low	29	Very low	153 Å²	153	128.9 Å²	128.9	82%	0.818	68%	0.683	S	S	*	*				-153.4	167.8	89.6	-135.7	-27.4	0	0	0	113.9
22	T	26.6	Very low	28.9	Very low	99 Å²	99	128.8 Å²	128.8	61%	0.607	69%	0.692	S	S	*	*			trans	-137.9	121.8	-152.7	-50.1	0	0	0	0	115.1
23	Y	28.9	Very low	29	Very low	226 Å²	226	135 Å²	135	89%	0.886	72%	0.718	S	S	*	*			trans	-140.3	153.7	160	-78.4	-74	0	0	0	113.5
24	P	30	Very low	28.9	Very low	92 Å²	92	141.5 Å²	141.5	60%	0.597	73%	0.734	S	S	*	*			trans	-120.5	162.5	-149.8	41.8	-32.2	0	0	0	116.3	R26	P24-R26 HydrophobicContact CG-CB 4.49Å; P24-R26 PolarHBondContact O-N 2.98Å
25	T	27.2	Very low	28.6	Very low	151 Å²	151	141.9 Å²	141.9	93%	0.926	75%	0.752	S	S	*	*			trans	-58.4	116.2	152.4	-50.2	0	0	0	0	109.3
26	R	27.1	Very low	28.5	Very low	212 Å²	212	142.2 Å²	142.2	80%	0.8	76%	0.762	S	S	*	*			trans	-130.7	106.9	175.9	-138.4	-179.5	-172.6	-176.7	2.6	113	P24	P24-R26 HydrophobicContact CG-CB 4.49Å; P24-R26 PolarHBondContact O-N 2.98Å
27	S	25.9	Very low	28.4	Very low	104 Å²	104	143.6 Å²	143.6	73%	0.727	77%	0.765	S	S	*	*			trans	-61.7	142	153.8	41.4	0	0	0	0	109.9
28	L	28.1	Very low	28.2	Very low	154 Å²	154	144.4 Å²	144.4	81%	0.806	77%	0.765	S	S	*	*			trans	-107.3	77	179.9	-95.6	165.4	0	0	0	111.5
29	T	24.6	Very low	28.2	Very low	120 Å²	120	145 Å²	145	74%	0.736	77%	0.766	S	S	*	*			trans	-81.4	122.9	157.6	-56.7	0	0	0	0	108.2	Q31	T29-Q31 PolarHBondContact O-N 3.13Å
30	I	27.3	Very low	27.8	Very low	159 Å²	159	145 Å²	145	82%	0.815	77%	0.767	S	S	*	*			trans	-86.1	103	175.6	-59.6	173.2	0	0	0	108.8
31	Q	27.7	Very low	27.9	Very low	177 Å²	177	144.7 Å²	144.7	83%	0.827	77%	0.769	S	S	*	*			trans	-162.8	112.3	161.5	-118.6	177.8	13	0	0	112.7	T29	T29-Q31 PolarHBondContact O-N 3.13Å
32	S	27.6	Very low	27.8	Very low	118 Å²	118	144.5 Å²	144.5	83%	0.825	77%	0.766	S	S	*	*				165.7	126.1	128.7	46.9	0	0	0	0	111.4
33	E	28.8	Very low	27.8	Very low	161 Å²	161	143.5 Å²	143.5	75%	0.752	76%	0.763	S	S	*	*				-157.6	132.4	116.9	-113.5	-161.2	139.7	0	0	112
34	R	25.6	Very low	27.8	Very low	215 Å²	215	144 Å²	144	81%	0.811	76%	0.764	S	S	*	*			trans	21.2	103.2	154.9	-66.5	167.8	166.1	161.7	-8.9	119.4
35	S	24.8	Very low	27.7	Very low	126 Å²	126	144.1 Å²	144.1	88%	0.881	77%	0.767	S	S	*	*				-150.3	151.6	115.6	-71.8	0	0	0	0	110.3
36	S	24.7	Very low	28	Very low	101 Å²	101	143.9 Å²	143.9	71%	0.706	77%	0.765	S	S	*	*			trans	-66.1	169.3	-172.5	37.6	0	0	0	0	116.8
37	E	27.5	Very low	28.2	Very low	168 Å²	168	142.2 Å²	142.2	79%	0.785	77%	0.766	S	S	*	*			trans	76.4	139.8	159.3	-74.1	159.7	-149.4	0	0	119.5
38	Q	27	Very low	28.7	Very low	154 Å²	154	142 Å²	142	72%	0.72	76%	0.762	S	S	*	*			cis	-164.3	159.3	-23.4	-129.1	-175.2	19.5	0	0	111.7
39	I	29.4	Very low	28.8	Very low	146 Å²	146	139.2 Å²	139.2	75%	0.749	75%	0.752	S	S	*	*			trans	75	144.7	150.8	-75.5	167.6	0	0	0	119.5
40	P	32.6	Very low	29.3	Very low	101 Å²	101	136 Å²	136	66%	0.656	73%	0.734	S	S	*	*			trans	-147.2	178.3	-139.9	43.6	-22.4	0	0	0	120.1
41	S	29.3	Very low	29.9	Very low	102 Å²	102	132 Å²	132	71%	0.713	72%	0.718	S	S	*	*			trans	70.7	178.1	137.9	73.2	0	0	0	0	123.3
42	I	32.8	Very low	29.9	Very low	148 Å²	148	128.8 Å²	128.8	76%	0.759	71%	0.706	S	S	*	*			trans	86.2	112.3	177.2	-53.3	169.1	0	0	0	113.6
43	S	27.4	Very low	30	Very low	79 Å²	79	127.6 Å²	127.6	55%	0.552	70%	0.698	S	S	*	*			cis	76.5	151.3	11.2	93.5	0	0	0	0	116.6
44	W	27.9	Very low	30.2	Very low	236 Å²	236	123.7 Å²	123.7	89%	0.894	69%	0.688	S	S	*	*			cis	-141.1	-174.6	16.4	-95.2	125.4	0	0	0	113.5
45	S	28.6	Very low	30.3	Very low	94 Å²	94	123.4 Å²	123.4	66%	0.657	69%	0.693	S	S	*	*			trans	-59.7	167.7	179.1	-38.4	0	0	0	0	118.2
46	V	32.7	Very low	30.6	Very low	147 Å²	147	121.1 Å²	121.1	89%	0.891	68%	0.677	S	S	*	*				-172.8	153.2	115.6	146.2	0	0	0	0	112.7
47	H	32.6	Very low	30.9	Very low	177 Å²	177	122.1 Å²	122.1	82%	0.819	68%	0.681	S	S	*	*			trans	-94	-170.6	-176.1	-98.2	-69	0	0	0	112.9
48	P	35.5	Very low	31.1	Very low	100 Å²	100	120.7 Å²	120.7	65%	0.649	68%	0.684	S	S	*	*			cis	-137.5	-168.9	-12.3	22.6	3.9	0	0	0	115.9
49	T	31	Very low	31.3	Very low	95 Å²	95	116.6 Å²	116.6	58%	0.583	68%	0.683	S	S	*	*			trans	108.1	84.6	148.1	64.9	0	0	0	0	122.6	N1038	T49-N1038 PolarHBondContact O-ND2 2.91Å; T49-N1038 PolarHBondContact O-OD1 2.85Å
50	S	33.9	Very low	31.3	Very low	52 Å²	52	116.5 Å²	116.5	36%	0.364	69%	0.689	S	S	.	*				81.7	148.8	117	-48.3	0	0	0	0	121.4	I1037 N1038	S50-I1037 CarbonylContact O-C 3.28Å; S50-I1037 VanDerWaalsContact O-C 3.28Å; S50-I1037 VanDerWaalsContact O-CG1 3.29Å; S50-I1037 WeakPolarHBondContact O-CG1 3.35Å; S50-N1038 WeakPolarHBondContact CB-OD1 3.3Å; S50-N1038 VanDerWaalsContact O-CA 3.25Å; S50-N1038 WeakPolarHBondContact O-CA 3.18Å; S50-N1038 VanDerWaalsContact O-CG 3.29Å; S50-N1038 PolarHBondContact O-N 3.49Å; S50-N1038 PolarHBondContact O-ND2 3.45Å
51	P	39.6	Very low	31.3	Very low	75 Å²	75	119.4 Å²	119.4	49%	0.487	70%	0.699	S	S	.	*			trans	-117	153.6	-142.7	40.4	-31.2	0	0	0	117.2	E1036 N1038 S1039	P51-E1036 WeakPolarHBondContact CA-OE2 3.46Å; P51-E1036 WeakPolarHBondContact CB-OE2 3.13Å; P51-N1038 VanDerWaalsContact C-N 3.33Å; P51-N1038 CarbonylContact O-C 3.46Å; P51-S1039 PolarHBondContact O-N 3.31Å
52	L	29.3	Very low	31.3	Very low	110 Å²	110	118 Å²	118	58%	0.576	69%	0.689	S	S	*	*			trans	-161.2	91.6	168.8	-153.4	80.5	0	0	0	117	E1036	L52-E1036 VanDerWaalsContact C-CD 3.43Å; L52-E1036 VanDerWaalsContact N-CD 3.32Å; L52-E1036 PolarHBondContact N-OE2 2.88Å; L52-E1036 WeakPolarHBondContact O-CB 3.35Å
53	S	29.8	Very low	31.5	Very low	92 Å²	92	120.9 Å²	120.9	64%	0.643	70%	0.698	S	S	*	*			trans	35.6	104.7	144.3	172.1	0	0	0	0	120.1	E1036	S53-E1036 VanDerWaalsContact N-CD 3.25Å; S53-E1036 PolarHBondContact N-OE1 2.85Å
54	S	31.6	Very low	31.7	Very low	80 Å²	80	124.2 Å²	124.2	56%	0.559	71%	0.705	S	S	*	*			trans	-138	152.3	137.4	70.7	0	0	0	0	111.2	H1035	S54-H1035 PolarHBondContact OG-O 3.15Å
55	K	29	Very low	32	Very low	208 Å²	208	119.1 Å²	119.1	90%	0.904	70%	0.696	S	S	*	*			trans	-100.3	131.7	-173.4	-66.9	175.1	-179.3	172.7	0	111.6
56	S	29.4	Very low	32.5	Very low	78 Å²	78	123.2 Å²	123.2	55%	0.545	71%	0.707	S	S	.	*			trans	-125.3	150.8	163.8	62	0	0	0	0	111.2
57	P	31.5	Very low	33.2	Very low	123 Å²	123	119.9 Å²	119.9	80%	0.799	68%	0.684	S	S	*	*			trans	-90.1	134.1	-169.3	33.4	-34.1	0	0	0	113.6	G59	P57-G59 VanDerWaalsContact C-N 3.33Å; P57-G59 PolarHBondContact O-N 3.23Å
58	T	31.2	Very low	33.7	Very low	138 Å²	138	114.6 Å²	114.6	85%	0.847	68%	0.677	S	S	*	*			trans	-75.5	81	169.2	35.3	0	0	0	0	111.3	T60	T58-T60 PolarHBondContact O-N 2.96Å
59	G	31.4	Very low	34.3	Very low	67 Å²	67	117.9 Å²	117.9	69%	0.691	69%	0.689	S	S	*	*			trans	-60.3	118	177.2	0	0	0	0	0	112.5	P57 L61	P57-G59 VanDerWaalsContact C-N 3.33Å; P57-G59 PolarHBondContact O-N 3.23Å; G59-L61 PolarHBondContact O-N 3.4Å; G59-L61 VanDerWaalsContact O-N 3.11Å
60	T	31.2	Very low	35.6	Very low	145 Å²	145	115.8 Å²	115.8	89%	0.89	68%	0.682	S	S	*	*			trans	-78.3	93.8	-179.5	-50.6	0	0	0	0	110.4	T58 S62	T58-T60 PolarHBondContact O-N 2.96Å; T60-S62 PolarHBondContact O-N 3.37Å
61	L	31.5	Very low	37.9	Very low	162 Å²	162	115.3 Å²	115.3	85%	0.848	69%	0.685	S	S	*	*			trans	-76.8	102.1	178.5	-85.6	165.7	0	0	0	112.1	G59	G59-L61 PolarHBondContact O-N 3.4Å; G59-L61 VanDerWaalsContact O-N 3.11Å
62	S	30.5	Very low	40.1	Very low	73 Å²	73	117.2 Å²	117.2	51%	0.51	69%	0.686	S	S	.	*			trans	40.4	99.7	141.2	59.5	0	0	0	0	118.4	T60 E64	T60-S62 PolarHBondContact O-N 3.37Å; S62-E64 PolarHBondContact O-N 2.7Å
63	H	35.1	Very low	43	Very low	207 Å²	207	112.5 Å²	112.5	96%	0.958	66%	0.661	S	S	*	*			trans	-83.7	49.8	148.9	-162.8	-61	0	0	0	110.1
64	E	31.9	Very low	46	Very low	149 Å²	149	112.7 Å²	112.7	70%	0.696	65%	0.653	S	S	*	*			trans	-104.9	151.8	174.2	-63.9	-164.3	128.4	0	0	110	S62	S62-E64 PolarHBondContact O-N 2.7Å
65	N	34	Very low	49	Very low	130 Å²	130	109 Å²	109	70%	0.695	63%	0.626	S	S	*	*			trans	66.6	80.4	169	-51.9	-37.4	0	0	0	117.4
66	M	39	Very low	52.1	Low	179 Å²	179	101 Å²	101	88%	0.882	59%	0.592	S	S	*	*	S	Bend	trans	-126	-36.2	144.3	-80.5	-66	163.8	0	0	111.7	G68	M66-G68 PolarHBondContact O-N 2.89Å
67	D	47.9	Very low	55.3	Low	78 Å²	78	97.2 Å²	97.2	42%	0.417	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62	3.8	169.8	-67	32	0	0	0	114.8	R147	D67-R147 IonicContact OD2-CZ 3.71Å; D67-R147 IonicContact OD2-NH1 2.79Å; D67-R147 PolarHBondContact OD2-NH1 2.75Å; D67-R147 IonicContact OD2-NH2 3.31Å; D67-R147 PolarHBondContact OD2-NH2 3.04Å
68	G	44.2	Very low	58.3	Low	66 Å²	66	95.4 Å²	95.4	68%	0.68	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-18.7	-171.7	0	0	0	0	0	115.6	M66	M66-G68 PolarHBondContact O-N 2.89Å
69	N	48.5	Very low	61.3	Low	168 Å²	168	89.4 Å²	89.4	90%	0.898	51%	0.509	S	S	*	.	S	Bend	trans	-128.7	5.7	-174.2	-155	31.6	0	0	0	114.1
70	A	58.2	Low	64.1	Low	52 Å²	52	86.4 Å²	86.4	43%	0.43	48%	0.477	S	S	.	.			trans	-104.2	124.3	172.4	0	0	0	0	0	109.7	F72 N93	A70-F72 PolarHBondContact O-N 3.28Å; A70-N93 PolarHBondContact O-ND2 3.39Å
71	G	81	Confident	66.7	Low	42 Å²	42	80.7 Å²	80.7	43%	0.433	44%	0.443	S	S	.	.	S	Bend	trans	-69.8	-8.1	178.4	0	0	0	0	0	114.7	T92 N93	G71-T92 VanDerWaalsContact O-CA 3.28Å; G71-T92 WeakPolarHBondContact O-CA 3.47Å; G71-N93 PolarHBondContact O-N 3.12Å
72	F	86.5	Confident	68.7	Low	114 Å²	114	78.6 Å²	78.6	50%	0.5	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.4	-169.9	-58.2	-100.6	0	0	0	110.8	A70 E90 V91 T92	A70-F72 PolarHBondContact O-N 3.28Å; F72-E90 HydrophobicContact CB-CG 4Å; F72-E90 WeakPolarHBondContact CB-OE1 3.26Å; F72-E90 HydrophobicContact CD1-CG 3.99Å; F72-E90 HydrophobicContact CG-CG 4.37Å; F72-V91 CarbonylContact C-O 3.55Å; F72-V91 WeakPolarHBondContact CA-O 3.27Å; F72-T92 HydrophobicContact CD1-CG2 3.48Å; F72-T92 VanDerWaalsContact CD1-CG2 3.48Å; F72-T92 HydrophobicContact CE1-CG2 3.29Å; F72-T92 HydrophobicContact CG-CG2 4.22Å; F72-T92 HydrophobicContact CZ-CG2 3.87Å
73	F	90.5	Very high	70.6	Confident	11 Å²	11	80.2 Å²	80.2	5%	0.048	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.4	171.4	65.9	-79.7	0	0	0	110.9	V75 V91 N93 V137 Y138	F73-V75 HydrophobicContact CD2-CG2 3.71Å; F73-V75 HydrophobicContact CE2-CG2 3.32Å; F73-V75 HydrophobicContact CZ-CG2 4.21Å; F73-V91 WeakPolarHBondContact CD1-O 3.3Å; F73-V91 HydrophobicContact CE1-CB 4.18Å; F73-V91 HydrophobicContact CE1-CG1 3.93Å; F73-V91 WeakPolarHBondContact CE1-O 3.33Å; F73-V91 HydrophobicContact CE2-CB 4.43Å; F73-V91 HydrophobicContact CE2-CG1 4.48Å; F73-V91 HydrophobicContact CZ-CB 4.12Å; F73-V91 HydrophobicContact CZ-CG1 3.79Å; F73-V91 PolarHBondContact N-O 3.22Å; F73-V91 PolarHBondContact O-N 3.44Å; F73-N93 VanDerWaalsContact CD1-OD1 3.3Å; F73-N93 WeakPolarHBondContact CD1-OD1 3.22Å; F73-V137 HydrophobicContact CE2-CG1 4.22Å; F73-V137 HydrophobicContact CZ-CB 4.13Å; F73-V137 HydrophobicContact CZ-CG1 3.91Å; F73-Y138 HydrophobicContact CD1-CD2 4.36Å; F73-Y138 HydrophobicContact CE1-CD2 4.17Å
74	M	92.2	Very high	72.8	Confident	97 Å²	97	72.8 Å²	72.8	48%	0.478	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	143.8	176.6	-64	-54.8	-64.3	0	0	112.1	Q88 E90	M74-Q88 HydrophobicContact CE-CB 3.84Å; M74-E90 HydrophobicContact CE-CB 4.49Å; M74-E90 HydrophobicContact SD-CB 3.78Å; M74-E90 HydrophobicContact SD-CG 4.06Å
75	V	94.3	Very high	75.4	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.006	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.9	174.4	-178.6	0	0	0	0	108.9	F73 V77 M89 V91 L100 V137 L141 L149	F73-V75 HydrophobicContact CD2-CG2 3.71Å; F73-V75 HydrophobicContact CE2-CG2 3.32Å; F73-V75 HydrophobicContact CZ-CG2 4.21Å; V75-V77 HydrophobicContact CG1-CG2 4.42Å; V75-M89 PolarHBondContact N-O 3.03Å; V75-M89 PolarHBondContact O-N 2.61Å; V75-V91 HydrophobicContact CB-CG2 4.06Å; V75-V91 HydrophobicContact CG2-CB 4.1Å; V75-V91 HydrophobicContact CG2-CG2 3.71Å; V75-L100 HydrophobicContact CG1-CD2 4.22Å; V75-V137 HydrophobicContact CG2-CG1 4.33Å; V75-L141 HydrophobicContact CG1-CD1 4.11Å; V75-L141 HydrophobicContact CG2-CD1 4.32Å; V75-L149 HydrophobicContact CG1-CD1 3.65Å; V75-L149 HydrophobicContact CG1-CG 4.24Å
76	E	94.6	Very high	78	Confident	40 Å²	40	67.2 Å²	67.2	19%	0.187	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128.2	175.3	-178.8	-167.9	-162.6	0	0	109.3	K78 P86 R147 S148 L149	E76-K78 HydrophobicContact CG-CG 4.38Å; E76-K78 WeakPolarHBondContact OE1-CE 3.48Å; E76-K78 IonicContact OE1-NZ 3.12Å; E76-K78 WeakPolarHBondContact OE2-CE 3.44Å; E76-K78 IonicContact OE2-NZ 2.76Å; E76-P86 HydrophobicContact CG-CB 3.64Å; E76-P86 HydrophobicContact CG-CG 4.49Å; E76-P86 WeakPolarHBondContact OE1-CG 3.38Å; E76-R147 PolarHBondContact N-O 3.11Å; E76-S148 CarbonylContact O-C 3.25Å; E76-S148 WeakPolarHBondContact O-CA 3.28Å; E76-S148 WeakPolarHBondContact OE2-CB 3.32Å; E76-L149 PolarHBondContact O-N 3Å
77	V	95.7	Very high	80.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	103.1	174.9	-175.7	0	0	0	0	110.3	V75 L87 M89 V104 L119 L149 F151	V75-V77 HydrophobicContact CG1-CG2 4.42Å; V77-L87 HydrophobicContact CB-CB 4.28Å; V77-L87 PolarHBondContact N-O 2.63Å; V77-L87 PolarHBondContact O-N 2.89Å; V77-M89 HydrophobicContact CG2-CG 3.91Å; V77-V104 HydrophobicContact CB-CG2 4.35Å; V77-V104 HydrophobicContact CG1-CG1 4.18Å; V77-V104 HydrophobicContact CG1-CG2 4.04Å; V77-V104 HydrophobicContact CG2-CG2 3.97Å; V77-L119 HydrophobicContact CG1-CD2 3.55Å; V77-L149 WeakPolarHBondContact CA-O 2.95Å; V77-L149 HydrophobicContact CG2-CB 4.32Å; V77-F151 HydrophobicContact CG1-CB 4.4Å
78	K	94.6	Very high	82.8	Confident	85 Å²	85	61.2 Å²	61.2	37%	0.37	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	129.7	175.5	-59.2	-167.1	173.3	-170.4	0	110.1	E76 P86 L149 N150 F151	E76-K78 HydrophobicContact CG-CG 4.38Å; E76-K78 WeakPolarHBondContact OE1-CE 3.48Å; E76-K78 IonicContact OE1-NZ 3.12Å; E76-K78 WeakPolarHBondContact OE2-CE 3.44Å; E76-K78 IonicContact OE2-NZ 2.76Å; K78-P86 HydrophobicContact CG-CB 4.14Å; K78-P86 HydrophobicContact CG-CG 4.07Å; K78-L149 PolarHBondContact N-O 3.3Å; K78-N150 WeakPolarHBondContact O-CA 3.5Å; K78-F151 PolarHBondContact O-N 3.5Å
79	L	93.9	Very high	85.1	Confident	12 Å²	12	58.6 Å²	58.6	6%	0.063	32%	0.317	C	S	.	.			trans	-83.3	-170.1	-178.6	-61.6	-172.9	0	0	0	111.6	E84 L87 L108 F151 R152	L79-E84 HydrophobicContact CB-CB 4.22Å; L79-E84 VanDerWaalsContact CB-OE2 3.22Å; L79-E84 WeakPolarHBondContact CB-OE2 3.49Å; L79-E84 HydrophobicContact CD1-CB 4.16Å; L79-L87 HydrophobicContact CD1-CD1 4.35Å; L79-L87 HydrophobicContact CD1-CD2 4.47Å; L79-L87 HydrophobicContact CD1-CG 4.1Å; L79-L87 HydrophobicContact CD2-CD1 3.88Å; L79-L87 HydrophobicContact CD2-CG 4.09Å; L79-L87 HydrophobicContact CG-CG 4.24Å; L79-L108 HydrophobicContact CD1-CD2 3.95Å; L79-L108 HydrophobicContact CD2-CD2 3.98Å; L79-F151 HydrophobicContact CD2-CB 4.29Å; L79-R152 PolarHBondContact O-NH1 2.84Å
80	L	91.8	Very high	87.2	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	30%	0.301	C	S	.	.	S	Bend	trans	-82.1	-42	-172.1	-86.5	161.9	0	0	0	112.5	F151 L172 L175 Q176 R179	L80-F151 HydrophobicContact CD1-CD1 3.73Å; L80-F151 HydrophobicContact CD1-CE1 3.79Å; L80-F151 HydrophobicContact CG-CD1 4.04Å; L80-F151 WeakPolarHBondContact CG-O 3.28Å; L80-L172 HydrophobicContact CD1-CB 3.99Å; L80-L172 HydrophobicContact CD1-CD2 3.96Å; L80-L172 WeakPolarHBondContact CD1-O 3.29Å; L80-L175 HydrophobicContact CB-CB 4.06Å; L80-L175 HydrophobicContact CB-CD1 4.32Å; L80-Q176 HydrophobicContact CD2-CB 3.82Å; L80-Q176 HydrophobicContact CD2-CG 4.42Å; L80-R179 PolarHBondContact O-NH1 3.01Å; L80-R179 VanDerWaalsContact O-NH1 3.11Å
81	S	85.1	Confident	88.8	Confident	25 Å²	25	54 Å²	54	18%	0.175	28%	0.281	C	S	.	.	S	Bend	trans	-67.1	140.4	162.1	-179.2	0	0	0	0	109.8	E83	S81-E83 PolarHBondContact OG-N 3.49Å; S81-E83 VanDerWaalsContact OG-N 3.13Å
82	D	72.6	Confident	89.3	Confident	118 Å²	118	54.7 Å²	54.7	63%	0.631	28%	0.277	S	S	*	.	S	Bend	trans	-81.4	-5.3	171	-73.9	-44.1	0	0	0	112.7	R179	D82-R179 IonicContact OD1-CZ 2.74Å; D82-R179 IonicContact OD1-NH1 3.57Å; D82-R179 PolarHBondContact OD1-NH1 2.76Å; D82-R179 IonicContact OD1-NH2 3.08Å; D82-R179 PolarHBondContact OD1-NH2 3.07Å; D82-R179 IonicContact OD2-CZ 3.45Å; D82-R179 IonicContact OD2-NH1 2.68Å; D82-R179 PolarHBondContact OD2-NH1 3.15Å; D82-R179 IonicContact OD2-NH2 2.69Å; D82-R179 PolarHBondContact OD2-NH2 2.82Å
83	E	71.8	Confident	89.5	Confident	107 Å²	107	51.3 Å²	51.3	50%	0.5	26%	0.264	S	S	.	.	S	Bend	trans	-96.9	-18.8	-179	-57.7	170.4	179.9	0	0	112.5	S81 F415 R419	S81-E83 PolarHBondContact OG-N 3.49Å; S81-E83 VanDerWaalsContact OG-N 3.13Å; E83-F415 WeakPolarHBondContact OE2-CE2 3.34Å; E83-R419 IonicContact OE1-CZ 2.63Å; E83-R419 VanDerWaalsContact OE1-CZ 3.32Å; E83-R419 IonicContact OE1-NH1 3.97Å; E83-R419 PolarHBondContact OE1-NH1 2.85Å; E83-R419 IonicContact OE1-NH2 2.92Å; E83-R419 PolarHBondContact OE1-NH2 3.39Å; E83-R419 IonicContact OE2-CZ 2.88Å; E83-R419 IonicContact OE2-NH1 3.3Å; E83-R419 PolarHBondContact OE2-NH1 3.16Å; E83-R419 IonicContact OE2-NH2 3.98Å
84	E	80	Confident	89.5	Confident	50 Å²	50	56.8 Å²	56.8	23%	0.234	29%	0.294	C	S	.	.	S	Bend	trans	-74.1	130.1	176.3	-73.4	175.8	140.5	0	0	111.1	L79 P86	L79-E84 HydrophobicContact CB-CB 4.22Å; L79-E84 VanDerWaalsContact CB-OE2 3.22Å; L79-E84 WeakPolarHBondContact CB-OE2 3.49Å; L79-E84 HydrophobicContact CD1-CB 4.16Å; E84-P86 WeakPolarHBondContact O-CD 3.43Å
85	V	86.9	Confident	89.6	Confident	126 Å²	126	52.7 Å²	52.7	76%	0.764	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-58.3	124.7	176.9	-179.6	0	0	0	0	109.9	L87	V85-L87 PolarHBondContact O-N 2.91Å
86	P	89.9	Confident	89.6	Confident	36 Å²	36	55 Å²	55	23%	0.234	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-55.7	132.5	-179.4	-28.4	36	0	0	0	112.7	E76 K78 E84 Q88	E76-P86 HydrophobicContact CG-CB 3.64Å; E76-P86 HydrophobicContact CG-CG 4.49Å; E76-P86 WeakPolarHBondContact OE1-CG 3.38Å; K78-P86 HydrophobicContact CG-CB 4.14Å; K78-P86 HydrophobicContact CG-CG 4.07Å; E84-P86 WeakPolarHBondContact O-CD 3.43Å; P86-Q88 PolarHBondContact O-N 2.72Å; P86-Q88 VanDerWaalsContact O-N 3.14Å
87	L	92.9	Very high	89.7	Confident	26 Å²	26	53.1 Å²	53.1	14%	0.136	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	113.4	179.1	-62.1	-178.6	0	0	0	109.5	V77 L79 V85 M89 R107	V77-L87 HydrophobicContact CB-CB 4.28Å; V77-L87 PolarHBondContact N-O 2.63Å; V77-L87 PolarHBondContact O-N 2.89Å; L79-L87 HydrophobicContact CD1-CD1 4.35Å; L79-L87 HydrophobicContact CD1-CD2 4.47Å; L79-L87 HydrophobicContact CD1-CG 4.1Å; L79-L87 HydrophobicContact CD2-CD1 3.88Å; L79-L87 HydrophobicContact CD2-CG 4.09Å; L79-L87 HydrophobicContact CG-CG 4.24Å; V85-L87 PolarHBondContact O-N 2.91Å; L87-M89 HydrophobicContact CB-SD 4.37Å; L87-R107 HydrophobicContact CD1-CB 4.05Å
88	Q	92.9	Very high	89.6	Confident	105 Å²	105	60 Å²	60	49%	0.491	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	121.3	170.1	-59.2	-58.4	-26.2	0	0	109.2	M74 P86	M74-Q88 HydrophobicContact CE-CB 3.84Å; P86-Q88 PolarHBondContact O-N 2.72Å; P86-Q88 VanDerWaalsContact O-N 3.14Å
89	M	93.2	Very high	89.6	Confident	12 Å²	12	58.4 Å²	58.4	6%	0.059	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.6	-177.1	-60.5	-58	-59.2	0	0	109.8	V75 V77 L87 V91 L100 Q103 V104 R107	V75-M89 PolarHBondContact N-O 3.03Å; V75-M89 PolarHBondContact O-N 2.61Å; V77-M89 HydrophobicContact CG2-CG 3.91Å; L87-M89 HydrophobicContact CB-SD 4.37Å; M89-V91 HydrophobicContact CB-CG2 4.22Å; M89-L100 HydrophobicContact CB-CD1 3.77Å; M89-L100 HydrophobicContact CE-CD1 4.32Å; M89-L100 HydrophobicContact CG-CD1 3.92Å; M89-Q103 HydrophobicContact CE-CB 3.59Å; M89-Q103 HydrophobicContact CE-CG 4.49Å; M89-V104 HydrophobicContact CG-CG2 4.38Å; M89-R107 HydrophobicContact SD-CG 4.45Å
90	E	91.8	Very high	89.7	Confident	122 Å²	122	57.8 Å²	57.8	57%	0.57	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.4	170.6	-171.1	177.5	-169.4	0	0	109.7	F72 M74	F72-E90 HydrophobicContact CB-CG 4Å; F72-E90 WeakPolarHBondContact CB-OE1 3.26Å; F72-E90 HydrophobicContact CD1-CG 3.99Å; F72-E90 HydrophobicContact CG-CG 4.37Å; M74-E90 HydrophobicContact CE-CB 4.49Å; M74-E90 HydrophobicContact SD-CB 3.78Å; M74-E90 HydrophobicContact SD-CG 4.06Å
91	V	92.5	Very high	89.9	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.012	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	126.7	-165.5	-177.8	0	0	0	0	110.1	F72 F73 V75 M89 C95 L100 V137	F72-V91 CarbonylContact C-O 3.55Å; F72-V91 WeakPolarHBondContact CA-O 3.27Å; F73-V91 WeakPolarHBondContact CD1-O 3.3Å; F73-V91 HydrophobicContact CE1-CB 4.18Å; F73-V91 HydrophobicContact CE1-CG1 3.93Å; F73-V91 WeakPolarHBondContact CE1-O 3.33Å; F73-V91 HydrophobicContact CE2-CB 4.43Å; F73-V91 HydrophobicContact CE2-CG1 4.48Å; F73-V91 HydrophobicContact CZ-CB 4.12Å; F73-V91 HydrophobicContact CZ-CG1 3.79Å; F73-V91 PolarHBondContact N-O 3.22Å; F73-V91 PolarHBondContact O-N 3.44Å; V75-V91 HydrophobicContact CB-CG2 4.06Å; V75-V91 HydrophobicContact CG2-CB 4.1Å; V75-V91 HydrophobicContact CG2-CG2 3.71Å; M89-V91 HydrophobicContact CB-CG2 4.22Å; V91-C95 HydrophobicContact CG1-CB 3.49Å; V91-C95 VanDerWaalsContact CG1-CB 3.49Å; V91-L100 HydrophobicContact CG2-CD1 3.92Å; V91-L100 HydrophobicContact CG2-CD2 4.35Å; V91-V137 HydrophobicContact CG1-CB 4.07Å; V91-V137 HydrophobicContact CG1-CG1 4.33Å; V91-V137 HydrophobicContact CG1-CG2 4.25Å
92	T	92.7	Very high	90.4	Very high	56 Å²	56	59.4 Å²	59.4	34%	0.344	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	152.6	173.8	54.4	0	0	0	0	112.1	G71 F72 D94 C95	G71-T92 VanDerWaalsContact O-CA 3.28Å; G71-T92 WeakPolarHBondContact O-CA 3.47Å; F72-T92 HydrophobicContact CD1-CG2 3.48Å; F72-T92 VanDerWaalsContact CD1-CG2 3.48Å; F72-T92 HydrophobicContact CE1-CG2 3.29Å; F72-T92 HydrophobicContact CG-CG2 4.22Å; F72-T92 HydrophobicContact CZ-CG2 3.87Å; T92-D94 PolarHBondContact O-N 3.36Å; T92-D94 VanDerWaalsContact O-N 3.14Å; T92-C95 WeakPolarHBondContact O-CB 3.42Å; T92-C95 PolarHBondContact O-N 3.16Å; T92-C95 WeakPolarHBondContact OG1-CB 3.32Å; T92-C95 PolarHBondContact OG1-N 3.43Å
93	N	90.1	Very high	91.4	Very high	42 Å²	42	56.8 Å²	56.8	23%	0.225	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.4	178.2	-69.9	-37	0	0	0	113.6	A70 G71 F73 Y138	A70-N93 PolarHBondContact O-ND2 3.39Å; G71-N93 PolarHBondContact O-N 3.12Å; F73-N93 VanDerWaalsContact CD1-OD1 3.3Å; F73-N93 WeakPolarHBondContact CD1-OD1 3.22Å; N93-Y138 HydrophobicContact CB-CD2 4.38Å; N93-Y138 HydrophobicContact CB-CG 4.46Å; N93-Y138 VanDerWaalsContact O-CB 3.25Å; N93-Y138 WeakPolarHBondContact O-CB 3.24Å; N93-Y138 WeakPolarHBondContact OD1-CD2 3.36Å
94	D	91.2	Very high	92.5	Very high	127 Å²	127	51.7 Å²	51.7	68%	0.679	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-2.2	176.2	-69.2	-53.9	0	0	0	114.8	T92 L96 T136	T92-D94 PolarHBondContact O-N 3.36Å; T92-D94 VanDerWaalsContact O-N 3.14Å; D94-L96 PolarHBondContact O-N 3.47Å; D94-T136 WeakPolarHBondContact O-CG2 3.3Å
95	C	93.6	Very high	93.2	Very high	11 Å²	11	49.6 Å²	49.6	7%	0.074	26%	0.255	C	S	.	.			trans	-59.2	125	-179.6	-173.9	0	0	0	0	111.3	V91 T92 T136 V137	V91-C95 HydrophobicContact CG1-CB 3.49Å; V91-C95 VanDerWaalsContact CG1-CB 3.49Å; T92-C95 WeakPolarHBondContact O-CB 3.42Å; T92-C95 PolarHBondContact O-N 3.16Å; T92-C95 WeakPolarHBondContact OG1-CB 3.32Å; T92-C95 PolarHBondContact OG1-N 3.43Å; C95-T136 CarbonylContact O-C 3.53Å; C95-T136 WeakPolarHBondContact O-CA 3.3Å; C95-T136 WeakPolarHBondContact O-CB 3.44Å; C95-V137 PolarHBondContact O-N 3.02Å
96	L	95	Very high	93.5	Very high	50 Å²	50	49 Å²	49	26%	0.262	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-77.2	148.2	175.8	-66.6	173.5	0	0	0	111.2	D94 R98 V99 L100 T136	D94-L96 PolarHBondContact O-N 3.47Å; L96-R98 HydrophobicContact CB-CG 4.27Å; L96-R98 PolarHBondContact O-N 3.21Å; L96-R98 VanDerWaalsContact O-N 3.09Å; L96-V99 HydrophobicContact CB-CG2 4.37Å; L96-V99 WeakPolarHBondContact O-CB 3.15Å; L96-V99 PolarHBondContact O-N 3.43Å; L96-L100 PolarHBondContact O-N 2.75Å; L96-T136 HydrophobicContact CD2-CG2 4.03Å
97	G	94.8	Very high	93.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-51.5	-36.8	177.3	0	0	0	0	0	113.4	V99 F101 K135	G97-V99 VanDerWaalsContact C-N 3.26Å; G97-V99 PolarHBondContact O-N 3.33Å; G97-F101 VanDerWaalsContact O-CB 3.29Å; G97-F101 WeakPolarHBondContact O-CB 3.45Å; G97-F101 PolarHBondContact O-N 3.47Å; G97-K135 PolarHBondContact N-O 3.22Å
98	R	94.7	Very high	93.4	Very high	145 Å²	145	54.8 Å²	54.8	55%	0.547	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-31.6	175.1	84.4	175.5	-159	-116.7	-2.3	114.3	L96 N102 M133	L96-R98 HydrophobicContact CB-CG 4.27Å; L96-R98 PolarHBondContact O-N 3.21Å; L96-R98 VanDerWaalsContact O-N 3.09Å; R98-N102 WeakPolarHBondContact O-CB 3.3Å; R98-N102 PolarHBondContact O-N 2.74Å; R98-N102 PolarHBondContact O-ND2 3.23Å; R98-M133 HydrophobicContact CB-CB 4.16Å; R98-M133 PolarHBondContact N-O 3.18Å; R98-M133 VanDerWaalsContact N-O 3.09Å
99	V	95.3	Very high	93	Very high	50 Å²	50	52.2 Å²	52.2	30%	0.303	26%	0.263	S	S	.	.	H	α-helix	trans	-79.5	-50.4	-174.2	176.8	0	0	0	0	109.2	L96 G97 F101 N102 Q103	L96-V99 HydrophobicContact CB-CG2 4.37Å; L96-V99 WeakPolarHBondContact O-CB 3.15Å; L96-V99 PolarHBondContact O-N 3.43Å; G97-V99 VanDerWaalsContact C-N 3.26Å; G97-V99 PolarHBondContact O-N 3.33Å; V99-F101 VanDerWaalsContact C-N 3.26Å; V99-F101 PolarHBondContact O-N 3.48Å; V99-N102 PolarHBondContact O-N 3.12Å; V99-Q103 WeakPolarHBondContact O-CG 3.14Å; V99-Q103 PolarHBondContact O-N 2.77Å
100	L	95.7	Very high	92.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.9	-41.8	170.6	175.5	58.4	0	0	0	111.5	V75 M89 V91 L96 Q103 V104 L119 L131 V137 L149	V75-L100 HydrophobicContact CG1-CD2 4.22Å; M89-L100 HydrophobicContact CB-CD1 3.77Å; M89-L100 HydrophobicContact CE-CD1 4.32Å; M89-L100 HydrophobicContact CG-CD1 3.92Å; V91-L100 HydrophobicContact CG2-CD1 3.92Å; V91-L100 HydrophobicContact CG2-CD2 4.35Å; L96-L100 PolarHBondContact O-N 2.75Å; L100-Q103 PolarHBondContact O-N 2.87Å; L100-V104 HydrophobicContact CD1-CG2 4.3Å; L100-V104 WeakPolarHBondContact O-CG2 3.41Å; L100-V104 PolarHBondContact O-N 3.41Å; L100-L119 HydrophobicContact CG-CD1 4.27Å; L100-L131 HydrophobicContact CD2-CD2 4.35Å; L100-V137 HydrophobicContact CB-CG2 4.06Å; L100-V137 HydrophobicContact CD2-CG1 3.93Å; L100-V137 HydrophobicContact CD2-CG2 3.79Å; L100-L149 HydrophobicContact CD2-CD1 3.65Å
101	F	95.9	Very high	92.6	Very high	14 Å²	14	47.3 Å²	47.3	6%	0.061	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-46.8	176.8	-175.7	-118.9	0	0	0	112.9	G97 V99 Q103 V104 I105 K114 F117 L119 M133 F151	G97-F101 VanDerWaalsContact O-CB 3.29Å; G97-F101 WeakPolarHBondContact O-CB 3.45Å; G97-F101 PolarHBondContact O-N 3.47Å; V99-F101 VanDerWaalsContact C-N 3.26Å; V99-F101 PolarHBondContact O-N 3.48Å; F101-Q103 VanDerWaalsContact C-N 3.34Å; F101-Q103 PolarHBondContact O-N 2.99Å; F101-V104 PolarHBondContact O-N 2.89Å; F101-I105 HydrophobicContact CD1-CG1 4.47Å; F101-I105 HydrophobicContact CD2-CG1 4.45Å; F101-I105 HydrophobicContact CE1-CG1 4.19Å; F101-I105 HydrophobicContact CE2-CD1 4.14Å; F101-I105 HydrophobicContact CE2-CG1 4.17Å; F101-I105 HydrophobicContact CZ-CD1 3.98Å; F101-I105 HydrophobicContact CZ-CG1 4.04Å; F101-I105 VanDerWaalsContact O-CG1 3.32Å; F101-I105 WeakPolarHBondContact O-CG1 3.45Å; F101-I105 PolarHBondContact O-N 3.45Å; F101-K114 HydrophobicContact CE1-CB 4.34Å; F101-K114 HydrophobicContact CE1-CG 4.49Å; F101-K114 WeakPolarHBondContact CZ-O 3.47Å; F101-F117 HydrophobicContact CZ-CB 4.25Å; F101-F117 WeakPolarHBondContact CZ-O 3.49Å; F101-L119 HydrophobicContact CB-CD1 4.16Å; F101-L119 HydrophobicContact CD2-CD1 3.93Å; F101-L119 HydrophobicContact CD2-CG 3.95Å; F101-M133 HydrophobicContact CB-CE 3.86Å; F101-M133 HydrophobicContact CB-SD 3.75Å; F101-M133 HydrophobicContact CD1-CE 3.58Å; F101-M133 HydrophobicContact CD1-SD 4.16Å; F101-M133 HydrophobicContact CD2-CE 3.89Å; F101-M133 HydrophobicContact CE1-CE 4.02Å; F101-M133 HydrophobicContact CE2-CE 4.3Å; F101-M133 HydrophobicContact CG-CE 3.5Å; F101-M133 VanDerWaalsContact CG-CE 3.5Å; F101-M133 HydrophobicContact CG-SD 4.04Å; F101-M133 HydrophobicContact CZ-CE 4.35Å; F101-F151 HydrophobicContact CE2-CD2 4.47Å; F101-F151 HydrophobicContact CE2-CE2 4.04Å
102	N	94.8	Very high	92.5	Very high	48 Å²	48	49.6 Å²	49.6	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-58.8	-44.9	174.9	-76.7	-18.2	0	0	0	111.6	R98 V99 V104 I105 E106 K114	R98-N102 WeakPolarHBondContact O-CB 3.3Å; R98-N102 PolarHBondContact O-N 2.74Å; R98-N102 PolarHBondContact O-ND2 3.23Å; V99-N102 PolarHBondContact O-N 3.12Å; N102-V104 VanDerWaalsContact C-N 3.33Å; N102-V104 PolarHBondContact O-N 2.74Å; N102-I105 CarbonylContact O-C 3.59Å; N102-I105 PolarHBondContact O-N 3.39Å; N102-I105 VanDerWaalsContact O-N 3.14Å; N102-E106 WeakPolarHBondContact O-CB 3.16Å; N102-E106 VanDerWaalsContact O-CG 3.27Å; N102-E106 WeakPolarHBondContact O-CG 3.41Å; N102-E106 PolarHBondContact O-N 3.38Å; N102-K114 PolarHBondContact OD1-NZ 3.02Å
103	Q	94.3	Very high	92.4	Very high	63 Å²	63	46.9 Å²	46.9	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-39.9	176.8	-70.6	172.1	-27.2	0	0	112.4	M89 V99 L100 F101 E106 R107	M89-Q103 HydrophobicContact CE-CB 3.59Å; M89-Q103 HydrophobicContact CE-CG 4.49Å; V99-Q103 WeakPolarHBondContact O-CG 3.14Å; V99-Q103 PolarHBondContact O-N 2.77Å; L100-Q103 PolarHBondContact O-N 2.87Å; F101-Q103 VanDerWaalsContact C-N 3.34Å; F101-Q103 PolarHBondContact O-N 2.99Å; Q103-E106 PolarHBondContact O-N 2.8Å; Q103-R107 WeakPolarHBondContact O-CB 3.44Å; Q103-R107 WeakPolarHBondContact O-CG 3.03Å; Q103-R107 PolarHBondContact O-N 2.79Å
104	V	95.1	Very high	92.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-43.8	174.3	170.1	0	0	0	0	111	V77 M89 L100 F101 N102 E106 R107 L108 L119 F151	V77-V104 HydrophobicContact CB-CG2 4.35Å; V77-V104 HydrophobicContact CG1-CG1 4.18Å; V77-V104 HydrophobicContact CG1-CG2 4.04Å; V77-V104 HydrophobicContact CG2-CG2 3.97Å; M89-V104 HydrophobicContact CG-CG2 4.38Å; L100-V104 HydrophobicContact CD1-CG2 4.3Å; L100-V104 WeakPolarHBondContact O-CG2 3.41Å; L100-V104 PolarHBondContact O-N 3.41Å; F101-V104 PolarHBondContact O-N 2.89Å; N102-V104 VanDerWaalsContact C-N 3.33Å; N102-V104 PolarHBondContact O-N 2.74Å; V104-E106 VanDerWaalsContact C-N 3.33Å; V104-E106 PolarHBondContact O-N 2.81Å; V104-R107 PolarHBondContact O-N 2.79Å; V104-L108 HydrophobicContact CG1-CD1 4.11Å; V104-L108 WeakPolarHBondContact O-CB 3.17Å; V104-L108 WeakPolarHBondContact O-CG 3.44Å; V104-L108 PolarHBondContact O-N 2.96Å; V104-L119 HydrophobicContact CG1-CD2 4.5Å; V104-L119 HydrophobicContact CG2-CD1 4.44Å; V104-F151 HydrophobicContact CG1-CD2 3.98Å; V104-F151 HydrophobicContact CG1-CE2 4.47Å
105	I	94.5	Very high	92.7	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.036	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-39	175.9	-64.3	-69.4	0	0	0	111.5	F101 N102 G109 G110 I111 K114 F151	F101-I105 HydrophobicContact CD1-CG1 4.47Å; F101-I105 HydrophobicContact CD2-CG1 4.45Å; F101-I105 HydrophobicContact CE1-CG1 4.19Å; F101-I105 HydrophobicContact CE2-CD1 4.14Å; F101-I105 HydrophobicContact CE2-CG1 4.17Å; F101-I105 HydrophobicContact CZ-CD1 3.98Å; F101-I105 HydrophobicContact CZ-CG1 4.04Å; F101-I105 VanDerWaalsContact O-CG1 3.32Å; F101-I105 WeakPolarHBondContact O-CG1 3.45Å; F101-I105 PolarHBondContact O-N 3.45Å; N102-I105 CarbonylContact O-C 3.59Å; N102-I105 PolarHBondContact O-N 3.39Å; N102-I105 VanDerWaalsContact O-N 3.14Å; I105-G109 PolarHBondContact O-N 3.44Å; I105-G110 WeakPolarHBondContact O-CA 3.21Å; I105-G110 PolarHBondContact O-N 3Å; I105-I111 HydrophobicContact CD1-CB 4.39Å; I105-I111 HydrophobicContact CD1-CD1 3.88Å; I105-I111 HydrophobicContact CD1-CG1 4.44Å; I105-I111 HydrophobicContact CG2-CB 3.89Å; I105-I111 HydrophobicContact CG2-CG1 4.21Å; I105-K114 HydrophobicContact CD1-CB 3.73Å; I105-K114 HydrophobicContact CG1-CB 3.96Å; I105-K114 HydrophobicContact CG1-CD 4.34Å; I105-K114 HydrophobicContact CG2-CB 4.16Å; I105-K114 HydrophobicContact CG2-CD 4.18Å; I105-F151 HydrophobicContact CD1-CE2 3.76Å; I105-F151 HydrophobicContact CD1-CZ 4.01Å
106	E	92.5	Very high	92.8	Very high	112 Å²	112	42.4 Å²	42.4	52%	0.523	21%	0.212	S	C	.	.	H	α-helix	trans	-67.1	-43.4	175.6	-73.2	155.9	-155.3	0	0	111.6	N102 Q103 V104 G109	N102-E106 WeakPolarHBondContact O-CB 3.16Å; N102-E106 VanDerWaalsContact O-CG 3.27Å; N102-E106 WeakPolarHBondContact O-CG 3.41Å; N102-E106 PolarHBondContact O-N 3.38Å; Q103-E106 PolarHBondContact O-N 2.8Å; V104-E106 VanDerWaalsContact C-N 3.33Å; V104-E106 PolarHBondContact O-N 2.81Å; E106-G109 VanDerWaalsContact O-CA 3.27Å; E106-G109 WeakPolarHBondContact O-CA 3.46Å; E106-G109 PolarHBondContact O-N 3Å
107	R	90.4	Very high	92.8	Very high	151 Å²	151	40.1 Å²	40.1	57%	0.57	20%	0.2	S	C	*	.	H	α-helix	trans	-68.1	-30.9	176.2	-72.3	-67.6	-60.4	-78.1	2.4	113.4	L87 M89 Q103 V104 G109	L87-R107 HydrophobicContact CD1-CB 4.05Å; M89-R107 HydrophobicContact SD-CG 4.45Å; Q103-R107 WeakPolarHBondContact O-CB 3.44Å; Q103-R107 WeakPolarHBondContact O-CG 3.03Å; Q103-R107 PolarHBondContact O-N 2.79Å; V104-R107 PolarHBondContact O-N 2.79Å; R107-G109 PolarHBondContact O-N 3.35Å
108	L	90.1	Very high	92.9	Very high	33 Å²	33	40.1 Å²	40.1	17%	0.173	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-7.2	165.8	-73.7	169.4	0	0	0	112.4	L79 V104 I111 F151 K168	L79-L108 HydrophobicContact CD1-CD2 3.95Å; L79-L108 HydrophobicContact CD2-CD2 3.98Å; V104-L108 HydrophobicContact CG1-CD1 4.11Å; V104-L108 WeakPolarHBondContact O-CB 3.17Å; V104-L108 WeakPolarHBondContact O-CG 3.44Å; V104-L108 PolarHBondContact O-N 2.96Å; L108-I111 HydrophobicContact CD1-CD1 4.3Å; L108-F151 HydrophobicContact CD1-CD1 4.09Å; L108-F151 HydrophobicContact CD1-CD2 4.3Å; L108-F151 HydrophobicContact CD1-CE1 3.74Å; L108-F151 HydrophobicContact CD1-CE2 3.96Å; L108-F151 HydrophobicContact CD1-CG 4.35Å; L108-F151 HydrophobicContact CD1-CZ 3.67Å; L108-K168 WeakPolarHBondContact O-CE 3.46Å; L108-K168 PolarHBondContact O-NZ 3.02Å
109	G	85.6	Confident	93	Very high	51 Å²	51	33.3 Å²	33.3	53%	0.526	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.1	25.5	177.5	0	0	0	0	0	114.7	I105 E106 R107 K168	I105-G109 PolarHBondContact O-N 3.44Å; E106-G109 VanDerWaalsContact O-CA 3.27Å; E106-G109 WeakPolarHBondContact O-CA 3.46Å; E106-G109 PolarHBondContact O-N 3Å; R107-G109 PolarHBondContact O-N 3.35Å; G109-K168 PolarHBondContact O-NZ 3.37Å
110	G	87	Confident	93	Very high	18 Å²	18	32.9 Å²	32.9	19%	0.186	17%	0.168	C	C	.	.			trans	81.4	135.9	-179.6	0	0	0	0	0	114.2	I105 K168	I105-G110 WeakPolarHBondContact O-CA 3.21Å; I105-G110 PolarHBondContact O-N 3Å; G110-K168 WeakPolarHBondContact O-CE 3.34Å; G110-K168 PolarHBondContact O-NZ 2.97Å
111	I	90.1	Very high	92.9	Very high	13 Å²	13	33.9 Å²	33.9	7%	0.067	17%	0.172	C	C	.	.			trans	-142.5	126.7	174.6	-53.5	175.9	0	0	0	107.9	I105 L108 K114 F117 F151 K168 L172	I105-I111 HydrophobicContact CD1-CB 4.39Å; I105-I111 HydrophobicContact CD1-CD1 3.88Å; I105-I111 HydrophobicContact CD1-CG1 4.44Å; I105-I111 HydrophobicContact CG2-CB 3.89Å; I105-I111 HydrophobicContact CG2-CG1 4.21Å; L108-I111 HydrophobicContact CD1-CD1 4.3Å; I111-K114 HydrophobicContact CB-CB 4.4Å; I111-F117 HydrophobicContact CG2-CE2 4.25Å; I111-F151 HydrophobicContact CD1-CZ 4.33Å; I111-K168 HydrophobicContact CG1-CD 4.36Å; I111-L172 HydrophobicContact CD1-CD1 3.38Å; I111-L172 HydrophobicContact CG1-CD1 4.44Å
112	I	88.5	Confident	92.8	Very high	50 Å²	50	37.4 Å²	37.4	26%	0.256	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-46.6	-179.9	-63.2	169.5	0	0	0	109.9	K114 Q166 R384 L392 M396	I112-K114 PolarHBondContact O-N 3.25Å; I112-K114 VanDerWaalsContact O-N 3.08Å; I112-Q166 HydrophobicContact CB-CG 4.47Å; I112-Q166 HydrophobicContact CD1-CG 4.11Å; I112-R384 PolarHBondContact O-NH2 2.9Å; I112-L392 HydrophobicContact CG2-CD2 3.7Å; I112-M396 HydrophobicContact CD1-CE 3.86Å; I112-M396 HydrophobicContact CD1-SD 4.04Å; I112-M396 HydrophobicContact CG2-SD 4.06Å
113	E	92.3	Very high	92.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	29.1	178.4	-58.4	113.7	155.7	0	0	113.3	D115 Y116 F164 R165 Q166 S169 N393	E113-D115 PolarHBondContact O-N 3.1Å; E113-Y116 HydrophobicContact CB-CD2 3.92Å; E113-Y116 HydrophobicContact CB-CE2 4.2Å; E113-Y116 WeakPolarHBondContact O-CD2 3.41Å; E113-Y116 PolarHBondContact O-N 3.07Å; E113-Y116 VanDerWaalsContact O-N 3.14Å; E113-F164 HydrophobicContact CB-CD1 3.93Å; E113-F164 HydrophobicContact CB-CE1 3.91Å; E113-F164 HydrophobicContact CG-CD1 3.98Å; E113-F164 HydrophobicContact CG-CE1 4.43Å; E113-F164 WeakPolarHBondContact OE1-CA 3.43Å; E113-R165 PolarHBondContact OE1-N 3.38Å; E113-Q166 PolarHBondContact OE1-N 3.14Å; E113-Q166 WeakPolarHBondContact OE2-CB 3.46Å; E113-Q166 WeakPolarHBondContact OE2-CG 3.3Å; E113-S169 WeakPolarHBondContact OE2-CB 3.49Å; E113-S169 PolarHBondContact OE2-OG 2.7Å; E113-N393 WeakPolarHBondContact CG-ND2 3.15Å; E113-N393 PolarHBondContact OE1-ND2 3.29Å
114	K	93.5	Very high	92.3	Very high	58 Å²	58	42.3 Å²	42.3	25%	0.252	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-55.7	-25.7	-174.1	64.2	-179.6	179.2	-178.7	0	115	F101 N102 I105 I111 I112 Y116 F117	F101-K114 HydrophobicContact CE1-CB 4.34Å; F101-K114 HydrophobicContact CE1-CG 4.49Å; F101-K114 WeakPolarHBondContact CZ-O 3.47Å; N102-K114 PolarHBondContact OD1-NZ 3.02Å; I105-K114 HydrophobicContact CD1-CB 3.73Å; I105-K114 HydrophobicContact CG1-CB 3.96Å; I105-K114 HydrophobicContact CG1-CD 4.34Å; I105-K114 HydrophobicContact CG2-CB 4.16Å; I105-K114 HydrophobicContact CG2-CD 4.18Å; I111-K114 HydrophobicContact CB-CB 4.4Å; I112-K114 PolarHBondContact O-N 3.25Å; I112-K114 VanDerWaalsContact O-N 3.08Å; K114-Y116 PolarHBondContact O-N 2.83Å; K114-F117 PolarHBondContact O-N 3.41Å
115	D	93.9	Very high	91.9	Very high	25 Å²	25	44.9 Å²	44.9	13%	0.134	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-64.3	-20.7	-179.7	-63.7	-101.4	0	0	0	113.7	E113 F117 H155 G383 R384 L389	E113-D115 PolarHBondContact O-N 3.1Å; D115-F117 PolarHBondContact O-N 3.34Å; D115-H155 PolarHBondContact O-CD2 2.91Å; D115-G383 WeakPolarHBondContact OD1-CA 3.14Å; D115-R384 PolarHBondContact OD1-N 3.46Å; D115-R384 IonicContact OD1-NE 2.71Å; D115-R384 IonicContact OD2-CZ 3.88Å; D115-R384 IonicContact OD2-NE 3.14Å; D115-R384 PolarHBondContact OD2-NE 2.79Å; D115-R384 IonicContact OD2-NH2 2.99Å; D115-R384 PolarHBondContact OD2-NH2 3.19Å; D115-L389 HydrophobicContact CB-CD1 3.77Å; D115-L389 HydrophobicContact CB-CD2 4.13Å
116	Y	95.2	Very high	91.5	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.008	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-71.6	-17.7	171.4	-71	-99.4	0	0	0	112.8	E113 K114 K154 H155 P157 E163 F164 F354 L389	E113-Y116 HydrophobicContact CB-CD2 3.92Å; E113-Y116 HydrophobicContact CB-CE2 4.2Å; E113-Y116 WeakPolarHBondContact O-CD2 3.41Å; E113-Y116 PolarHBondContact O-N 3.07Å; E113-Y116 VanDerWaalsContact O-N 3.14Å; K114-Y116 PolarHBondContact O-N 2.83Å; Y116-K154 WeakPolarHBondContact O-CA 3.47Å; Y116-K154 WeakPolarHBondContact O-CB 3.41Å; Y116-K154 PolarHBondContact O-N 3.11Å; Y116-H155 HydrophobicContact CD1-CB 4.19Å; Y116-H155 PolarHBondContact O-N 2.87Å; Y116-P157 HydrophobicContact CE1-CB 3.99Å; Y116-E163 PolarHBondContact OH-OE2 3.45Å; Y116-F164 AromaticContact CD1-CE1 3.99Å; Y116-F164 HydrophobicContact CD1-CE1 3.99Å; Y116-F164 HydrophobicContact CD1-CZ 4.06Å; Y116-F164 AromaticContact CD2-CE1 3.61Å; Y116-F164 HydrophobicContact CD2-CE1 3.61Å; Y116-F164 HydrophobicContact CD2-CZ 4.36Å; Y116-F164 HydrophobicContact CE1-CE1 4.31Å; Y116-F164 AromaticContact CE2-CE1 3.91Å; Y116-F164 HydrophobicContact CE2-CE1 3.91Å; Y116-F164 AromaticContact CG-CE1 3.63Å; Y116-F164 HydrophobicContact CG-CE1 3.63Å; Y116-F164 AromaticContact CG-CZ 3.92Å; Y116-F164 HydrophobicContact CG-CZ 3.92Å; Y116-F354 HydrophobicContact CD1-CE1 4.16Å; Y116-F354 AromaticContact CD1-CZ 3.8Å; Y116-F354 HydrophobicContact CD1-CZ 3.8Å; Y116-F354 HydrophobicContact CD2-CZ 4.21Å; Y116-F354 AromaticContact CE1-CE1 3.86Å; Y116-F354 HydrophobicContact CE1-CE1 3.86Å; Y116-F354 AromaticContact CE1-CZ 3.66Å; Y116-F354 HydrophobicContact CE1-CZ 3.66Å; Y116-F354 HydrophobicContact CE2-CZ 4.14Å; Y116-F354 HydrophobicContact CG-CZ 4.08Å; Y116-F354 AromaticContact CZ-CZ 3.85Å; Y116-L389 HydrophobicContact CD2-CD1 4.02Å; Y116-L389 HydrophobicContact CE2-CB 4.33Å; Y116-L389 HydrophobicContact CE2-CD1 3.67Å; Y116-L389 HydrophobicContact CE2-CG 4.5Å
117	F	95.8	Very high	91.4	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.009	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	167.3	-176.4	-58.9	-90.7	0	0	0	112.1	F101 I111 K114 D115 F151 V153 L172	F101-F117 HydrophobicContact CZ-CB 4.25Å; F101-F117 WeakPolarHBondContact CZ-O 3.49Å; I111-F117 HydrophobicContact CG2-CE2 4.25Å; K114-F117 PolarHBondContact O-N 3.41Å; D115-F117 PolarHBondContact O-N 3.34Å; F117-F151 HydrophobicContact CB-CE1 4.5Å; F117-F151 HydrophobicContact CB-CE2 3.76Å; F117-F151 HydrophobicContact CB-CZ 3.61Å; F117-F151 AromaticContact CD1-CE1 3.71Å; F117-F151 HydrophobicContact CD1-CE1 3.71Å; F117-F151 HydrophobicContact CD1-CE2 4.47Å; F117-F151 AromaticContact CD1-CZ 3.55Å; F117-F151 HydrophobicContact CD1-CZ 3.55Å; F117-F151 HydrophobicContact CE1-CE1 4.27Å; F117-F151 HydrophobicContact CE1-CZ 4.37Å; F117-F151 HydrophobicContact CG-CE1 4.28Å; F117-F151 HydrophobicContact CG-CE2 4.31Å; F117-F151 AromaticContact CG-CZ 3.64Å; F117-F151 HydrophobicContact CG-CZ 3.64Å; F117-V153 HydrophobicContact CD1-CG2 4.01Å; F117-V153 HydrophobicContact CE1-CG2 3.79Å; F117-L172 HydrophobicContact CE1-CB 3.66Å; F117-L172 HydrophobicContact CE1-CD1 4.34Å; F117-L172 HydrophobicContact CZ-CB 3.85Å; F117-L172 HydrophobicContact CZ-CD1 4.26Å
118	G	95.7	Very high	91.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	173.5	175.6	0	0	0	0	0	113.7	R152	G118-R152 PolarHBondContact N-O 3.44Å; G118-R152 PolarHBondContact O-N 2.8Å
119	L	96.8	Very high	91.7	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.2	174.9	-67.7	165.9	0	0	0	109.7	V77 L100 F101 V104 L131 L149 N150 F151	V77-L119 HydrophobicContact CG1-CD2 3.55Å; L100-L119 HydrophobicContact CG-CD1 4.27Å; F101-L119 HydrophobicContact CB-CD1 4.16Å; F101-L119 HydrophobicContact CD2-CD1 3.93Å; F101-L119 HydrophobicContact CD2-CG 3.95Å; V104-L119 HydrophobicContact CG1-CD2 4.5Å; V104-L119 HydrophobicContact CG2-CD1 4.44Å; L119-L131 HydrophobicContact CB-CB 4.07Å; L119-L131 HydrophobicContact CB-CD2 4.14Å; L119-L131 HydrophobicContact CD1-CD2 3.93Å; L119-L131 WeakPolarHBondContact O-CB 3.25Å; L119-L131 PolarHBondContact O-N 3.48Å; L119-L149 HydrophobicContact CB-CB 4.48Å; L119-L149 HydrophobicContact CB-CD1 4.41Å; L119-L149 HydrophobicContact CB-CD2 4.13Å; L119-L149 HydrophobicContact CD1-CD1 4.32Å; L119-L149 HydrophobicContact CD2-CB 4.29Å; L119-N150 WeakPolarHBondContact CA-O 3.3Å; L119-F151 HydrophobicContact CD2-CB 4.22Å; L119-F151 HydrophobicContact CD2-CD2 4.3Å
120	R	94.9	Very high	92.1	Very high	41 Å²	41	43.3 Å²	43.3	16%	0.155	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.7	-173.9	-161.6	177.3	71.6	164.2	4.5	111.9	Q129 W130 L149 N150 E270	R120-Q129 CarbonylContact C-O 3.6Å; R120-Q129 WeakPolarHBondContact CA-O 3.39Å; R120-Q129 VanDerWaalsContact CG-O 3.25Å; R120-Q129 WeakPolarHBondContact CG-O 3.27Å; R120-W130 HydrophobicContact CB-CD2 4.33Å; R120-W130 HydrophobicContact CB-CE3 3.88Å; R120-W130 HydrophobicContact CB-CH2 4.46Å; R120-W130 HydrophobicContact CB-CZ3 3.96Å; R120-W130 HydrophobicContact CG-CD2 4.23Å; R120-W130 HydrophobicContact CG-CE3 4.28Å; R120-L149 CarbonylContact O-C 3.54Å; R120-N150 PolarHBondContact N-O 2.93Å; R120-N150 PolarHBondContact O-N 3.38Å; R120-N150 PolarHBondContact O-ND2 3.24Å; R120-N150 VanDerWaalsContact O-ND2 3.09Å; R120-E270 IonicContact CZ-OE1 2.67Å; R120-E270 IonicContact NH1-OE1 2.74Å; R120-E270 PolarHBondContact NH1-OE1 2.94Å; R120-E270 IonicContact NH1-OE2 2.62Å; R120-E270 PolarHBondContact NH1-OE2 2.77Å; R120-E270 IonicContact NH2-OE1 3.15Å
121	Y	95.1	Very high	92.5	Very high	22 Å²	22	42.8 Å²	42.8	9%	0.086	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	173.3	177.1	67.2	-76.9	0	0	0	111.9	D123 R128 Q129 L141 V144 L149	Y121-D123 HydrophobicContact CE2-CB 4.33Å; Y121-R128 WeakPolarHBondContact O-CA 3.42Å; Y121-Q129 HydrophobicContact CD1-CB 4.25Å; Y121-Q129 HydrophobicContact CE1-CB 3.8Å; Y121-Q129 HydrophobicContact CE2-CB 4.32Å; Y121-Q129 PolarHBondContact N-O 3.18Å; Y121-Q129 PolarHBondContact O-N 2.92Å; Y121-L141 HydrophobicContact CD1-CD2 4.19Å; Y121-L141 HydrophobicContact CD2-CD2 3.72Å; Y121-L141 HydrophobicContact CE2-CD2 4.08Å; Y121-L141 HydrophobicContact CG-CD2 3.77Å; Y121-V144 HydrophobicContact CD2-CG1 4.47Å; Y121-V144 HydrophobicContact CD2-CG2 3.8Å; Y121-V144 HydrophobicContact CE2-CG2 3.92Å; Y121-L149 HydrophobicContact CD1-CD2 4.04Å; Y121-L149 HydrophobicContact CG-CD2 4.3Å
122	L	92.9	Very high	92.7	Very high	87 Å²	87	43.8 Å²	43.8	46%	0.455	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.4	166.4	-63.2	173.7	0	0	0	108.2	R128 V144	L122-R128 HydrophobicContact CD2-CB 4.41Å; L122-R128 HydrophobicContact CD2-CG 3.57Å; L122-V144 WeakPolarHBondContact O-CG1 3.36Å
123	D	89.7	Confident	92.9	Very high	34 Å²	34	42.8 Å²	42.8	18%	0.182	19%	0.192	C	C	.	.			trans	-67.5	168.1	171.5	173.1	52.4	0	0	0	111	Y121 S125 K126 Q127 Q129	Y121-D123 HydrophobicContact CE2-CB 4.33Å; D123-S125 PolarHBondContact O-N 3.22Å; D123-S125 WeakPolarHBondContact OD2-CB 3.39Å; D123-S125 PolarHBondContact OD2-N 2.97Å; D123-S125 PolarHBondContact OD2-OG 3.29Å; D123-K126 VanDerWaalsContact O-CA 3.31Å; D123-K126 WeakPolarHBondContact O-CA 3.25Å; D123-K126 PolarHBondContact O-N 3.15Å; D123-Q127 PolarHBondContact N-O 3.28Å; D123-Q129 HydrophobicContact CB-CG 4.1Å
124	R	88.1	Confident	92.7	Very high	181 Å²	181	46.2 Å²	46.2	68%	0.683	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-26.8	173.3	73	-165.7	177.6	158.9	7.4	114	K126	R124-K126 PolarHBondContact O-N 3Å
125	S	86.5	Confident	92.7	Very high	54 Å²	54	47.8 Å²	47.8	38%	0.378	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	1.3	175.3	56.5	0	0	0	0	114.3	D123 Q127	D123-S125 PolarHBondContact O-N 3.22Å; D123-S125 WeakPolarHBondContact OD2-CB 3.39Å; D123-S125 PolarHBondContact OD2-N 2.97Å; D123-S125 PolarHBondContact OD2-OG 3.29Å; S125-Q127 PolarHBondContact O-N 3.36Å; S125-Q127 VanDerWaalsContact O-N 3.12Å; S125-Q127 VanDerWaalsContact OG-CB 3.27Å; S125-Q127 WeakPolarHBondContact OG-CB 3.49Å; S125-Q127 PolarHBondContact OG-N 3.41Å
126	K	87.5	Confident	92.7	Very high	153 Å²	153	47.2 Å²	47.2	67%	0.665	22%	0.22	S	C	*	.	S	Bend	trans	54	13	-162.8	-63.4	-166	177.6	-175	0	114.8	D123 R124	D123-K126 VanDerWaalsContact O-CA 3.31Å; D123-K126 WeakPolarHBondContact O-CA 3.25Å; D123-K126 PolarHBondContact O-N 3.15Å; R124-K126 PolarHBondContact O-N 3Å
127	Q	90.4	Very high	92.6	Very high	27 Å²	27	47.1 Å²	47.1	13%	0.126	22%	0.22	C	C	.	.			trans	-69.4	131.2	168.5	178.4	51.3	51.2	0	0	110	D123 S125 E339 A343	D123-Q127 PolarHBondContact N-O 3.28Å; S125-Q127 PolarHBondContact O-N 3.36Å; S125-Q127 VanDerWaalsContact O-N 3.12Å; S125-Q127 VanDerWaalsContact OG-CB 3.27Å; S125-Q127 WeakPolarHBondContact OG-CB 3.49Å; S125-Q127 PolarHBondContact OG-N 3.41Å; Q127-E339 HydrophobicContact CB-CB 4.28Å; Q127-E339 HydrophobicContact CG-CB 4.26Å; Q127-A343 HydrophobicContact CG-CB 4.15Å
128	R	92.8	Very high	92.5	Very high	97 Å²	97	50.4 Å²	50.4	37%	0.366	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	135.3	170.4	-65.9	172.8	-172.4	171.2	6.6	109.2	Y121 L122 E270 W347	Y121-R128 WeakPolarHBondContact O-CA 3.42Å; L122-R128 HydrophobicContact CD2-CB 4.41Å; L122-R128 HydrophobicContact CD2-CG 3.57Å; R128-E270 VanDerWaalsContact CD-OE1 3.23Å; R128-E270 WeakPolarHBondContact CD-OE1 3.39Å; R128-E270 IonicContact CZ-OE1 2.84Å; R128-E270 IonicContact NE-OE1 3.58Å; R128-E270 IonicContact NH1-OE1 3.97Å; R128-E270 PolarHBondContact NH1-OE1 2.81Å; R128-W347 HydrophobicContact CB-CH2 4.03Å; R128-W347 HydrophobicContact CB-CZ2 4.12Å; R128-W347 VanDerWaalsContact O-CZ2 3.3Å; R128-W347 WeakPolarHBondContact O-CZ2 3.19Å
129	Q	93.4	Very high	92.3	Very high	19 Å²	19	57.5 Å²	57.5	9%	0.089	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	145	176.4	-66.3	-65.6	-2.1	0	0	110.6	R120 Y121 D123	R120-Q129 CarbonylContact C-O 3.6Å; R120-Q129 WeakPolarHBondContact CA-O 3.39Å; R120-Q129 VanDerWaalsContact CG-O 3.25Å; R120-Q129 WeakPolarHBondContact CG-O 3.27Å; Y121-Q129 HydrophobicContact CD1-CB 4.25Å; Y121-Q129 HydrophobicContact CE1-CB 3.8Å; Y121-Q129 HydrophobicContact CE2-CB 4.32Å; Y121-Q129 PolarHBondContact N-O 3.18Å; Y121-Q129 PolarHBondContact O-N 2.92Å; D123-Q129 HydrophobicContact CB-CG 4.1Å
130	W	95	Very high	92.1	Very high	24 Å²	24	58.3 Å²	58.3	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	142.7	167.7	-65.8	98.5	0	0	0	109.7	R120 E132 R152 V153 K154 W347	R120-W130 HydrophobicContact CB-CD2 4.33Å; R120-W130 HydrophobicContact CB-CE3 3.88Å; R120-W130 HydrophobicContact CB-CH2 4.46Å; R120-W130 HydrophobicContact CB-CZ3 3.96Å; R120-W130 HydrophobicContact CG-CD2 4.23Å; R120-W130 HydrophobicContact CG-CE3 4.28Å; W130-E132 PolarHBondContact O-N 2.8Å; W130-R152 HydrophobicContact CH2-CB 3.83Å; W130-R152 HydrophobicContact CZ3-CB 4.11Å; W130-V153 WeakPolarHBondContact CH2-O 3.29Å; W130-K154 HydrophobicContact CD2-CD 4.39Å; W130-K154 HydrophobicContact CD2-CG 4.35Å; W130-K154 HydrophobicContact CE3-CB 4.4Å; W130-K154 HydrophobicContact CE3-CD 4.28Å; W130-K154 HydrophobicContact CE3-CG 4.39Å; W130-K154 HydrophobicContact CH2-CB 3.86Å; W130-K154 HydrophobicContact CH2-CG 4.41Å; W130-K154 HydrophobicContact CZ2-CB 4.23Å; W130-K154 HydrophobicContact CZ2-CG 4.38Å; W130-K154 HydrophobicContact CZ3-CB 3.96Å; W130-K154 HydrophobicContact CZ3-CG 4.42Å; W130-W347 AromaticContact CD1-CD1 3.64Å; W130-W347 AromaticContact CD1-CE2 3.85Å; W130-W347 AromaticContact CD1-NE1 3.44Å
131	L	95.3	Very high	92	Very high	7 Å²	7	56.4 Å²	56.4	4%	0.037	26%	0.26	C	S	.	.			trans	-65.6	115.7	174.5	-172	72.7	0	0	0	109.6	L100 L119 M133 Q140 L149	L100-L131 HydrophobicContact CD2-CD2 4.35Å; L119-L131 HydrophobicContact CB-CB 4.07Å; L119-L131 HydrophobicContact CB-CD2 4.14Å; L119-L131 HydrophobicContact CD1-CD2 3.93Å; L119-L131 WeakPolarHBondContact O-CB 3.25Å; L119-L131 PolarHBondContact O-N 3.48Å; L131-M133 PolarHBondContact O-N 2.87Å; L131-Q140 HydrophobicContact CD1-CB 4.27Å; L131-L149 HydrophobicContact CB-CD2 4.42Å; L131-L149 HydrophobicContact CD1-CD2 4.46Å; L131-L149 HydrophobicContact CD2-CD1 4.25Å
132	E	93.4	Very high	91.6	Very high	34 Å²	34	60.2 Å²	60.2	16%	0.159	28%	0.277	C	S	.	.			trans	-73.7	114.9	177.7	-61.9	-173.8	-141.7	0	0	109.6	W130 S134 K135 Q140 K346	W130-E132 PolarHBondContact O-N 2.8Å; E132-S134 PolarHBondContact O-N 3.41Å; E132-S134 VanDerWaalsContact O-N 3.13Å; E132-K135 HydrophobicContact CB-CB 4.43Å; E132-K135 HydrophobicContact CB-CD 4.1Å; E132-K135 HydrophobicContact CB-CG 4.4Å; E132-K135 PolarHBondContact O-N 2.85Å; E132-K135 VanDerWaalsContact O-N 3.15Å; E132-K135 IonicContact OE1-NZ 3.07Å; E132-K135 PolarHBondContact OE1-NZ 3.05Å; E132-K135 WeakPolarHBondContact OE2-CD 3.33Å; E132-K135 WeakPolarHBondContact OE2-CE 3.41Å; E132-K135 IonicContact OE2-NZ 2.71Å; E132-K135 PolarHBondContact OE2-NZ 3.09Å; E132-Q140 PolarHBondContact O-NE2 2.98Å; E132-Q140 VanDerWaalsContact O-NE2 3.13Å; E132-K346 IonicContact OE1-NZ 3.16Å; E132-K346 PolarHBondContact OE1-NZ 3.36Å; E132-K346 VanDerWaalsContact OE1-NZ 3.15Å
133	M	92.8	Very high	91.3	Very high	29 Å²	29	63.2 Å²	63.2	14%	0.143	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.2	-172	-60.7	-61.1	179	0	0	114.1	R98 F101 L131	R98-M133 HydrophobicContact CB-CB 4.16Å; R98-M133 PolarHBondContact N-O 3.18Å; R98-M133 VanDerWaalsContact N-O 3.09Å; F101-M133 HydrophobicContact CB-CE 3.86Å; F101-M133 HydrophobicContact CB-SD 3.75Å; F101-M133 HydrophobicContact CD1-CE 3.58Å; F101-M133 HydrophobicContact CD1-SD 4.16Å; F101-M133 HydrophobicContact CD2-CE 3.89Å; F101-M133 HydrophobicContact CE1-CE 4.02Å; F101-M133 HydrophobicContact CE2-CE 4.3Å; F101-M133 HydrophobicContact CG-CE 3.5Å; F101-M133 VanDerWaalsContact CG-CE 3.5Å; F101-M133 HydrophobicContact CG-SD 4.04Å; F101-M133 HydrophobicContact CZ-CE 4.35Å; L131-M133 PolarHBondContact O-N 2.87Å
134	S	88.8	Confident	91.1	Very high	72 Å²	72	62.2 Å²	62.2	50%	0.503	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-11.2	-178.8	55.7	0	0	0	0	114.6	E132	E132-S134 PolarHBondContact O-N 3.41Å; E132-S134 VanDerWaalsContact O-N 3.13Å
135	K	92.2	Very high	90.9	Very high	92 Å²	92	59.3 Å²	59.3	40%	0.4	29%	0.286	S	S	.	.	S	Bend	trans	-104.9	158.3	179.5	-70.2	174.5	-178.9	163	0	110.7	G97 E132 Q140	G97-K135 PolarHBondContact N-O 3.22Å; E132-K135 HydrophobicContact CB-CB 4.43Å; E132-K135 HydrophobicContact CB-CD 4.1Å; E132-K135 HydrophobicContact CB-CG 4.4Å; E132-K135 PolarHBondContact O-N 2.85Å; E132-K135 VanDerWaalsContact O-N 3.15Å; E132-K135 IonicContact OE1-NZ 3.07Å; E132-K135 PolarHBondContact OE1-NZ 3.05Å; E132-K135 WeakPolarHBondContact OE2-CD 3.33Å; E132-K135 WeakPolarHBondContact OE2-CE 3.41Å; E132-K135 IonicContact OE2-NZ 2.71Å; E132-K135 PolarHBondContact OE2-NZ 3.09Å; K135-Q140 HydrophobicContact CB-CG 4.2Å; K135-Q140 PolarHBondContact O-NE2 2.78Å
136	T	94.1	Very high	90.8	Very high	12 Å²	12	61 Å²	61	7%	0.074	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-70.8	148.7	173.1	75.1	0	0	0	0	110.8	D94 C95 L96 K139 Q140	D94-T136 WeakPolarHBondContact O-CG2 3.3Å; C95-T136 CarbonylContact O-C 3.53Å; C95-T136 WeakPolarHBondContact O-CA 3.3Å; C95-T136 WeakPolarHBondContact O-CB 3.44Å; L96-T136 HydrophobicContact CD2-CG2 4.03Å; T136-K139 PolarHBondContact O-N 3.27Å; T136-K139 WeakPolarHBondContact OG1-CD 3.28Å; T136-K139 WeakPolarHBondContact OG1-CG 3.46Å; T136-K139 PolarHBondContact OG1-N 3.11Å; T136-Q140 PolarHBondContact O-NE2 3.48Å; T136-Q140 VanDerWaalsContact O-NE2 3.15Å
137	V	94.1	Very high	90.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-43.7	179.5	-179	0	0	0	0	109.9	F73 V75 V91 C95 L100 K139 Q140 L141	F73-V137 HydrophobicContact CE2-CG1 4.22Å; F73-V137 HydrophobicContact CZ-CB 4.13Å; F73-V137 HydrophobicContact CZ-CG1 3.91Å; V75-V137 HydrophobicContact CG2-CG1 4.33Å; V91-V137 HydrophobicContact CG1-CB 4.07Å; V91-V137 HydrophobicContact CG1-CG1 4.33Å; V91-V137 HydrophobicContact CG1-CG2 4.25Å; C95-V137 PolarHBondContact O-N 3.02Å; L100-V137 HydrophobicContact CB-CG2 4.06Å; L100-V137 HydrophobicContact CD2-CG1 3.93Å; L100-V137 HydrophobicContact CD2-CG2 3.79Å; V137-K139 VanDerWaalsContact C-N 3.34Å; V137-K139 PolarHBondContact O-N 2.88Å; V137-Q140 PolarHBondContact O-N 2.95Å; V137-L141 HydrophobicContact CG1-CD1 3.67Å; V137-L141 HydrophobicContact CG1-CG 4.11Å; V137-L141 PolarHBondContact O-N 2.82Å
138	Y	92.2	Very high	91	Very high	71 Å²	71	56.8 Å²	56.8	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-53.7	-46.4	176.5	-178.2	-90.9	0	0	0	112.6	F73 N93 Q140 L141 K142	F73-Y138 HydrophobicContact CD1-CD2 4.36Å; F73-Y138 HydrophobicContact CE1-CD2 4.17Å; N93-Y138 HydrophobicContact CB-CD2 4.38Å; N93-Y138 HydrophobicContact CB-CG 4.46Å; N93-Y138 VanDerWaalsContact O-CB 3.25Å; N93-Y138 WeakPolarHBondContact O-CB 3.24Å; N93-Y138 WeakPolarHBondContact OD1-CD2 3.36Å; Y138-Q140 PolarHBondContact O-N 3.27Å; Y138-L141 PolarHBondContact O-N 2.7Å; Y138-K142 HydrophobicContact CE1-CD 4.34Å; Y138-K142 WeakPolarHBondContact O-CA 3.35Å; Y138-K142 WeakPolarHBondContact O-CB 3.43Å; Y138-K142 PolarHBondContact O-N 3.05Å
139	K	91.6	Very high	91.1	Very high	150 Å²	150	52.2 Å²	52.2	65%	0.652	26%	0.261	S	S	*	.	H	α-helix	trans	-66.4	-18	-179.7	-74.5	168.8	-175.3	151.3	0	113.6	T136 V137	T136-K139 PolarHBondContact O-N 3.27Å; T136-K139 WeakPolarHBondContact OG1-CD 3.28Å; T136-K139 WeakPolarHBondContact OG1-CG 3.46Å; T136-K139 PolarHBondContact OG1-N 3.11Å; V137-K139 VanDerWaalsContact C-N 3.34Å; V137-K139 PolarHBondContact O-N 2.88Å
140	Q	92.7	Very high	91.2	Very high	18 Å²	18	53.1 Å²	53.1	8%	0.084	27%	0.267	C	S	.	.	H	α-helix	trans	-97.8	-36.3	179.7	-66.6	178.3	89.8	0	0	112.2	L131 E132 K135 T136 V137 Y138	L131-Q140 HydrophobicContact CD1-CB 4.27Å; E132-Q140 PolarHBondContact O-NE2 2.98Å; E132-Q140 VanDerWaalsContact O-NE2 3.13Å; K135-Q140 HydrophobicContact CB-CG 4.2Å; K135-Q140 PolarHBondContact O-NE2 2.78Å; T136-Q140 PolarHBondContact O-NE2 3.48Å; T136-Q140 VanDerWaalsContact O-NE2 3.15Å; V137-Q140 PolarHBondContact O-N 2.95Å; Y138-Q140 PolarHBondContact O-N 3.27Å
141	L	92.5	Very high	91.3	Very high	1 Å²	1	52 Å²	52	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-97.7	2.6	-179.2	-57.9	-173.9	0	0	0	114.4	V75 Y121 V137 Y138 Y143 V144 R147 L149	V75-L141 HydrophobicContact CG1-CD1 4.11Å; V75-L141 HydrophobicContact CG2-CD1 4.32Å; Y121-L141 HydrophobicContact CD1-CD2 4.19Å; Y121-L141 HydrophobicContact CD2-CD2 3.72Å; Y121-L141 HydrophobicContact CE2-CD2 4.08Å; Y121-L141 HydrophobicContact CG-CD2 3.77Å; V137-L141 HydrophobicContact CG1-CD1 3.67Å; V137-L141 HydrophobicContact CG1-CG 4.11Å; V137-L141 PolarHBondContact O-N 2.82Å; Y138-L141 PolarHBondContact O-N 2.7Å; L141-Y143 PolarHBondContact O-N 2.55Å; L141-V144 HydrophobicContact CB-CB 4.36Å; L141-V144 HydrophobicContact CD2-CB 4.16Å; L141-V144 HydrophobicContact CD2-CG1 4.3Å; L141-V144 HydrophobicContact CD2-CG2 4.09Å; L141-V144 PolarHBondContact O-N 3.45Å; L141-R147 HydrophobicContact CD1-CB 4.5Å; L141-L149 HydrophobicContact CD1-CD1 4.35Å; L141-L149 HydrophobicContact CD1-CG 4.39Å
142	K	87.4	Confident	91.3	Very high	102 Å²	102	52.3 Å²	52.3	44%	0.443	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-35.4	-177.7	-176.8	171.9	-178.9	-179.2	0	114.2	Y138	Y138-K142 HydrophobicContact CE1-CD 4.34Å; Y138-K142 WeakPolarHBondContact O-CA 3.35Å; Y138-K142 WeakPolarHBondContact O-CB 3.43Å; Y138-K142 PolarHBondContact O-N 3.05Å
143	Y	85.8	Confident	91.4	Very high	150 Å²	150	50.8 Å²	50.8	59%	0.588	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	20.4	-177.8	-56.4	-72.6	0	0	0	112.9	L141	L141-Y143 PolarHBondContact O-N 2.55Å
144	V	86.8	Confident	91.5	Very high	14 Å²	14	50.4 Å²	50.4	9%	0.085	25%	0.253	C	S	.	.			trans	-112.6	115	-177.2	-177.2	0	0	0	0	108.6	Y121 L122 L141 R147	Y121-V144 HydrophobicContact CD2-CG1 4.47Å; Y121-V144 HydrophobicContact CD2-CG2 3.8Å; Y121-V144 HydrophobicContact CE2-CG2 3.92Å; L122-V144 WeakPolarHBondContact O-CG1 3.36Å; L141-V144 HydrophobicContact CB-CB 4.36Å; L141-V144 HydrophobicContact CD2-CB 4.16Å; L141-V144 HydrophobicContact CD2-CG1 4.3Å; L141-V144 HydrophobicContact CD2-CG2 4.09Å; L141-V144 PolarHBondContact O-N 3.45Å; V144-R147 VanDerWaalsContact O-CG 3.28Å; V144-R147 WeakPolarHBondContact O-CG 3.49Å
145	S	84	Confident	91.8	Very high	120 Å²	120	47 Å²	47	84%	0.839	23%	0.23	S	C	*	.	S	Bend	trans	-134.8	127.8	177	-169.7	0	0	0	0	109.9
146	P	84.8	Confident	92	Very high	88 Å²	88	43.3 Å²	43.3	57%	0.571	21%	0.213	S	C	*	.	S	Bend	cis	-63.9	152.9	-8.1	29.2	-35.9	0	0	0	112.1	S148	P146-S148 PolarHBondContact O-N 2.56Å; P146-S148 PolarHBondContact O-OG 3.34Å
147	R	89.3	Confident	92	Very high	67 Å²	67	42.7 Å²	42.7	25%	0.253	21%	0.21	S	C	.	.			trans	-72.6	67	179	-68.2	179.5	-179.6	148.3	3	111.2	D67 E76 L141 V144	D67-R147 IonicContact OD2-CZ 3.71Å; D67-R147 IonicContact OD2-NH1 2.79Å; D67-R147 PolarHBondContact OD2-NH1 2.75Å; D67-R147 IonicContact OD2-NH2 3.31Å; D67-R147 PolarHBondContact OD2-NH2 3.04Å; E76-R147 PolarHBondContact N-O 3.11Å; L141-R147 HydrophobicContact CD1-CB 4.5Å; V144-R147 VanDerWaalsContact O-CG 3.28Å; V144-R147 WeakPolarHBondContact O-CG 3.49Å
148	S	92	Very high	92	Very high	26 Å²	26	45.4 Å²	45.4	18%	0.182	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.2	-172.7	59.2	0	0	0	0	112.4	E76 P146	E76-S148 CarbonylContact O-C 3.25Å; E76-S148 WeakPolarHBondContact O-CA 3.28Å; E76-S148 WeakPolarHBondContact OE2-CB 3.32Å; P146-S148 PolarHBondContact O-N 2.56Å; P146-S148 PolarHBondContact O-OG 3.34Å
149	L	95.3	Very high	92	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	155.6	173.4	-72.6	163.9	0	0	0	109.3	V75 E76 V77 K78 L100 L119 R120 Y121 L131 L141	V75-L149 HydrophobicContact CG1-CD1 3.65Å; V75-L149 HydrophobicContact CG1-CG 4.24Å; E76-L149 PolarHBondContact O-N 3Å; V77-L149 WeakPolarHBondContact CA-O 2.95Å; V77-L149 HydrophobicContact CG2-CB 4.32Å; K78-L149 PolarHBondContact N-O 3.3Å; L100-L149 HydrophobicContact CD2-CD1 3.65Å; L119-L149 HydrophobicContact CB-CB 4.48Å; L119-L149 HydrophobicContact CB-CD1 4.41Å; L119-L149 HydrophobicContact CB-CD2 4.13Å; L119-L149 HydrophobicContact CD1-CD1 4.32Å; L119-L149 HydrophobicContact CD2-CB 4.29Å; R120-L149 CarbonylContact O-C 3.54Å; Y121-L149 HydrophobicContact CD1-CD2 4.04Å; Y121-L149 HydrophobicContact CG-CD2 4.3Å; L131-L149 HydrophobicContact CB-CD2 4.42Å; L131-L149 HydrophobicContact CD1-CD2 4.46Å; L131-L149 HydrophobicContact CD2-CD1 4.25Å; L141-L149 HydrophobicContact CD1-CD1 4.35Å; L141-L149 HydrophobicContact CD1-CG 4.39Å
150	N	95.1	Very high	92.1	Very high	39 Å²	39	37.7 Å²	37.7	21%	0.209	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.5	176.9	-60.1	-106.1	0	0	0	107.9	K78 L119 R120 R152	K78-N150 WeakPolarHBondContact O-CA 3.5Å; L119-N150 WeakPolarHBondContact CA-O 3.3Å; R120-N150 PolarHBondContact N-O 2.93Å; R120-N150 PolarHBondContact O-N 3.38Å; R120-N150 PolarHBondContact O-ND2 3.24Å; R120-N150 VanDerWaalsContact O-ND2 3.09Å; N150-R152 HydrophobicContact CB-CG 4.05Å; N150-R152 PolarHBondContact O-N 3.09Å
151	F	96.3	Very high	92.1	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	117.8	170.8	-177.6	-101.9	0	0	0	109	V77 K78 L79 L80 F101 V104 I105 L108 I111 F117 L119 L172	V77-F151 HydrophobicContact CG1-CB 4.4Å; K78-F151 PolarHBondContact O-N 3.5Å; L79-F151 HydrophobicContact CD2-CB 4.29Å; L80-F151 HydrophobicContact CD1-CD1 3.73Å; L80-F151 HydrophobicContact CD1-CE1 3.79Å; L80-F151 HydrophobicContact CG-CD1 4.04Å; L80-F151 WeakPolarHBondContact CG-O 3.28Å; F101-F151 HydrophobicContact CE2-CD2 4.47Å; F101-F151 HydrophobicContact CE2-CE2 4.04Å; V104-F151 HydrophobicContact CG1-CD2 3.98Å; V104-F151 HydrophobicContact CG1-CE2 4.47Å; I105-F151 HydrophobicContact CD1-CE2 3.76Å; I105-F151 HydrophobicContact CD1-CZ 4.01Å; L108-F151 HydrophobicContact CD1-CD1 4.09Å; L108-F151 HydrophobicContact CD1-CD2 4.3Å; L108-F151 HydrophobicContact CD1-CE1 3.74Å; L108-F151 HydrophobicContact CD1-CE2 3.96Å; L108-F151 HydrophobicContact CD1-CG 4.35Å; L108-F151 HydrophobicContact CD1-CZ 3.67Å; I111-F151 HydrophobicContact CD1-CZ 4.33Å; F117-F151 HydrophobicContact CB-CE1 4.5Å; F117-F151 HydrophobicContact CB-CE2 3.76Å; F117-F151 HydrophobicContact CB-CZ 3.61Å; F117-F151 AromaticContact CD1-CE1 3.71Å; F117-F151 HydrophobicContact CD1-CE1 3.71Å; F117-F151 HydrophobicContact CD1-CE2 4.47Å; F117-F151 AromaticContact CD1-CZ 3.55Å; F117-F151 HydrophobicContact CD1-CZ 3.55Å; F117-F151 HydrophobicContact CE1-CE1 4.27Å; F117-F151 HydrophobicContact CE1-CZ 4.37Å; F117-F151 HydrophobicContact CG-CE1 4.28Å; F117-F151 HydrophobicContact CG-CE2 4.31Å; F117-F151 AromaticContact CG-CZ 3.64Å; F117-F151 HydrophobicContact CG-CZ 3.64Å; L119-F151 HydrophobicContact CD2-CB 4.22Å; L119-F151 HydrophobicContact CD2-CD2 4.3Å; F151-L172 HydrophobicContact CE1-CD1 4.42Å; F151-L172 HydrophobicContact CE1-CD2 4.49Å
152	R	95.8	Very high	92	Very high	12 Å²	12	44.7 Å²	44.7	5%	0.045	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	156.5	-172.6	-65.4	-66.9	177.2	-95.1	7.4	110.9	L79 G118 W130 N150 K154 Q176 R179	L79-R152 PolarHBondContact O-NH1 2.84Å; G118-R152 PolarHBondContact N-O 3.44Å; G118-R152 PolarHBondContact O-N 2.8Å; W130-R152 HydrophobicContact CH2-CB 3.83Å; W130-R152 HydrophobicContact CZ3-CB 4.11Å; N150-R152 HydrophobicContact CB-CG 4.05Å; N150-R152 PolarHBondContact O-N 3.09Å; R152-K154 PolarHBondContact O-N 2.88Å; R152-Q176 VanDerWaalsContact CD-OE1 3.24Å; R152-R179 VanDerWaalsContact NH2-CZ 3.27Å
153	V	95.9	Very high	92.1	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	127.4	171	-179.2	0	0	0	0	109	F117 W130 H155 Y156 L173 Q176	F117-V153 HydrophobicContact CD1-CG2 4.01Å; F117-V153 HydrophobicContact CE1-CG2 3.79Å; W130-V153 WeakPolarHBondContact CH2-O 3.29Å; V153-H155 WeakPolarHBondContact CG1-O 3.5Å; V153-Y156 HydrophobicContact CB-CE1 4.14Å; V153-Y156 HydrophobicContact CB-CE2 4.03Å; V153-Y156 HydrophobicContact CG1-CD1 4.05Å; V153-Y156 HydrophobicContact CG1-CD2 3.84Å; V153-Y156 HydrophobicContact CG1-CE1 4Å; V153-Y156 HydrophobicContact CG1-CE2 3.75Å; V153-Y156 HydrophobicContact CG1-CG 3.96Å; V153-L173 HydrophobicContact CG1-CD1 4.2Å; V153-L173 HydrophobicContact CG2-CD1 3.99Å; V153-Q176 HydrophobicContact CB-CG 3.93Å; V153-Q176 HydrophobicContact CG2-CB 3.74Å; V153-Q176 HydrophobicContact CG2-CG 3.71Å
154	K	94.9	Very high	92.4	Very high	20 Å²	20	33.2 Å²	33.2	9%	0.087	19%	0.192	C	C	.	.	S	Bend	trans	-100.2	-47	-175.4	177.1	172.2	169.9	-79.6	0	110.7	Y116 W130 R152 D350 R351	Y116-K154 WeakPolarHBondContact O-CA 3.47Å; Y116-K154 WeakPolarHBondContact O-CB 3.41Å; Y116-K154 PolarHBondContact O-N 3.11Å; W130-K154 HydrophobicContact CD2-CD 4.39Å; W130-K154 HydrophobicContact CD2-CG 4.35Å; W130-K154 HydrophobicContact CE3-CB 4.4Å; W130-K154 HydrophobicContact CE3-CD 4.28Å; W130-K154 HydrophobicContact CE3-CG 4.39Å; W130-K154 HydrophobicContact CH2-CB 3.86Å; W130-K154 HydrophobicContact CH2-CG 4.41Å; W130-K154 HydrophobicContact CZ2-CB 4.23Å; W130-K154 HydrophobicContact CZ2-CG 4.38Å; W130-K154 HydrophobicContact CZ3-CB 3.96Å; W130-K154 HydrophobicContact CZ3-CG 4.42Å; R152-K154 PolarHBondContact O-N 2.88Å; K154-D350 WeakPolarHBondContact CE-OD2 3.28Å; K154-D350 IonicContact NZ-OD1 3.79Å; K154-D350 PolarHBondContact NZ-OD1 3.18Å; K154-D350 IonicContact NZ-OD2 2.73Å; K154-D350 PolarHBondContact NZ-OD2 2.93Å; K154-R351 PolarHBondContact O-NH2 3.42Å
155	H	95.3	Very high	92.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.208	C	C	.	.	S	Bend	trans	-114.2	131.3	171.1	-53.8	-72.7	0	0	0	108.7	D115 Y116 V153 D350 F354 F355	D115-H155 PolarHBondContact O-CD2 2.91Å; Y116-H155 HydrophobicContact CD1-CB 4.19Å; Y116-H155 PolarHBondContact O-N 2.87Å; V153-H155 WeakPolarHBondContact CG1-O 3.5Å; H155-D350 IonicContact CE1-OD2 2.66Å; H155-D350 PolarHBondContact CE1-OD2 3.29Å; H155-D350 IonicContact NE2-OD2 3.78Å; H155-F354 HydrophobicContact CB-CD1 3.78Å; H155-F354 HydrophobicContact CB-CE1 3.59Å; H155-F354 HydrophobicContact CB-CE2 4.41Å; H155-F354 HydrophobicContact CB-CG 4.28Å; H155-F354 HydrophobicContact CB-CZ 3.93Å; H155-F354 AromaticContact CD2-CD2 3.44Å; H155-F354 VanDerWaalsContact CD2-CD2 3.44Å; H155-F354 WeakPolarHBondContact CD2-CD2 3.42Å; H155-F354 AromaticContact CD2-CE2 3.64Å; H155-F354 AromaticContact CD2-CG 3.67Å; H155-F354 VanDerWaalsContact CE1-CB 3.46Å; H155-F354 WeakPolarHBondContact CE1-CB 3.37Å; H155-F354 AromaticContact CE1-CG 3.68Å; H155-F354 AromaticContact CG-CD1 3.62Å; H155-F354 AromaticContact CG-CD2 3.86Å; H155-F354 AromaticContact CG-CE1 3.86Å; H155-F354 AromaticContact CG-CG 3.62Å; H155-F354 AromaticContact ND1-CD1 3.78Å; H155-F354 AromaticContact ND1-CG 3.63Å; H155-F354 AromaticContact NE2-CD2 3.58Å; H155-F354 AromaticContact NE2-CG 3.73Å; H155-F355 HydrophobicContact CB-CZ 4.17Å
156	Y	96	Very high	92.7	Very high	14 Å²	14	33.1 Å²	33.1	6%	0.055	17%	0.172	C	C	.	.			trans	-100.3	124.8	177.1	-68	-109.5	0	0	0	107.2	V153 L173 Q176 L177 Y267 F355	V153-Y156 HydrophobicContact CB-CE1 4.14Å; V153-Y156 HydrophobicContact CB-CE2 4.03Å; V153-Y156 HydrophobicContact CG1-CD1 4.05Å; V153-Y156 HydrophobicContact CG1-CD2 3.84Å; V153-Y156 HydrophobicContact CG1-CE1 4Å; V153-Y156 HydrophobicContact CG1-CE2 3.75Å; V153-Y156 HydrophobicContact CG1-CG 3.96Å; Y156-L173 HydrophobicContact CD1-CD1 3.78Å; Y156-L173 HydrophobicContact CE1-CD1 3.97Å; Y156-Q176 HydrophobicContact CE1-CG 4Å; Y156-Q176 VanDerWaalsContact OH-CG 3.28Å; Y156-Q176 WeakPolarHBondContact OH-CG 3.42Å; Y156-L177 HydrophobicContact CD1-CD2 4.35Å; Y156-L177 HydrophobicContact CE1-CD2 4.06Å; Y156-Y267 HydrophobicContact CD1-CE2 4.35Å; Y156-F355 WeakPolarHBondContact O-CZ 3.35Å
157	P	94.6	Very high	93	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.			trans	-62.6	154.5	177.4	27.7	-35.2	0	0	0	110.7	Y116 P160 E163 F164 L173 Y267	Y116-P157 HydrophobicContact CE1-CB 3.99Å; P157-P160 HydrophobicContact CG-CB 3.91Å; P157-E163 HydrophobicContact CB-CB 3.96Å; P157-E163 VanDerWaalsContact CB-CD 3.41Å; P157-E163 HydrophobicContact CB-CG 4.22Å; P157-E163 VanDerWaalsContact CB-OE2 3.31Å; P157-E163 WeakPolarHBondContact CB-OE2 2.96Å; P157-F164 HydrophobicContact CG-CD2 4.33Å; P157-F164 HydrophobicContact CG-CE2 3.89Å; P157-F164 HydrophobicContact CG-CZ 4.16Å; P157-L173 HydrophobicContact CG-CD2 4.03Å; P157-Y267 WeakPolarHBondContact O-CE1 3.36Å; P157-Y267 PolarHBondContact O-OH 2.86Å
158	S	93.5	Very high	93.1	Very high	56 Å²	56	32.2 Å²	32.2	39%	0.392	16%	0.163	S	C	.	.	S	Bend	trans	-68.2	-43	170.6	19.6	0	0	0	0	111.4	E163 Q386	S158-E163 WeakPolarHBondContact CA-OE1 3.43Å; S158-E163 WeakPolarHBondContact CB-OE1 3.39Å; S158-E163 PolarHBondContact N-OE1 3.42Å; S158-E163 PolarHBondContact OG-OE1 3.38Å; S158-Q386 PolarHBondContact OG-NE2 2.92Å
159	D	93.6	Very high	93.2	Very high	58 Å²	58	31 Å²	31	31%	0.31	15%	0.154	S	C	.	.	S	Bend	trans	-123.5	101.2	174.6	-176.8	-30.8	0	0	0	109.2	V161 N162 E163	D159-V161 VanDerWaalsContact C-N 3.29Å; D159-V161 PolarHBondContact O-N 3.49Å; D159-V161 PolarHBondContact OD1-N 3.31Å; D159-V161 VanDerWaalsContact OD1-N 3.09Å; D159-N162 HydrophobicContact CB-CB 4.45Å; D159-N162 PolarHBondContact OD1-N 3.19Å; D159-N162 PolarHBondContact OD1-ND2 2.96Å; D159-N162 PolarHBondContact OD2-ND2 3.37Å; D159-E163 PolarHBondContact N-OE1 3.3Å; D159-E163 WeakPolarHBondContact O-CB 3.31Å; D159-E163 VanDerWaalsContact O-CG 3.27Å; D159-E163 WeakPolarHBondContact O-CG 3.47Å; D159-E163 PolarHBondContact O-N 2.86Å
160	P	93.4	Very high	93.2	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.013	16%	0.16	C	C	.	.	H	α-helix	trans	-71.1	-19.7	-173.9	29	-36.2	0	0	0	114.5	P157 F164 L173 L258 A262	P157-P160 HydrophobicContact CG-CB 3.91Å; P160-F164 WeakPolarHBondContact O-CB 3.45Å; P160-L173 HydrophobicContact CB-CD2 3.48Å; P160-L173 VanDerWaalsContact CB-CD2 3.48Å; P160-L258 HydrophobicContact CB-CB 4.21Å; P160-L258 HydrophobicContact CG-CB 3.83Å; P160-A262 HydrophobicContact CG-CB 4Å
161	V	92.1	Very high	93.1	Very high	32 Å²	32	33.7 Å²	33.7	19%	0.194	16%	0.162	C	C	.	.	H	α-helix	trans	-89.1	-40.3	-178.5	176.7	0	0	0	0	110.6	D159 N255 L258 E259	D159-V161 VanDerWaalsContact C-N 3.29Å; D159-V161 PolarHBondContact O-N 3.49Å; D159-V161 PolarHBondContact OD1-N 3.31Å; D159-V161 VanDerWaalsContact OD1-N 3.09Å; V161-N255 HydrophobicContact CG2-CB 4.1Å; V161-L258 HydrophobicContact CG2-CB 4.41Å; V161-E259 HydrophobicContact CG2-CG 3.79Å
162	N	90.1	Very high	93.1	Very high	133 Å²	133	34.2 Å²	34.2	71%	0.711	16%	0.164	S	C	*	.	H	α-helix	trans	-85.1	-29.3	179.3	-68	-59.2	0	0	0	113.9	D159	D159-N162 HydrophobicContact CB-CB 4.45Å; D159-N162 PolarHBondContact OD1-N 3.19Å; D159-N162 PolarHBondContact OD1-ND2 2.96Å; D159-N162 PolarHBondContact OD2-ND2 3.37Å
163	E	90.2	Very high	93.1	Very high	11 Å²	11	33.7 Å²	33.7	5%	0.051	16%	0.162	C	C	.	.	H	α-helix	trans	-77.4	-35.7	176.7	-67.4	179.6	-129.2	0	0	112.9	Y116 P157 S158 D159 Q386 M390 N393	Y116-E163 PolarHBondContact OH-OE2 3.45Å; P157-E163 HydrophobicContact CB-CB 3.96Å; P157-E163 VanDerWaalsContact CB-CD 3.41Å; P157-E163 HydrophobicContact CB-CG 4.22Å; P157-E163 VanDerWaalsContact CB-OE2 3.31Å; P157-E163 WeakPolarHBondContact CB-OE2 2.96Å; S158-E163 WeakPolarHBondContact CA-OE1 3.43Å; S158-E163 WeakPolarHBondContact CB-OE1 3.39Å; S158-E163 PolarHBondContact N-OE1 3.42Å; S158-E163 PolarHBondContact OG-OE1 3.38Å; D159-E163 PolarHBondContact N-OE1 3.3Å; D159-E163 WeakPolarHBondContact O-CB 3.31Å; D159-E163 VanDerWaalsContact O-CG 3.27Å; D159-E163 WeakPolarHBondContact O-CG 3.47Å; D159-E163 PolarHBondContact O-N 2.86Å; E163-Q386 VanDerWaalsContact CD-NE2 3.34Å; E163-Q386 PolarHBondContact OE1-NE2 3.3Å; E163-Q386 PolarHBondContact OE2-NE2 2.87Å; E163-M390 HydrophobicContact CG-CE 4.42Å; E163-N393 PolarHBondContact O-ND2 3Å; E163-N393 VanDerWaalsContact O-ND2 3.11Å
164	F	91.8	Very high	93.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.162	C	C	.	.			trans	-93.5	105.2	178.5	-71.2	-37.1	0	0	0	112.6	E113 Y116 P157 P160 R170 L173	E113-F164 HydrophobicContact CB-CD1 3.93Å; E113-F164 HydrophobicContact CB-CE1 3.91Å; E113-F164 HydrophobicContact CG-CD1 3.98Å; E113-F164 HydrophobicContact CG-CE1 4.43Å; E113-F164 WeakPolarHBondContact OE1-CA 3.43Å; Y116-F164 AromaticContact CD1-CE1 3.99Å; Y116-F164 HydrophobicContact CD1-CE1 3.99Å; Y116-F164 HydrophobicContact CD1-CZ 4.06Å; Y116-F164 AromaticContact CD2-CE1 3.61Å; Y116-F164 HydrophobicContact CD2-CE1 3.61Å; Y116-F164 HydrophobicContact CD2-CZ 4.36Å; Y116-F164 HydrophobicContact CE1-CE1 4.31Å; Y116-F164 AromaticContact CE2-CE1 3.91Å; Y116-F164 HydrophobicContact CE2-CE1 3.91Å; Y116-F164 AromaticContact CG-CE1 3.63Å; Y116-F164 HydrophobicContact CG-CE1 3.63Å; Y116-F164 AromaticContact CG-CZ 3.92Å; Y116-F164 HydrophobicContact CG-CZ 3.92Å; P157-F164 HydrophobicContact CG-CD2 4.33Å; P157-F164 HydrophobicContact CG-CE2 3.89Å; P157-F164 HydrophobicContact CG-CZ 4.16Å; P160-F164 WeakPolarHBondContact O-CB 3.45Å; F164-R170 HydrophobicContact CB-CG 3.58Å; F164-R170 HydrophobicContact CD2-CG 4.14Å; F164-R170 HydrophobicContact CG-CG 4.36Å; F164-R170 PolarHBondContact O-NH1 3.47Å; F164-L173 HydrophobicContact CD2-CD2 4.36Å; F164-L173 HydrophobicContact CE2-CB 4.02Å; F164-L173 HydrophobicContact CE2-CD2 3.79Å; F164-L173 HydrophobicContact CE2-CG 4.48Å
165	R	87.2	Confident	93.1	Very high	111 Å²	111	33.4 Å²	33.4	42%	0.419	16%	0.162	S	C	.	.			trans	-73.5	-34.5	175.1	-165.1	175.7	-172.8	-169.6	2	111.7	E113 N393 M396 A398	E113-R165 PolarHBondContact OE1-N 3.38Å; R165-N393 WeakPolarHBondContact CD-O 3.32Å; R165-N393 PolarHBondContact NH1-O 2.9Å; R165-M396 PolarHBondContact NH1-O 2.94Å; R165-M396 PolarHBondContact NH2-O 3.36Å; R165-M396 VanDerWaalsContact NH2-O 3.15Å; R165-A398 VanDerWaalsContact NH2-CA 3.3Å
166	Q	89.6	Confident	93.1	Very high	22 Å²	22	33.6 Å²	33.6	10%	0.103	16%	0.162	C	C	.	.	S	Bend	trans	-81.7	122.5	175.7	-58.1	-159.6	-78.3	0	0	112	I112 E113 K168 S169 R170	I112-Q166 HydrophobicContact CB-CG 4.47Å; I112-Q166 HydrophobicContact CD1-CG 4.11Å; E113-Q166 PolarHBondContact OE1-N 3.14Å; E113-Q166 WeakPolarHBondContact OE2-CB 3.46Å; E113-Q166 WeakPolarHBondContact OE2-CG 3.3Å; Q166-K168 PolarHBondContact O-N 3.36Å; Q166-S169 WeakPolarHBondContact O-CB 3.14Å; Q166-S169 PolarHBondContact O-N 3.47Å; Q166-R170 PolarHBondContact O-N 3.09Å
167	E	90.9	Very high	93.1	Very high	75 Å²	75	33 Å²	33	35%	0.35	16%	0.16	S	C	.	.	H	α-helix	trans	-46.7	-42.9	168.7	-178.2	175.6	126.4	0	0	112.5	S169 R170 Y171 N251	E167-S169 VanDerWaalsContact C-N 3.34Å; E167-S169 PolarHBondContact O-N 3.09Å; E167-R170 CarbonylContact O-C 3.6Å; E167-R170 WeakPolarHBondContact O-CA 3.43Å; E167-R170 WeakPolarHBondContact O-CB 3.46Å; E167-R170 PolarHBondContact O-N 3.07Å; E167-R170 VanDerWaalsContact O-N 3.1Å; E167-Y171 PolarHBondContact O-N 2.95Å; E167-N251 PolarHBondContact OE1-ND2 2.78Å; E167-N251 PolarHBondContact OE2-ND2 3.32Å
168	K	91.4	Very high	93	Very high	61 Å²	61	35 Å²	35	27%	0.265	17%	0.168	S	C	.	.	H	α-helix	trans	-59.8	-36	175.2	-174.2	179.2	-174.4	174.9	0	114.6	L108 G109 G110 I111 Q166 R170 L172	L108-K168 WeakPolarHBondContact O-CE 3.46Å; L108-K168 PolarHBondContact O-NZ 3.02Å; G109-K168 PolarHBondContact O-NZ 3.37Å; G110-K168 WeakPolarHBondContact O-CE 3.34Å; G110-K168 PolarHBondContact O-NZ 2.97Å; I111-K168 HydrophobicContact CG1-CD 4.36Å; Q166-K168 PolarHBondContact O-N 3.36Å; K168-R170 VanDerWaalsContact C-N 3.34Å; K168-L172 HydrophobicContact CG-CD1 4.28Å; K168-L172 WeakPolarHBondContact O-CD1 3.41Å; K168-L172 VanDerWaalsContact O-CG 3.23Å; K168-L172 WeakPolarHBondContact O-CG 3.42Å; K168-L172 PolarHBondContact O-N 3.2Å
169	S	94.1	Very high	92.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-70.1	-36	175.7	-60.1	0	0	0	0	110.6	E113 Q166 E167 L173	E113-S169 WeakPolarHBondContact OE2-CB 3.49Å; E113-S169 PolarHBondContact OE2-OG 2.7Å; Q166-S169 WeakPolarHBondContact O-CB 3.14Å; Q166-S169 PolarHBondContact O-N 3.47Å; E167-S169 VanDerWaalsContact C-N 3.34Å; E167-S169 PolarHBondContact O-N 3.09Å; S169-L173 PolarHBondContact O-N 3.33Å; S169-L173 VanDerWaalsContact O-N 3.16Å
170	R	95	Very high	92.8	Very high	32 Å²	32	33.1 Å²	33.1	12%	0.121	15%	0.148	C	C	.	.	H	α-helix	trans	-65.9	-49.2	171.9	-62	-163.9	-55.8	-85	-2.2	111.7	F164 Q166 E167 K168 L172 L173 Y174 N255 L258	F164-R170 HydrophobicContact CB-CG 3.58Å; F164-R170 HydrophobicContact CD2-CG 4.14Å; F164-R170 HydrophobicContact CG-CG 4.36Å; F164-R170 PolarHBondContact O-NH1 3.47Å; Q166-R170 PolarHBondContact O-N 3.09Å; E167-R170 CarbonylContact O-C 3.6Å; E167-R170 WeakPolarHBondContact O-CA 3.43Å; E167-R170 WeakPolarHBondContact O-CB 3.46Å; E167-R170 PolarHBondContact O-N 3.07Å; E167-R170 VanDerWaalsContact O-N 3.1Å; K168-R170 VanDerWaalsContact C-N 3.34Å; R170-L172 PolarHBondContact O-N 3.3Å; R170-L173 CarbonylContact O-C 3.6Å; R170-L173 WeakPolarHBondContact O-CA 3.27Å; R170-L173 WeakPolarHBondContact O-CB 3.34Å; R170-L173 PolarHBondContact O-N 3.3Å; R170-Y174 PolarHBondContact O-N 2.69Å; R170-N255 PolarHBondContact NE-OD1 2.9Å; R170-L258 HydrophobicContact CB-CD1 3.61Å; R170-L258 HydrophobicContact CG-CD1 4.18Å
171	Y	94.6	Very high	92.8	Very high	64 Å²	64	33.1 Å²	33.1	25%	0.251	15%	0.148	S	C	.	.	H	α-helix	trans	-55.8	-44.5	175.6	178	-109.9	0	0	0	113.1	E167 L173 Y174 L175 E254	E167-Y171 PolarHBondContact O-N 2.95Å; Y171-L173 VanDerWaalsContact C-N 3.32Å; Y171-L173 PolarHBondContact O-N 3.06Å; Y171-Y174 HydrophobicContact CD2-CD1 4.26Å; Y171-Y174 HydrophobicContact CE2-CD1 4.34Å; Y171-Y174 WeakPolarHBondContact O-CB 3.43Å; Y171-Y174 PolarHBondContact O-N 3.49Å; Y171-L175 HydrophobicContact CD1-CD1 4.2Å; Y171-L175 HydrophobicContact CE1-CD1 3.58Å; Y171-L175 HydrophobicContact CE1-CG 4.13Å; Y171-L175 HydrophobicContact CE2-CD2 4.31Å; Y171-L175 HydrophobicContact CE2-CG 4.3Å; Y171-L175 PolarHBondContact O-N 2.87Å; Y171-E254 WeakPolarHBondContact CD2-OE1 3.4Å; Y171-E254 WeakPolarHBondContact CD2-OE2 3.21Å
172	L	95.1	Very high	92.6	Very high	12 Å²	12	36.1 Å²	36.1	6%	0.063	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-32.7	177.4	-67.6	166.1	0	0	0	112.1	L80 I111 F117 F151 K168 R170 Q176	L80-L172 HydrophobicContact CD1-CB 3.99Å; L80-L172 HydrophobicContact CD1-CD2 3.96Å; L80-L172 WeakPolarHBondContact CD1-O 3.29Å; I111-L172 HydrophobicContact CD1-CD1 3.38Å; I111-L172 HydrophobicContact CG1-CD1 4.44Å; F117-L172 HydrophobicContact CE1-CB 3.66Å; F117-L172 HydrophobicContact CE1-CD1 4.34Å; F117-L172 HydrophobicContact CZ-CB 3.85Å; F117-L172 HydrophobicContact CZ-CD1 4.26Å; F151-L172 HydrophobicContact CE1-CD1 4.42Å; F151-L172 HydrophobicContact CE1-CD2 4.49Å; K168-L172 HydrophobicContact CG-CD1 4.28Å; K168-L172 WeakPolarHBondContact O-CD1 3.41Å; K168-L172 VanDerWaalsContact O-CG 3.23Å; K168-L172 WeakPolarHBondContact O-CG 3.42Å; K168-L172 PolarHBondContact O-N 3.2Å; R170-L172 PolarHBondContact O-N 3.3Å; L172-Q176 PolarHBondContact O-N 3.02Å
173	L	96	Very high	92.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.4	-38	170.4	-179.2	62.6	0	0	0	111.9	V153 Y156 P157 P160 F164 S169 R170 Y171 Q176 L177 L258	V153-L173 HydrophobicContact CG1-CD1 4.2Å; V153-L173 HydrophobicContact CG2-CD1 3.99Å; Y156-L173 HydrophobicContact CD1-CD1 3.78Å; Y156-L173 HydrophobicContact CE1-CD1 3.97Å; P157-L173 HydrophobicContact CG-CD2 4.03Å; P160-L173 HydrophobicContact CB-CD2 3.48Å; P160-L173 VanDerWaalsContact CB-CD2 3.48Å; F164-L173 HydrophobicContact CD2-CD2 4.36Å; F164-L173 HydrophobicContact CE2-CB 4.02Å; F164-L173 HydrophobicContact CE2-CD2 3.79Å; F164-L173 HydrophobicContact CE2-CG 4.48Å; S169-L173 PolarHBondContact O-N 3.33Å; S169-L173 VanDerWaalsContact O-N 3.16Å; R170-L173 CarbonylContact O-C 3.6Å; R170-L173 WeakPolarHBondContact O-CA 3.27Å; R170-L173 WeakPolarHBondContact O-CB 3.34Å; R170-L173 PolarHBondContact O-N 3.3Å; Y171-L173 VanDerWaalsContact C-N 3.32Å; Y171-L173 PolarHBondContact O-N 3.06Å; L173-Q176 WeakPolarHBondContact O-CB 3.06Å; L173-Q176 PolarHBondContact O-N 3.45Å; L173-L177 HydrophobicContact CD1-CD1 3.81Å; L173-L177 HydrophobicContact CD1-CG 3.98Å; L173-L177 HydrophobicContact CD2-CD1 4.25Å; L173-L177 HydrophobicContact CG-CD1 3.69Å; L173-L177 HydrophobicContact CG-CG 4.29Å; L173-L177 WeakPolarHBondContact O-CB 3.33Å; L173-L177 WeakPolarHBondContact O-CG 3.26Å; L173-L177 PolarHBondContact O-N 3.37Å; L173-L258 HydrophobicContact CB-CD2 4.15Å; L173-L258 HydrophobicContact CD2-CD2 3.89Å; L173-L258 HydrophobicContact CG-CD2 3.74Å
174	Y	96	Very high	92.4	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.016	16%	0.155	C	C	.	.	H	α-helix	trans	-57.1	-50.9	173.3	163.9	-103.4	0	0	0	110.8	R170 Y171 Q176 L177 R178 I200 E204 E254 F257	R170-Y174 PolarHBondContact O-N 2.69Å; Y171-Y174 HydrophobicContact CD2-CD1 4.26Å; Y171-Y174 HydrophobicContact CE2-CD1 4.34Å; Y171-Y174 WeakPolarHBondContact O-CB 3.43Å; Y171-Y174 PolarHBondContact O-N 3.49Å; Y174-Q176 VanDerWaalsContact C-N 3.32Å; Y174-Q176 PolarHBondContact O-N 2.98Å; Y174-L177 PolarHBondContact O-N 3Å; Y174-L177 VanDerWaalsContact O-N 3.14Å; Y174-R178 WeakPolarHBondContact O-CB 3.17Å; Y174-R178 PolarHBondContact O-N 3.34Å; Y174-I200 HydrophobicContact CE2-CG1 4.14Å; Y174-E204 PolarHBondContact OH-OE1 3.5Å; Y174-E254 HydrophobicContact CD1-CG 4.1Å; Y174-E254 HydrophobicContact CD2-CG 4.31Å; Y174-E254 HydrophobicContact CE1-CG 4.47Å; Y174-E254 HydrophobicContact CG-CG 4.04Å; Y174-F257 HydrophobicContact CD2-CB 4.22Å; Y174-F257 AromaticContact CD2-CD1 3.59Å; Y174-F257 HydrophobicContact CD2-CD1 3.59Å; Y174-F257 HydrophobicContact CD2-CD2 4.38Å; Y174-F257 HydrophobicContact CD2-CE1 4.02Å; Y174-F257 AromaticContact CD2-CG 3.8Å; Y174-F257 HydrophobicContact CD2-CG 3.8Å; Y174-F257 HydrophobicContact CE2-CB 4.38Å; Y174-F257 HydrophobicContact CE2-CD1 4.1Å; Y174-F257 HydrophobicContact CE2-CD2 4.06Å; Y174-F257 HydrophobicContact CE2-CE1 4.43Å; Y174-F257 HydrophobicContact CE2-CE2 4.39Å; Y174-F257 AromaticContact CE2-CG 3.92Å; Y174-F257 HydrophobicContact CE2-CG 3.92Å
175	L	94.9	Very high	92.2	Very high	14 Å²	14	35.4 Å²	35.4	7%	0.073	16%	0.164	C	C	.	.	H	α-helix	trans	-58.4	-41.2	176.2	-68.2	-178.1	0	0	0	112.8	L80 Y171 R179	L80-L175 HydrophobicContact CB-CB 4.06Å; L80-L175 HydrophobicContact CB-CD1 4.32Å; Y171-L175 HydrophobicContact CD1-CD1 4.2Å; Y171-L175 HydrophobicContact CE1-CD1 3.58Å; Y171-L175 HydrophobicContact CE1-CG 4.13Å; Y171-L175 HydrophobicContact CE2-CD2 4.31Å; Y171-L175 HydrophobicContact CE2-CG 4.3Å; Y171-L175 PolarHBondContact O-N 2.87Å; L175-R179 WeakPolarHBondContact O-CB 3.32Å; L175-R179 PolarHBondContact O-N 3.49Å; L175-R179 VanDerWaalsContact O-N 3.12Å
176	Q	95.3	Very high	92.5	Very high	5 Å²	5	30.3 Å²	30.3	2%	0.023	14%	0.144	C	C	.	.	H	α-helix	trans	-62.7	-43.3	175.8	175.9	63.9	77.9	0	0	112	L80 R152 V153 Y156 L172 L173 Y174 R179 D180	L80-Q176 HydrophobicContact CD2-CB 3.82Å; L80-Q176 HydrophobicContact CD2-CG 4.42Å; R152-Q176 VanDerWaalsContact CD-OE1 3.24Å; V153-Q176 HydrophobicContact CB-CG 3.93Å; V153-Q176 HydrophobicContact CG2-CB 3.74Å; V153-Q176 HydrophobicContact CG2-CG 3.71Å; Y156-Q176 HydrophobicContact CE1-CG 4Å; Y156-Q176 VanDerWaalsContact OH-CG 3.28Å; Y156-Q176 WeakPolarHBondContact OH-CG 3.42Å; L172-Q176 PolarHBondContact O-N 3.02Å; L173-Q176 WeakPolarHBondContact O-CB 3.06Å; L173-Q176 PolarHBondContact O-N 3.45Å; Y174-Q176 VanDerWaalsContact C-N 3.32Å; Y174-Q176 PolarHBondContact O-N 2.98Å; Q176-R179 WeakPolarHBondContact O-CB 3.43Å; Q176-R179 PolarHBondContact O-N 3.39Å; Q176-D180 PolarHBondContact NE2-OD1 3.12Å; Q176-D180 PolarHBondContact NE2-OD2 3.28Å; Q176-D180 PolarHBondContact O-N 3.35Å
177	L	95.2	Very high	92.4	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-78.9	-35	-176.3	-70	168.5	0	0	0	112.6	Y156 L173 Y174 R179 D180 L181 L186 F257 L258 A261 Y267	Y156-L177 HydrophobicContact CD1-CD2 4.35Å; Y156-L177 HydrophobicContact CE1-CD2 4.06Å; L173-L177 HydrophobicContact CD1-CD1 3.81Å; L173-L177 HydrophobicContact CD1-CG 3.98Å; L173-L177 HydrophobicContact CD2-CD1 4.25Å; L173-L177 HydrophobicContact CG-CD1 3.69Å; L173-L177 HydrophobicContact CG-CG 4.29Å; L173-L177 WeakPolarHBondContact O-CB 3.33Å; L173-L177 WeakPolarHBondContact O-CG 3.26Å; L173-L177 PolarHBondContact O-N 3.37Å; Y174-L177 PolarHBondContact O-N 3Å; Y174-L177 VanDerWaalsContact O-N 3.14Å; L177-R179 VanDerWaalsContact C-N 3.27Å; L177-R179 PolarHBondContact O-N 2.94Å; L177-D180 CarbonylContact O-C 3.59Å; L177-D180 PolarHBondContact O-N 3.31Å; L177-D180 VanDerWaalsContact O-N 3.15Å; L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 PolarHBondContact O-N 3.48Å; L177-L186 HydrophobicContact CB-CD2 4.42Å; L177-L186 HydrophobicContact CD2-CD2 4.4Å; L177-F257 HydrophobicContact CB-CE1 3.71Å; L177-F257 HydrophobicContact CB-CZ 4.35Å; L177-L258 HydrophobicContact CD1-CD2 3.71Å; L177-A261 HydrophobicContact CD1-CB 4.12Å; L177-Y267 HydrophobicContact CD1-CD2 4.38Å; L177-Y267 HydrophobicContact CD1-CE2 3.8Å; L177-Y267 HydrophobicContact CD2-CD2 3.93Å; L177-Y267 HydrophobicContact CD2-CE2 3.99Å
178	R	93	Very high	92.3	Very high	42 Å²	42	28.4 Å²	28.4	16%	0.158	14%	0.142	C	C	.	.	H	α-helix	trans	-57.1	-42.8	167.2	179.5	-176	173.6	-162.4	8.8	110.8	Y174 L181 H182 I200 E204	Y174-R178 WeakPolarHBondContact O-CB 3.17Å; Y174-R178 PolarHBondContact O-N 3.34Å; R178-L181 WeakPolarHBondContact O-CB 3.41Å; R178-L181 PolarHBondContact O-N 2.98Å; R178-H182 PolarHBondContact O-N 2.63Å; R178-I200 HydrophobicContact CG-CD1 4.02Å; R178-I200 HydrophobicContact CG-CG1 4.46Å; R178-E204 WeakPolarHBondContact CD-OE1 3.45Å; R178-E204 IonicContact CZ-OE1 3.56Å; R178-E204 IonicContact CZ-OE2 3.87Å; R178-E204 IonicContact NE-OE1 2.73Å; R178-E204 PolarHBondContact NE-OE1 2.92Å; R178-E204 IonicContact NH1-OE1 2.74Å; R178-E204 PolarHBondContact NH1-OE1 3.33Å; R178-E204 IonicContact NH1-OE2 3.61Å; R178-E204 PolarHBondContact NH1-OE2 2.68Å; R178-E204 IonicContact NH2-OE1 2.82Å; R178-E204 PolarHBondContact NH2-OE1 2.8Å; R178-E204 IonicContact NH2-OE2 2.71Å; R178-E204 PolarHBondContact NH2-OE2 3.41Å
179	R	91.8	Very high	92.2	Very high	66 Å²	66	34 Å²	34	25%	0.249	16%	0.161	C	C	.	.	H	α-helix	trans	-63.9	-40.1	174.8	-169.4	-166.7	-169.7	100.8	18.1	112.4	L80 D82 R152 L175 Q176 L177 L181 S183	L80-R179 PolarHBondContact O-NH1 3.01Å; L80-R179 VanDerWaalsContact O-NH1 3.11Å; D82-R179 IonicContact OD1-CZ 2.74Å; D82-R179 IonicContact OD1-NH1 3.57Å; D82-R179 PolarHBondContact OD1-NH1 2.76Å; D82-R179 IonicContact OD1-NH2 3.08Å; D82-R179 PolarHBondContact OD1-NH2 3.07Å; D82-R179 IonicContact OD2-CZ 3.45Å; D82-R179 IonicContact OD2-NH1 2.68Å; D82-R179 PolarHBondContact OD2-NH1 3.15Å; D82-R179 IonicContact OD2-NH2 2.69Å; D82-R179 PolarHBondContact OD2-NH2 2.82Å; R152-R179 VanDerWaalsContact NH2-CZ 3.27Å; L175-R179 WeakPolarHBondContact O-CB 3.32Å; L175-R179 PolarHBondContact O-N 3.49Å; L175-R179 VanDerWaalsContact O-N 3.12Å; Q176-R179 WeakPolarHBondContact O-CB 3.43Å; Q176-R179 PolarHBondContact O-N 3.39Å; L177-R179 VanDerWaalsContact C-N 3.27Å; L177-R179 PolarHBondContact O-N 2.94Å; R179-L181 VanDerWaalsContact C-N 3.35Å; R179-S183 WeakPolarHBondContact O-CB 3.36Å; R179-S183 PolarHBondContact O-N 2.86Å; R179-S183 PolarHBondContact O-OG 2.86Å
180	D	92.3	Very high	91.9	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.048	18%	0.181	C	C	.	.	H	α-helix	trans	-70	-32.4	177.5	-67.6	-31.1	0	0	0	112	Q176 L177 S183 G184 R185 L186	Q176-D180 PolarHBondContact NE2-OD1 3.12Å; Q176-D180 PolarHBondContact NE2-OD2 3.28Å; Q176-D180 PolarHBondContact O-N 3.35Å; L177-D180 CarbonylContact O-C 3.59Å; L177-D180 PolarHBondContact O-N 3.31Å; L177-D180 VanDerWaalsContact O-N 3.15Å; D180-S183 WeakPolarHBondContact CA-OG 3.13Å; D180-S183 PolarHBondContact O-OG 3.47Å; D180-G184 PolarHBondContact O-N 2.9Å; D180-R185 HydrophobicContact CB-CB 4.24Å; D180-R185 HydrophobicContact CB-CG 4.37Å; D180-R185 WeakPolarHBondContact O-CA 3.5Å; D180-R185 WeakPolarHBondContact O-CB 3.28Å; D180-R185 PolarHBondContact O-N 3.19Å; D180-R185 WeakPolarHBondContact OD1-CD 3.47Å; D180-R185 IonicContact OD1-CZ 3.44Å; D180-R185 IonicContact OD1-NE 3.48Å; D180-R185 IonicContact OD1-NH1 3.95Å; D180-R185 PolarHBondContact OD1-NH1 3Å; D180-R185 IonicContact OD2-CZ 2.79Å; D180-R185 IonicContact OD2-NH1 3.65Å; D180-R185 PolarHBondContact OD2-NH1 3.09Å; D180-R185 IonicContact OD2-NH2 3.05Å; D180-L186 HydrophobicContact CB-CB 4.09Å; D180-L186 PolarHBondContact O-N 3.26Å
181	L	92.1	Very high	91.8	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-53.8	170.9	-166.4	78.5	0	0	0	111.2	L177 R178 R179 S183 G184 L186 M193 L196 I200 F227 F257	L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 PolarHBondContact O-N 3.48Å; R178-L181 WeakPolarHBondContact O-CB 3.41Å; R178-L181 PolarHBondContact O-N 2.98Å; R179-L181 VanDerWaalsContact C-N 3.35Å; L181-S183 PolarHBondContact O-N 2.98Å; L181-G184 PolarHBondContact O-N 2.92Å; L181-L186 HydrophobicContact CB-CB 4.49Å; L181-L186 HydrophobicContact CB-CD2 4.4Å; L181-L186 HydrophobicContact CD1-CB 4.43Å; L181-L186 HydrophobicContact CD1-CD2 4.11Å; L181-L186 HydrophobicContact CD1-CG 4.3Å; L181-M193 HydrophobicContact CD1-CE 3.52Å; L181-M193 HydrophobicContact CD1-SD 3.68Å; L181-M193 HydrophobicContact CG-CE 4.35Å; L181-L196 HydrophobicContact CD1-CD1 3.89Å; L181-L196 HydrophobicContact CD2-CB 4.28Å; L181-I200 HydrophobicContact CD2-CD1 3.68Å; L181-F227 HydrophobicContact CD2-CB 4.47Å; L181-F227 HydrophobicContact CG-CB 4.17Å; L181-F257 HydrophobicContact CD2-CE2 4.35Å
182	H	88.8	Confident	91.7	Very high	95 Å²	95	41 Å²	41	44%	0.44	20%	0.203	S	C	.	.	H	α-helix	trans	-58.9	-35.1	178.5	173.8	-114.3	0	0	0	112.8	R178 G184 K225 M226	R178-H182 PolarHBondContact O-N 2.63Å; H182-G184 VanDerWaalsContact C-N 3.31Å; H182-G184 PolarHBondContact O-N 2.83Å; H182-K225 PolarHBondContact CD2-O 2.82Å; H182-M226 WeakPolarHBondContact CA-O 3.42Å
183	S	87.8	Confident	91.6	Very high	57 Å²	57	41.4 Å²	41.4	40%	0.399	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	2.9	178.1	58.6	0	0	0	0	115.1	R179 D180 L181 R185	R179-S183 WeakPolarHBondContact O-CB 3.36Å; R179-S183 PolarHBondContact O-N 2.86Å; R179-S183 PolarHBondContact O-OG 2.86Å; D180-S183 WeakPolarHBondContact CA-OG 3.13Å; D180-S183 PolarHBondContact O-OG 3.47Å; L181-S183 PolarHBondContact O-N 2.98Å; S183-R185 PolarHBondContact O-N 2.9Å
184	G	87.6	Confident	91.4	Very high	26 Å²	26	42.3 Å²	42.3	27%	0.268	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	25.8	-178.5	0	0	0	0	0	113.7	D180 L181 H182	D180-G184 PolarHBondContact O-N 2.9Å; L181-G184 PolarHBondContact O-N 2.92Å; H182-G184 VanDerWaalsContact C-N 3.31Å; H182-G184 PolarHBondContact O-N 2.83Å
185	R	88.8	Confident	91.4	Very high	47 Å²	47	43.7 Å²	43.7	18%	0.177	22%	0.218	C	C	.	.			trans	-95.6	-35.2	176.6	174.6	178.9	166.3	-128.8	-14.1	111.7	D180 S183 G268 I269	D180-R185 HydrophobicContact CB-CB 4.24Å; D180-R185 HydrophobicContact CB-CG 4.37Å; D180-R185 WeakPolarHBondContact O-CA 3.5Å; D180-R185 WeakPolarHBondContact O-CB 3.28Å; D180-R185 PolarHBondContact O-N 3.19Å; D180-R185 WeakPolarHBondContact OD1-CD 3.47Å; D180-R185 IonicContact OD1-CZ 3.44Å; D180-R185 IonicContact OD1-NE 3.48Å; D180-R185 IonicContact OD1-NH1 3.95Å; D180-R185 PolarHBondContact OD1-NH1 3Å; D180-R185 IonicContact OD2-CZ 2.79Å; D180-R185 IonicContact OD2-NH1 3.65Å; D180-R185 PolarHBondContact OD2-NH1 3.09Å; D180-R185 IonicContact OD2-NH2 3.05Å; S183-R185 PolarHBondContact O-N 2.9Å; R185-G268 VanDerWaalsContact NH2-C 3.29Å; R185-G268 PolarHBondContact NH2-O 2.82Å; R185-I269 PolarHBondContact NE-O 2.86Å; R185-I269 PolarHBondContact NH2-O 3.17Å
186	L	91.5	Very high	91.4	Very high	3 Å²	3	43 Å²	43	2%	0.016	21%	0.214	C	C	.	.	S	Bend	trans	-91.2	121.5	167.8	-176.6	65.6	0	0	0	108.4	L177 D180 L181 L196 A261 F264	L177-L186 HydrophobicContact CB-CD2 4.42Å; L177-L186 HydrophobicContact CD2-CD2 4.4Å; D180-L186 HydrophobicContact CB-CB 4.09Å; D180-L186 PolarHBondContact O-N 3.26Å; L181-L186 HydrophobicContact CB-CB 4.49Å; L181-L186 HydrophobicContact CB-CD2 4.4Å; L181-L186 HydrophobicContact CD1-CB 4.43Å; L181-L186 HydrophobicContact CD1-CD2 4.11Å; L181-L186 HydrophobicContact CD1-CG 4.3Å; L186-L196 HydrophobicContact CD2-CD1 4.03Å; L186-A261 HydrophobicContact CD2-CB 4Å; L186-F264 HydrophobicContact CD1-CB 3.98Å; L186-F264 HydrophobicContact CD1-CD2 3.63Å; L186-F264 HydrophobicContact CD1-CG 4.18Å; L186-F264 HydrophobicContact CG-CD2 3.79Å; L186-F264 HydrophobicContact CG-CE2 4.22Å
187	I	88.7	Confident	91.3	Very high	38 Å²	38	42.8 Å²	42.8	20%	0.195	21%	0.213	C	C	.	.			trans	-139.8	128.4	-171.9	-48.5	176.4	0	0	0	108.5	F264 T266 L669	I187-F264 VanDerWaalsContact C-CD2 3.43Å; I187-F264 WeakPolarHBondContact O-CD2 3.33Å; I187-T266 HydrophobicContact CB-CG2 4.11Å; I187-T266 HydrophobicContact CG1-CG2 4.48Å; I187-T266 PolarHBondContact N-OG1 3.08Å; I187-T266 PolarHBondContact O-OG1 3.45Å; I187-L669 HydrophobicContact CD1-CB 3.75Å; I187-L669 HydrophobicContact CD1-CD1 4.41Å; I187-L669 HydrophobicContact CD1-CG 4.48Å
188	G	88	Confident	91.3	Very high	20 Å²	20	42.7 Å²	42.7	21%	0.206	21%	0.213	C	C	.	.			trans	-137.6	-167	170.4	0	0	0	0	0	110	M193	G188-M193 PolarHBondContact N-SD 2.62Å
189	R	89.5	Confident	91.4	Very high	178 Å²	178	40.7 Å²	40.7	67%	0.672	21%	0.205	S	C	*	.			trans	-69.5	154.7	175.6	-62.1	177.1	-71.7	167.2	-2	110.7	L191 E192 M193	R189-L191 VanDerWaalsContact C-N 3.33Å; R189-L191 PolarHBondContact O-N 2.91Å; R189-E192 HydrophobicContact CB-CG 4.15Å; R189-E192 WeakPolarHBondContact CB-OE2 3.48Å; R189-E192 IonicContact CZ-OE1 3.22Å; R189-E192 VanDerWaalsContact CZ-OE1 3.3Å; R189-E192 PolarHBondContact N-OE2 2.79Å; R189-E192 VanDerWaalsContact NE-CD 3.32Å; R189-E192 IonicContact NE-OE1 3.8Å; R189-E192 PolarHBondContact NE-OE1 3.36Å; R189-E192 IonicContact NE-OE2 3.99Å; R189-E192 PolarHBondContact NE-OE2 3.17Å; R189-E192 IonicContact NH2-OE1 2.91Å; R189-E192 PolarHBondContact NH2-OE1 3.06Å; R189-E192 WeakPolarHBondContact O-CA 3.28Å; R189-E192 WeakPolarHBondContact O-CB 3.42Å; R189-E192 PolarHBondContact O-N 2.9Å; R189-M193 WeakPolarHBondContact O-CG 3.43Å; R189-M193 PolarHBondContact O-N 2.88Å
190	N	89	Confident	91.5	Very high	76 Å²	76	37.7 Å²	37.7	41%	0.406	19%	0.194	S	C	.	.	H	α-helix	trans	-51.7	-47.7	-175	-69.5	-26.4	0	0	0	112.7	E192 M193 H194	N190-E192 VanDerWaalsContact C-N 3.34Å; N190-E192 PolarHBondContact O-N 3.33Å; N190-M193 WeakPolarHBondContact O-CB 3.41Å; N190-M193 PolarHBondContact O-N 2.8Å; N190-H194 PolarHBondContact O-CD2 3.48Å; N190-H194 PolarHBondContact O-CE1 3.4Å; N190-H194 PolarHBondContact O-N 3.01Å; N190-H194 PolarHBondContact O-ND1 2.93Å; N190-H194 PolarHBondContact O-NE2 3.35Å
191	L	91.8	Very high	91.5	Very high	117 Å²	117	37.4 Å²	37.4	61%	0.613	19%	0.193	S	C	*	.	H	α-helix	trans	-59.4	-40.7	176.1	-178.9	60.6	0	0	0	113.2	R189 H194 V195 I241	R189-L191 VanDerWaalsContact C-N 3.33Å; R189-L191 PolarHBondContact O-N 2.91Å; L191-H194 WeakPolarHBondContact O-CB 3.22Å; L191-H194 PolarHBondContact O-N 3.22Å; L191-V195 WeakPolarHBondContact O-CG2 3.39Å; L191-V195 PolarHBondContact O-N 3.01Å; L191-I241 HydrophobicContact CD1-CD1 4.06Å
192	E	92.7	Very high	91.6	Very high	50 Å²	50	37.5 Å²	37.5	23%	0.234	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-39.1	-179.9	-57.2	171.3	147.5	0	0	111.2	R189 N190 H194 V195 L196 F264	R189-E192 HydrophobicContact CB-CG 4.15Å; R189-E192 WeakPolarHBondContact CB-OE2 3.48Å; R189-E192 IonicContact CZ-OE1 3.22Å; R189-E192 VanDerWaalsContact CZ-OE1 3.3Å; R189-E192 PolarHBondContact N-OE2 2.79Å; R189-E192 VanDerWaalsContact NE-CD 3.32Å; R189-E192 IonicContact NE-OE1 3.8Å; R189-E192 PolarHBondContact NE-OE1 3.36Å; R189-E192 IonicContact NE-OE2 3.99Å; R189-E192 PolarHBondContact NE-OE2 3.17Å; R189-E192 IonicContact NH2-OE1 2.91Å; R189-E192 PolarHBondContact NH2-OE1 3.06Å; R189-E192 WeakPolarHBondContact O-CA 3.28Å; R189-E192 WeakPolarHBondContact O-CB 3.42Å; R189-E192 PolarHBondContact O-N 2.9Å; N190-E192 VanDerWaalsContact C-N 3.34Å; N190-E192 PolarHBondContact O-N 3.33Å; E192-H194 VanDerWaalsContact C-N 3.32Å; E192-H194 PolarHBondContact O-N 3.04Å; E192-V195 PolarHBondContact O-N 2.83Å; E192-L196 PolarHBondContact O-N 2.82Å; E192-F264 HydrophobicContact CB-CE1 3.64Å; E192-F264 HydrophobicContact CB-CZ 3.64Å; E192-F264 HydrophobicContact CG-CE1 4.42Å
193	M	92.2	Very high	91.8	Very high	21 Å²	21	33.2 Å²	33.2	10%	0.103	17%	0.174	C	C	.	.	H	α-helix	trans	-62.2	-39.2	172.5	-61.8	-72.9	-72.8	0	0	111.2	L181 G188 R189 N190 L196 A197 F227 F264	L181-M193 HydrophobicContact CD1-CE 3.52Å; L181-M193 HydrophobicContact CD1-SD 3.68Å; L181-M193 HydrophobicContact CG-CE 4.35Å; G188-M193 PolarHBondContact N-SD 2.62Å; R189-M193 WeakPolarHBondContact O-CG 3.43Å; R189-M193 PolarHBondContact O-N 2.88Å; N190-M193 WeakPolarHBondContact O-CB 3.41Å; N190-M193 PolarHBondContact O-N 2.8Å; M193-L196 PolarHBondContact O-N 2.89Å; M193-A197 WeakPolarHBondContact O-CB 3.43Å; M193-A197 PolarHBondContact O-N 2.94Å; M193-F227 HydrophobicContact CE-CD2 4.39Å; M193-F264 HydrophobicContact SD-CE2 3.72Å; M193-F264 HydrophobicContact SD-CZ 4.43Å
194	H	93.5	Very high	91.9	Very high	18 Å²	18	31.5 Å²	31.5	8%	0.083	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-37.7	174.6	-52.5	154.7	0	0	0	112.4	N190 L191 E192 A197 A198 I238 I241	N190-H194 PolarHBondContact O-CD2 3.48Å; N190-H194 PolarHBondContact O-CE1 3.4Å; N190-H194 PolarHBondContact O-N 3.01Å; N190-H194 PolarHBondContact O-ND1 2.93Å; N190-H194 PolarHBondContact O-NE2 3.35Å; L191-H194 WeakPolarHBondContact O-CB 3.22Å; L191-H194 PolarHBondContact O-N 3.22Å; E192-H194 VanDerWaalsContact C-N 3.32Å; E192-H194 PolarHBondContact O-N 3.04Å; H194-A197 PolarHBondContact O-N 3Å; H194-A198 PolarHBondContact O-N 3.1Å; H194-I238 HydrophobicContact CB-CG1 3.88Å; H194-I241 HydrophobicContact CB-CD1 3.68Å
195	V	94.8	Very high	91.9	Very high	33 Å²	33	30.9 Å²	30.9	20%	0.2	15%	0.15	C	C	.	.	H	α-helix	trans	-64.7	-43.8	174.6	173.2	0	0	0	0	111.3	L191 E192 A197 A198 C199 I241	L191-V195 WeakPolarHBondContact O-CG2 3.39Å; L191-V195 PolarHBondContact O-N 3.01Å; E192-V195 PolarHBondContact O-N 2.83Å; V195-A197 VanDerWaalsContact C-N 3.31Å; V195-A197 PolarHBondContact O-N 2.85Å; V195-A198 PolarHBondContact O-N 2.82Å; V195-C199 PolarHBondContact O-N 3.25Å; V195-C199 PolarHBondContact O-SG 3.21Å; V195-I241 HydrophobicContact CG2-CD1 4.12Å; V195-I241 HydrophobicContact CG2-CG2 4.19Å
196	L	95.3	Very high	92	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-40.7	174.3	-69.2	-171.3	0	0	0	111.8	L181 L186 E192 M193 C199 I200 F257 N260 A261 F264	L181-L196 HydrophobicContact CD1-CD1 3.89Å; L181-L196 HydrophobicContact CD2-CB 4.28Å; L186-L196 HydrophobicContact CD2-CD1 4.03Å; E192-L196 PolarHBondContact O-N 2.82Å; M193-L196 PolarHBondContact O-N 2.89Å; L196-C199 PolarHBondContact O-N 3.04Å; L196-I200 WeakPolarHBondContact O-CG1 3.48Å; L196-I200 PolarHBondContact O-N 3.44Å; L196-F257 HydrophobicContact CB-CD2 4.02Å; L196-F257 HydrophobicContact CB-CE2 3.74Å; L196-F257 HydrophobicContact CD1-CE2 4.34Å; L196-F257 HydrophobicContact CD1-CZ 4.43Å; L196-F257 HydrophobicContact CD2-CD1 4.5Å; L196-F257 HydrophobicContact CD2-CD2 3.74Å; L196-F257 HydrophobicContact CD2-CE2 3.95Å; L196-F257 HydrophobicContact CD2-CG 4.03Å; L196-F257 HydrophobicContact CD2-CZ 4.41Å; L196-F257 WeakPolarHBondContact CD2-O 3.46Å; L196-F257 HydrophobicContact CG-CD2 4.41Å; L196-F257 HydrophobicContact CG-CE2 4.22Å; L196-F257 WeakPolarHBondContact O-CD2 3.42Å; L196-N260 HydrophobicContact CD2-CB 3.81Å; L196-A261 HydrophobicContact CD1-CB 4.26Å; L196-A261 HydrophobicContact CD2-CB 4.19Å; L196-F264 HydrophobicContact CD1-CD2 4.41Å; L196-F264 HydrophobicContact CD1-CE1 4.36Å; L196-F264 HydrophobicContact CD1-CE2 3.45Å; L196-F264 VanDerWaalsContact CD1-CE2 3.45Å; L196-F264 HydrophobicContact CD1-CZ 3.42Å; L196-F264 VanDerWaalsContact CD1-CZ 3.42Å; L196-F264 HydrophobicContact CG-CE2 4.46Å; L196-F264 HydrophobicContact CG-CZ 3.98Å
197	A	93.8	Very high	92	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-48	175.1	0	0	0	0	0	112.2	M193 H194 V195 C199 I200 L201 M226 F227 I238	M193-A197 WeakPolarHBondContact O-CB 3.43Å; M193-A197 PolarHBondContact O-N 2.94Å; H194-A197 PolarHBondContact O-N 3Å; V195-A197 VanDerWaalsContact C-N 3.31Å; V195-A197 PolarHBondContact O-N 2.85Å; A197-C199 VanDerWaalsContact C-N 3.27Å; A197-C199 PolarHBondContact O-N 3.24Å; A197-I200 WeakPolarHBondContact O-CB 3.38Å; A197-I200 PolarHBondContact O-N 3.09Å; A197-I200 VanDerWaalsContact O-N 3.09Å; A197-L201 PolarHBondContact O-N 3.21Å; A197-L201 VanDerWaalsContact O-N 3.12Å; A197-M226 HydrophobicContact CB-CE 3.64Å; A197-M226 WeakPolarHBondContact O-CE 3.18Å; A197-F227 HydrophobicContact CB-CD1 4.15Å; A197-F227 HydrophobicContact CB-CE1 3.69Å; A197-I238 HydrophobicContact CB-CD1 3.92Å; A197-I238 HydrophobicContact CB-CG1 4.06Å; A197-I238 HydrophobicContact CB-CG2 4.06Å
198	A	94.1	Very high	91.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.8	-38	176.2	0	0	0	0	0	112.6	H194 V195 L201 Q202 I241 L245	H194-A198 PolarHBondContact O-N 3.1Å; V195-A198 PolarHBondContact O-N 2.82Å; A198-L201 PolarHBondContact O-N 2.93Å; A198-Q202 PolarHBondContact O-N 3.41Å; A198-Q202 VanDerWaalsContact O-N 3.09Å; A198-I241 HydrophobicContact CB-CB 3.96Å; A198-I241 HydrophobicContact CB-CG2 3.57Å; A198-L245 HydrophobicContact CB-CD1 3.9Å; A198-L245 WeakPolarHBondContact O-CD1 3.37Å
199	C	95.4	Very high	91.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.5	-35.2	175.5	-61.1	0	0	0	0	112.5	V195 L196 A197 Q202 A203 F257	V195-C199 PolarHBondContact O-N 3.25Å; V195-C199 PolarHBondContact O-SG 3.21Å; L196-C199 PolarHBondContact O-N 3.04Å; A197-C199 VanDerWaalsContact C-N 3.27Å; A197-C199 PolarHBondContact O-N 3.24Å; C199-Q202 PolarHBondContact O-N 2.81Å; C199-A203 VanDerWaalsContact O-CB 3.28Å; C199-A203 WeakPolarHBondContact O-CB 3.48Å; C199-A203 PolarHBondContact O-N 3.28Å; C199-F257 HydrophobicContact CB-CB 3.92Å; C199-F257 HydrophobicContact CB-CD2 4.26Å
200	I	93.6	Very high	91.5	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-41.7	172.2	-70.6	163.3	0	0	0	110.9	Y174 R178 L181 L196 A197 A203 E204 M226 F257	Y174-I200 HydrophobicContact CE2-CG1 4.14Å; R178-I200 HydrophobicContact CG-CD1 4.02Å; R178-I200 HydrophobicContact CG-CG1 4.46Å; L181-I200 HydrophobicContact CD2-CD1 3.68Å; L196-I200 WeakPolarHBondContact O-CG1 3.48Å; L196-I200 PolarHBondContact O-N 3.44Å; A197-I200 WeakPolarHBondContact O-CB 3.38Å; A197-I200 PolarHBondContact O-N 3.09Å; A197-I200 VanDerWaalsContact O-N 3.09Å; I200-A203 PolarHBondContact O-N 2.96Å; I200-E204 WeakPolarHBondContact O-CB 3.25Å; I200-E204 PolarHBondContact O-N 3.15Å; I200-M226 HydrophobicContact CB-CE 4.09Å; I200-M226 HydrophobicContact CG2-CE 4.12Å; I200-M226 HydrophobicContact CG2-CG 4.42Å; I200-F257 HydrophobicContact CD1-CD2 4.39Å; I200-F257 HydrophobicContact CD1-CE2 3.67Å; I200-F257 HydrophobicContact CD1-CZ 4.48Å; I200-F257 HydrophobicContact CG1-CD2 3.92Å; I200-F257 HydrophobicContact CG1-CE2 3.69Å
201	L	93.1	Very high	91.2	Very high	3 Å²	3	29 Å²	29	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-48.8	177.2	-60.7	176.7	0	0	0	111.3	A197 A198 A203 E204 I205 G206 L221 L224 M226 I238 Y242	A197-L201 PolarHBondContact O-N 3.21Å; A197-L201 VanDerWaalsContact O-N 3.12Å; A198-L201 PolarHBondContact O-N 2.93Å; L201-A203 VanDerWaalsContact C-N 3.26Å; L201-A203 PolarHBondContact O-N 3.45Å; L201-E204 PolarHBondContact O-N 3.31Å; L201-I205 HydrophobicContact CD2-CD1 4.04Å; L201-I205 WeakPolarHBondContact O-CB 3.47Å; L201-I205 PolarHBondContact O-N 2.76Å; L201-G206 PolarHBondContact O-N 2.92Å; L201-L221 HydrophobicContact CD1-CD1 4.09Å; L201-L221 HydrophobicContact CD1-CD2 3.96Å; L201-L221 HydrophobicContact CD2-CD2 4.07Å; L201-L224 HydrophobicContact CD2-CD1 3.43Å; L201-L224 VanDerWaalsContact CD2-CD1 3.43Å; L201-M226 HydrophobicContact CD1-CE 4.21Å; L201-M226 HydrophobicContact CD2-CE 3.56Å; L201-M226 HydrophobicContact CD2-SD 3.75Å; L201-M226 HydrophobicContact CG-CE 3.55Å; L201-M226 HydrophobicContact CG-SD 4.34Å; L201-I238 HydrophobicContact CD1-CG2 3.85Å; L201-Y242 HydrophobicContact CB-CD1 3.89Å; L201-Y242 HydrophobicContact CB-CD2 3.87Å; L201-Y242 HydrophobicContact CB-CE1 3.69Å; L201-Y242 HydrophobicContact CB-CE2 3.69Å; L201-Y242 HydrophobicContact CB-CG 3.98Å; L201-Y242 HydrophobicContact CD1-CD1 3.43Å; L201-Y242 VanDerWaalsContact CD1-CD1 3.43Å; L201-Y242 HydrophobicContact CD1-CE1 3.85Å; L201-Y242 HydrophobicContact CD1-CG 3.87Å; L201-Y242 HydrophobicContact CG-CD1 4.29Å; L201-Y242 HydrophobicContact CG-CE1 4.34Å
202	Q	94.1	Very high	90.4	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.019	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-33.9	177.8	-168.9	71.1	31.4	0	0	112.4	A198 C199 G206 D207 Y242 L245 M248 A253	A198-Q202 PolarHBondContact O-N 3.41Å; A198-Q202 VanDerWaalsContact O-N 3.09Å; C199-Q202 PolarHBondContact O-N 2.81Å; Q202-G206 WeakPolarHBondContact CA-O 3.48Å; Q202-G206 PolarHBondContact O-N 2.98Å; Q202-G206 PolarHBondContact OE1-O 2.9Å; Q202-D207 PolarHBondContact NE2-OD1 3.13Å; Q202-Y242 HydrophobicContact CB-CD2 4.35Å; Q202-Y242 HydrophobicContact CB-CE2 4.08Å; Q202-L245 HydrophobicContact CB-CB 4.28Å; Q202-L245 HydrophobicContact CB-CD1 4.03Å; Q202-L245 HydrophobicContact CG-CB 4.03Å; Q202-L245 PolarHBondContact NE2-O 3.18Å; Q202-L245 PolarHBondContact OE1-O 3.34Å; Q202-M248 HydrophobicContact CG-CB 4.06Å; Q202-M248 PolarHBondContact NE2-O 3.48Å; Q202-A253 HydrophobicContact CB-CB 3.9Å; Q202-A253 HydrophobicContact CG-CB 3.85Å
203	A	92.7	Very high	89.8	Confident	5 Å²	5	33.4 Å²	33.4	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-77.7	-21.8	177.5	0	0	0	0	0	114.5	C199 I200 L201 M250 A253 E254	C199-A203 VanDerWaalsContact O-CB 3.28Å; C199-A203 WeakPolarHBondContact O-CB 3.48Å; C199-A203 PolarHBondContact O-N 3.28Å; I200-A203 PolarHBondContact O-N 2.96Å; L201-A203 VanDerWaalsContact C-N 3.26Å; L201-A203 PolarHBondContact O-N 3.45Å; A203-M250 WeakPolarHBondContact O-CE 3.26Å; A203-A253 HydrophobicContact CB-CB 4.15Å; A203-E254 HydrophobicContact CB-CG 4.28Å
204	E	89.3	Confident	89.1	Confident	21 Å²	21	34.4 Å²	34.4	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-115.5	-26.3	-172.8	-72.9	178.8	-147.7	0	0	115	Y174 R178 I200 L201 F415	Y174-E204 PolarHBondContact OH-OE1 3.5Å; R178-E204 WeakPolarHBondContact CD-OE1 3.45Å; R178-E204 IonicContact CZ-OE1 3.56Å; R178-E204 IonicContact CZ-OE2 3.87Å; R178-E204 IonicContact NE-OE1 2.73Å; R178-E204 PolarHBondContact NE-OE1 2.92Å; R178-E204 IonicContact NH1-OE1 2.74Å; R178-E204 PolarHBondContact NH1-OE1 3.33Å; R178-E204 IonicContact NH1-OE2 3.61Å; R178-E204 PolarHBondContact NH1-OE2 2.68Å; R178-E204 IonicContact NH2-OE1 2.82Å; R178-E204 PolarHBondContact NH2-OE1 2.8Å; R178-E204 IonicContact NH2-OE2 2.71Å; R178-E204 PolarHBondContact NH2-OE2 3.41Å; I200-E204 WeakPolarHBondContact O-CB 3.25Å; I200-E204 PolarHBondContact O-N 3.15Å; L201-E204 PolarHBondContact O-N 3.31Å; E204-F415 HydrophobicContact CB-CE1 4.03Å; E204-F415 HydrophobicContact CG-CE1 3.82Å; E204-F415 HydrophobicContact CG-CZ 4.4Å
205	I	89	Confident	88.4	Confident	12 Å²	12	34.4 Å²	34.4	6%	0.062	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-28.6	-178.3	-55.8	179.7	0	0	0	110.7	L201 V210 L211 Y214 L224	L201-I205 HydrophobicContact CD2-CD1 4.04Å; L201-I205 WeakPolarHBondContact O-CB 3.47Å; L201-I205 PolarHBondContact O-N 2.76Å; I205-V210 HydrophobicContact CG2-CB 4.09Å; I205-V210 HydrophobicContact CG2-CG1 4.06Å; I205-L211 HydrophobicContact CD1-CD1 3.58Å; I205-Y214 HydrophobicContact CD1-CD1 3.86Å; I205-Y214 HydrophobicContact CD1-CD2 4.28Å; I205-Y214 HydrophobicContact CD1-CE1 4.26Å; I205-Y214 HydrophobicContact CD1-CG 3.92Å; I205-Y214 HydrophobicContact CG1-CD1 4.46Å; I205-Y214 HydrophobicContact CG1-CD2 4.01Å; I205-Y214 HydrophobicContact CG1-CE2 4.23Å; I205-Y214 HydrophobicContact CG1-CG 4.14Å; I205-Y214 HydrophobicContact CG2-CD2 4.35Å; I205-Y214 HydrophobicContact CG2-CG 4.3Å; I205-L224 HydrophobicContact CD1-CD1 4.28Å
206	G	89.6	Confident	87.4	Confident	25 Å²	25	33.9 Å²	33.9	26%	0.258	19%	0.186	S	C	.	.			trans	93.2	-143.4	-171.1	0	0	0	0	0	110.9	L201 Q202 Y242	L201-G206 PolarHBondContact O-N 2.92Å; Q202-G206 WeakPolarHBondContact CA-O 3.48Å; Q202-G206 PolarHBondContact O-N 2.98Å; Q202-G206 PolarHBondContact OE1-O 2.9Å; G206-Y242 VanDerWaalsContact O-CE2 3.29Å; G206-Y242 WeakPolarHBondContact O-CE2 3.47Å; G206-Y242 PolarHBondContact O-OH 3.48Å
207	D	91.6	Very high	86	Confident	47 Å²	47	40.4 Å²	40.4	25%	0.251	23%	0.228	S	C	.	.	S	Bend	trans	-69.5	150.3	-179.9	-77.9	-11.2	0	0	0	113.1	Q202 D209 V210 Y242 K246 G247	Q202-D207 PolarHBondContact NE2-OD1 3.13Å; D207-D209 PolarHBondContact O-N 3.35Å; D207-V210 PolarHBondContact O-N 2.88Å; D207-Y242 PolarHBondContact O-OH 3.27Å; D207-K246 HydrophobicContact CB-CG 4.24Å; D207-K246 WeakPolarHBondContact OD1-CA 3.37Å; D207-K246 WeakPolarHBondContact OD2-CG 3.23Å; D207-G247 PolarHBondContact OD1-N 3.48Å; D207-G247 PolarHBondContact OD2-N 2.66Å
208	Y	87.1	Confident	84.7	Confident	76 Å²	76	49.1 Å²	49.1	30%	0.298	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-47.7	-33.7	-178.8	171.5	-101.8	0	0	0	114.9	V210 L211 V239 Y242 K243	Y208-V210 PolarHBondContact O-N 3.17Å; Y208-V210 VanDerWaalsContact O-N 3.1Å; Y208-L211 HydrophobicContact CD2-CB 4.35Å; Y208-L211 HydrophobicContact CD2-CD2 3.94Å; Y208-L211 HydrophobicContact CE2-CD2 3.77Å; Y208-L211 WeakPolarHBondContact O-CB 3.5Å; Y208-L211 PolarHBondContact O-N 3.27Å; Y208-V239 HydrophobicContact CD2-CG1 4.37Å; Y208-V239 HydrophobicContact CE2-CG1 3.62Å; Y208-Y242 AromaticContact CD2-CD1 3.8Å; Y208-Y242 HydrophobicContact CD2-CD1 3.8Å; Y208-Y242 AromaticContact CD2-CE1 3.94Å; Y208-Y242 HydrophobicContact CD2-CE1 3.94Å; Y208-K243 HydrophobicContact CD1-CD 4.45Å; Y208-K243 HydrophobicContact CD1-CG 3.81Å; Y208-K243 HydrophobicContact CD2-CG 4.08Å; Y208-K243 HydrophobicContact CE1-CD 4.32Å; Y208-K243 HydrophobicContact CE1-CG 4.17Å; Y208-K243 HydrophobicContact CE2-CG 4.43Å; Y208-K243 HydrophobicContact CG-CG 3.75Å; Y208-K243 WeakPolarHBondContact OH-CE 3.47Å
209	D	85.7	Confident	83.6	Confident	101 Å²	101	49.9 Å²	49.9	54%	0.54	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-55.7	-28.7	179.7	-57	9.5	0	0	0	112.6	D207 K246	D207-D209 PolarHBondContact O-N 3.35Å; D209-K246 IonicContact OD1-NZ 2.72Å; D209-K246 PolarHBondContact OD1-NZ 2.81Å; D209-K246 IonicContact OD2-NZ 2.63Å; D209-K246 PolarHBondContact OD2-NZ 3.14Å
210	V	83.7	Confident	82.7	Confident	64 Å²	64	52.5 Å²	52.5	39%	0.388	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-84.4	-14.2	-179.4	-173.4	0	0	0	0	112.4	I205 D207 Y208 L212 D213 Y214	I205-V210 HydrophobicContact CG2-CB 4.09Å; I205-V210 HydrophobicContact CG2-CG1 4.06Å; D207-V210 PolarHBondContact O-N 2.88Å; Y208-V210 PolarHBondContact O-N 3.17Å; Y208-V210 VanDerWaalsContact O-N 3.1Å; V210-L212 VanDerWaalsContact C-N 3.32Å; V210-L212 PolarHBondContact O-N 2.69Å; V210-D213 PolarHBondContact O-N 3.15Å; V210-Y214 WeakPolarHBondContact O-CB 3.22Å; V210-Y214 PolarHBondContact O-N 2.72Å
211	L	82.8	Confident	82	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.052	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-38.8	-174.4	-176.5	67.7	0	0	0	113	I205 Y208 Y214 L215 L221 Y242	I205-L211 HydrophobicContact CD1-CD1 3.58Å; Y208-L211 HydrophobicContact CD2-CB 4.35Å; Y208-L211 HydrophobicContact CD2-CD2 3.94Å; Y208-L211 HydrophobicContact CE2-CD2 3.77Å; Y208-L211 WeakPolarHBondContact O-CB 3.5Å; Y208-L211 PolarHBondContact O-N 3.27Å; L211-Y214 PolarHBondContact O-N 3.17Å; L211-L215 HydrophobicContact CD1-CD1 3.85Å; L211-L215 HydrophobicContact CD1-CG 4.07Å; L211-L215 HydrophobicContact CD2-CD1 4.26Å; L211-L215 HydrophobicContact CG-CD1 3.78Å; L211-L215 HydrophobicContact CG-CG 4.31Å; L211-L215 WeakPolarHBondContact O-CB 3.45Å; L211-L215 WeakPolarHBondContact O-CG 3.44Å; L211-L215 PolarHBondContact O-N 3.1Å; L211-L221 HydrophobicContact CD1-CD2 4.06Å; L211-L221 HydrophobicContact CD2-CD2 4.25Å; L211-Y242 HydrophobicContact CB-CE1 4.15Å; L211-Y242 HydrophobicContact CD1-CE1 4.2Å; L211-Y242 HydrophobicContact CD2-CD1 4.28Å; L211-Y242 HydrophobicContact CD2-CE1 4Å; L211-Y242 HydrophobicContact CG-CE1 4.33Å
212	L	75.3	Confident	81.2	Confident	129 Å²	129	54.8 Å²	54.8	68%	0.675	31%	0.312	S	S	*	.	H	α-helix	trans	-68.8	-42.1	-176.5	-166.2	67.8	0	0	0	111.5	V210 Y214 G216	V210-L212 VanDerWaalsContact C-N 3.32Å; V210-L212 PolarHBondContact O-N 2.69Å; L212-Y214 VanDerWaalsContact C-N 3.3Å; L212-Y214 PolarHBondContact O-N 3.31Å; L212-G216 PolarHBondContact O-N 3.25Å
213	D	78.7	Confident	80.2	Confident	131 Å²	131	58.7 Å²	58.7	70%	0.701	33%	0.333	S	S	*	.	H	α-helix	trans	-66.5	-32	174.3	-72	-8.8	0	0	0	112.1	V210	V210-D213 PolarHBondContact O-N 3.15Å
214	Y	77.8	Confident	79.3	Confident	42 Å²	42	59.7 Å²	59.7	17%	0.165	34%	0.338	C	S	.	.	H	α-helix	trans	-72.3	-48	177.4	-177.2	-75.5	0	0	0	112.2	I205 V210 L211 L212 L224 R419	I205-Y214 HydrophobicContact CD1-CD1 3.86Å; I205-Y214 HydrophobicContact CD1-CD2 4.28Å; I205-Y214 HydrophobicContact CD1-CE1 4.26Å; I205-Y214 HydrophobicContact CD1-CG 3.92Å; I205-Y214 HydrophobicContact CG1-CD1 4.46Å; I205-Y214 HydrophobicContact CG1-CD2 4.01Å; I205-Y214 HydrophobicContact CG1-CE2 4.23Å; I205-Y214 HydrophobicContact CG1-CG 4.14Å; I205-Y214 HydrophobicContact CG2-CD2 4.35Å; I205-Y214 HydrophobicContact CG2-CG 4.3Å; V210-Y214 WeakPolarHBondContact O-CB 3.22Å; V210-Y214 PolarHBondContact O-N 2.72Å; L211-Y214 PolarHBondContact O-N 3.17Å; L212-Y214 VanDerWaalsContact C-N 3.3Å; L212-Y214 PolarHBondContact O-N 3.31Å; Y214-L224 HydrophobicContact CD1-CD2 4.11Å; Y214-L224 HydrophobicContact CE1-CD2 3.44Å; Y214-L224 VanDerWaalsContact CE1-CD2 3.44Å; Y214-R419 HydrophobicContact CE2-CB 3.91Å; Y214-R419 WeakPolarHBondContact OH-CD 3.45Å; Y214-R419 PolarHBondContact OH-NE 3.3Å
215	L	78.5	Confident	78.6	Confident	17 Å²	17	65.8 Å²	65.8	9%	0.089	36%	0.364	C	S	.	.	H	α-helix	trans	-73.4	-39.7	-177.3	-73.4	175.5	0	0	0	112.2	L211 T220 L221 L224 R421	L211-L215 HydrophobicContact CD1-CD1 3.85Å; L211-L215 HydrophobicContact CD1-CG 4.07Å; L211-L215 HydrophobicContact CD2-CD1 4.26Å; L211-L215 HydrophobicContact CG-CD1 3.78Å; L211-L215 HydrophobicContact CG-CG 4.31Å; L211-L215 WeakPolarHBondContact O-CB 3.45Å; L211-L215 WeakPolarHBondContact O-CG 3.44Å; L211-L215 PolarHBondContact O-N 3.1Å; L215-T220 WeakPolarHBondContact CD2-O 3.33Å; L215-L221 HydrophobicContact CD1-CD2 4.31Å; L215-L224 HydrophobicContact CD2-CD1 4.23Å; L215-L224 HydrophobicContact CD2-CD2 3.83Å; L215-L224 HydrophobicContact CD2-CG 4.06Å; L215-R421 PolarHBondContact O-NH1 3.31Å
216	G	74.8	Confident	78	Confident	23 Å²	23	65.2 Å²	65.2	24%	0.237	36%	0.361	C	S	.	.			trans	82.9	170.3	-164	0	0	0	0	0	112.2	L212 E218 G219	L212-G216 PolarHBondContact O-N 3.25Å; G216-E218 PolarHBondContact O-N 2.99Å; G216-E218 VanDerWaalsContact O-N 3.07Å; G216-G219 PolarHBondContact O-N 3.49Å; G216-G219 VanDerWaalsContact O-N 3.15Å
217	P	65.5	Low	77.5	Confident	136 Å²	136	65.3 Å²	65.3	88%	0.883	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-16.1	-168.6	25.5	-35.5	0	0	0	115.5
218	E	66.7	Low	76.6	Confident	183 Å²	183	65.9 Å²	65.9	86%	0.855	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	3.5	178.3	-58.4	-171.9	154.4	0	0	113.2	G216	G216-E218 PolarHBondContact O-N 2.99Å; G216-E218 VanDerWaalsContact O-N 3.07Å
219	G	70.6	Confident	75.9	Confident	17 Å²	17	68.9 Å²	68.9	18%	0.175	39%	0.387	C	S	.	.			trans	-78.2	141.8	-176.7	0	0	0	0	0	112.7	G216	G216-G219 PolarHBondContact O-N 3.49Å; G216-G219 VanDerWaalsContact O-N 3.15Å
220	T	75.6	Confident	75.7	Confident	54 Å²	54	65.4 Å²	65.4	33%	0.331	37%	0.368	S	S	.	.			trans	-116.1	160.1	-179.9	63.9	0	0	0	0	111.4	L215 A222 D223	L215-T220 WeakPolarHBondContact CD2-O 3.33Å; T220-A222 PolarHBondContact O-N 3.11Å; T220-A222 VanDerWaalsContact O-N 3.15Å; T220-D223 PolarHBondContact N-OD2 2.86Å; T220-D223 WeakPolarHBondContact O-CB 3.47Å; T220-D223 PolarHBondContact O-N 2.84Å; T220-D223 VanDerWaalsContact O-N 3.09Å; T220-D223 PolarHBondContact OG1-OD2 3Å
221	L	80.9	Confident	75.8	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-61.6	-20.1	172.3	-66.4	-168.6	0	0	0	112.7	L201 L211 L215 D223 L224 I230 E235 I238 V239	L201-L221 HydrophobicContact CD1-CD1 4.09Å; L201-L221 HydrophobicContact CD1-CD2 3.96Å; L201-L221 HydrophobicContact CD2-CD2 4.07Å; L211-L221 HydrophobicContact CD1-CD2 4.06Å; L211-L221 HydrophobicContact CD2-CD2 4.25Å; L215-L221 HydrophobicContact CD1-CD2 4.31Å; L221-D223 VanDerWaalsContact C-N 3.29Å; L221-D223 PolarHBondContact O-N 3.34Å; L221-L224 HydrophobicContact CD2-CD1 3.62Å; L221-L224 WeakPolarHBondContact O-CB 3.32Å; L221-L224 PolarHBondContact O-N 3.13Å; L221-I230 HydrophobicContact CB-CG2 4.44Å; L221-E235 HydrophobicContact CB-CG 4.21Å; L221-E235 WeakPolarHBondContact CB-OE1 3.23Å; L221-E235 HydrophobicContact CD1-CB 4.49Å; L221-E235 HydrophobicContact CD1-CG 3.98Å; L221-E235 HydrophobicContact CG-CG 3.98Å; L221-E235 PolarHBondContact N-OE1 3.37Å; L221-I238 HydrophobicContact CD1-CB 4.03Å; L221-I238 HydrophobicContact CD1-CG2 3.69Å; L221-V239 HydrophobicContact CD1-CG2 4Å
222	A	74.9	Confident	75.8	Confident	53 Å²	53	69.6 Å²	69.6	44%	0.438	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-63.9	-33.1	174	0	0	0	0	0	112.6	T220 L224 K225	T220-A222 PolarHBondContact O-N 3.11Å; T220-A222 VanDerWaalsContact O-N 3.15Å; A222-L224 PolarHBondContact O-N 2.87Å; A222-K225 PolarHBondContact O-N 2.84Å
223	D	73.2	Confident	76.4	Confident	86 Å²	86	71.9 Å²	71.9	46%	0.46	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-63.3	-24.1	177.7	-66	-65.8	0	0	0	112.9	T220 L221 K225	T220-D223 PolarHBondContact N-OD2 2.86Å; T220-D223 WeakPolarHBondContact O-CB 3.47Å; T220-D223 PolarHBondContact O-N 2.84Å; T220-D223 VanDerWaalsContact O-N 3.09Å; T220-D223 PolarHBondContact OG1-OD2 3Å; L221-D223 VanDerWaalsContact C-N 3.29Å; L221-D223 PolarHBondContact O-N 3.34Å; D223-K225 VanDerWaalsContact C-N 3.27Å; D223-K225 PolarHBondContact O-N 3.17Å
224	L	75.1	Confident	76.9	Confident	25 Å²	25	66.7 Å²	66.7	13%	0.131	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-78.4	-5.8	-175.7	-54.8	-177.2	0	0	0	114.2	L201 I205 Y214 L215 L221 A222 M226	L201-L224 HydrophobicContact CD2-CD1 3.43Å; L201-L224 VanDerWaalsContact CD2-CD1 3.43Å; I205-L224 HydrophobicContact CD1-CD1 4.28Å; Y214-L224 HydrophobicContact CD1-CD2 4.11Å; Y214-L224 HydrophobicContact CE1-CD2 3.44Å; Y214-L224 VanDerWaalsContact CE1-CD2 3.44Å; L215-L224 HydrophobicContact CD2-CD1 4.23Å; L215-L224 HydrophobicContact CD2-CD2 3.83Å; L215-L224 HydrophobicContact CD2-CG 4.06Å; L221-L224 HydrophobicContact CD2-CD1 3.62Å; L221-L224 WeakPolarHBondContact O-CB 3.32Å; L221-L224 PolarHBondContact O-N 3.13Å; A222-L224 PolarHBondContact O-N 2.87Å; L224-M226 VanDerWaalsContact C-N 3.29Å; L224-M226 HydrophobicContact CB-CG 3.76Å; L224-M226 HydrophobicContact CB-SD 3.91Å; L224-M226 HydrophobicContact CD1-SD 4.02Å; L224-M226 PolarHBondContact O-N 2.92Å
225	K	74.5	Confident	77.5	Confident	149 Å²	149	66.8 Å²	66.8	65%	0.648	38%	0.375	S	S	*	.			trans	50.7	44.3	176.4	-61.2	177.6	-175.9	172	0	113.5	H182 A222 D223	H182-K225 PolarHBondContact CD2-O 2.82Å; A222-K225 PolarHBondContact O-N 2.84Å; D223-K225 VanDerWaalsContact C-N 3.27Å; D223-K225 PolarHBondContact O-N 3.17Å
226	M	76.5	Confident	78	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.005	40%	0.398	C	S	.	.	S	Bend	trans	-78	-50.3	-175.3	-57.5	162.7	74.3	0	0	111.4	H182 A197 I200 L201 L224 I230	H182-M226 WeakPolarHBondContact CA-O 3.42Å; A197-M226 HydrophobicContact CB-CE 3.64Å; A197-M226 WeakPolarHBondContact O-CE 3.18Å; I200-M226 HydrophobicContact CB-CE 4.09Å; I200-M226 HydrophobicContact CG2-CE 4.12Å; I200-M226 HydrophobicContact CG2-CG 4.42Å; L201-M226 HydrophobicContact CD1-CE 4.21Å; L201-M226 HydrophobicContact CD2-CE 3.56Å; L201-M226 HydrophobicContact CD2-SD 3.75Å; L201-M226 HydrophobicContact CG-CE 3.55Å; L201-M226 HydrophobicContact CG-SD 4.34Å; L224-M226 VanDerWaalsContact C-N 3.29Å; L224-M226 HydrophobicContact CB-CG 3.76Å; L224-M226 HydrophobicContact CB-SD 3.91Å; L224-M226 HydrophobicContact CD1-SD 4.02Å; L224-M226 PolarHBondContact O-N 2.92Å; M226-I230 HydrophobicContact CB-CD1 4.4Å
227	F	77.9	Confident	78.9	Confident	27 Å²	27	74.3 Å²	74.3	12%	0.118	41%	0.411	C	S	.	.	S	Bend	trans	-155.4	167.2	171.3	68	-78.9	0	0	0	109.8	L181 M193 A197 I230 T234 I238	L181-F227 HydrophobicContact CD2-CB 4.47Å; L181-F227 HydrophobicContact CG-CB 4.17Å; M193-F227 HydrophobicContact CE-CD2 4.39Å; A197-F227 HydrophobicContact CB-CD1 4.15Å; A197-F227 HydrophobicContact CB-CE1 3.69Å; F227-I230 HydrophobicContact CD1-CD1 4.19Å; F227-I230 HydrophobicContact CD1-CG1 4.19Å; F227-I230 HydrophobicContact CE1-CD1 4.02Å; F227-I230 HydrophobicContact CE1-CG1 3.81Å; F227-I230 HydrophobicContact CE2-CG1 4.23Å; F227-I230 HydrophobicContact CZ-CG1 3.85Å; F227-T234 HydrophobicContact CE2-CG2 4.36Å; F227-T234 HydrophobicContact CZ-CG2 3.76Å; F227-I238 HydrophobicContact CE1-CD1 3.75Å; F227-I238 HydrophobicContact CZ-CD1 3.93Å
228	A	73.7	Confident	80.1	Confident	59 Å²	59	67.8 Å²	67.8	49%	0.488	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	154.4	-179	0	0	0	0	0	112.4
229	N	72.1	Confident	81.3	Confident	139 Å²	139	60.3 Å²	60.3	74%	0.743	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	35.4	170.6	-47.3	-20.3	0	0	0	115.7	T231	N229-T231 PolarHBondContact O-N 3.27Å; N229-T231 VanDerWaalsContact O-N 3.09Å
230	I	81.9	Confident	82.4	Confident	27 Å²	27	66.1 Å²	66.1	14%	0.138	36%	0.358	C	S	.	.			trans	-64.6	109.8	167.5	-60.7	175.2	0	0	0	108.9	L221 M226 F227 T234 E235	L221-I230 HydrophobicContact CB-CG2 4.44Å; M226-I230 HydrophobicContact CB-CD1 4.4Å; F227-I230 HydrophobicContact CD1-CD1 4.19Å; F227-I230 HydrophobicContact CD1-CG1 4.19Å; F227-I230 HydrophobicContact CE1-CD1 4.02Å; F227-I230 HydrophobicContact CE1-CG1 3.81Å; F227-I230 HydrophobicContact CE2-CG1 4.23Å; F227-I230 HydrophobicContact CZ-CG1 3.85Å; I230-T234 HydrophobicContact CG2-CG2 4.32Å; I230-E235 HydrophobicContact CG2-CB 3.98Å
231	T	84.6	Confident	83.3	Confident	62 Å²	62	65 Å²	65	38%	0.38	35%	0.35	S	S	.	.			trans	-92.1	163.5	171	74.1	0	0	0	0	111	N229 K233 T234 E235	N229-T231 PolarHBondContact O-N 3.27Å; N229-T231 VanDerWaalsContact O-N 3.09Å; T231-K233 PolarHBondContact O-N 3.19Å; T231-K233 PolarHBondContact OG1-N 3.44Å; T231-T234 CarbonylContact O-C 3.59Å; T231-T234 WeakPolarHBondContact O-CA 3.48Å; T231-T234 VanDerWaalsContact O-CB 3.25Å; T231-T234 WeakPolarHBondContact O-CB 3.36Å; T231-T234 PolarHBondContact O-N 3.14Å; T231-T234 WeakPolarHBondContact OG1-CB 3.45Å; T231-T234 PolarHBondContact OG1-N 2.79Å; T231-T234 VanDerWaalsContact OG1-N 3.09Å; T231-T234 PolarHBondContact OG1-OG1 3.36Å; T231-E235 WeakPolarHBondContact O-CB 3.46Å; T231-E235 PolarHBondContact O-N 2.84Å
232	P	84	Confident	83.9	Confident	100 Å²	100	65 Å²	65	65%	0.649	35%	0.35	S	S	*	.	H	α-helix	trans	-58.2	-29.7	174	-27.3	36.2	0	0	0	114.2	S236	P232-S236 WeakPolarHBondContact O-CB 3.37Å; P232-S236 PolarHBondContact O-N 3.1Å; P232-S236 PolarHBondContact O-OG 3.48Å
233	K	86.9	Confident	84.7	Confident	177 Å²	177	67.3 Å²	67.3	77%	0.77	35%	0.35	S	S	*	.	H	α-helix	trans	-68.6	-44	172	-68.1	-172.9	177	-173.9	0	111.3	T231 K237	T231-K233 PolarHBondContact O-N 3.19Å; T231-K233 PolarHBondContact OG1-N 3.44Å; K233-K237 PolarHBondContact O-N 2.83Å
234	T	89.7	Confident	85.7	Confident	22 Å²	22	67.4 Å²	67.4	14%	0.135	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-49.5	175.7	-57.2	0	0	0	0	111.1	F227 I230 T231 S236 K237 I238	F227-T234 HydrophobicContact CE2-CG2 4.36Å; F227-T234 HydrophobicContact CZ-CG2 3.76Å; I230-T234 HydrophobicContact CG2-CG2 4.32Å; T231-T234 CarbonylContact O-C 3.59Å; T231-T234 WeakPolarHBondContact O-CA 3.48Å; T231-T234 VanDerWaalsContact O-CB 3.25Å; T231-T234 WeakPolarHBondContact O-CB 3.36Å; T231-T234 PolarHBondContact O-N 3.14Å; T231-T234 WeakPolarHBondContact OG1-CB 3.45Å; T231-T234 PolarHBondContact OG1-N 2.79Å; T231-T234 VanDerWaalsContact OG1-N 3.09Å; T231-T234 PolarHBondContact OG1-OG1 3.36Å; T234-S236 PolarHBondContact O-N 3.19Å; T234-K237 PolarHBondContact O-N 2.75Å; T234-I238 HydrophobicContact CG2-CD1 3.78Å; T234-I238 VanDerWaalsContact O-CG1 3.3Å; T234-I238 WeakPolarHBondContact O-CG1 3.29Å; T234-I238 PolarHBondContact O-N 2.75Å
235	E	89.9	Confident	86.6	Confident	44 Å²	44	66.4 Å²	66.4	21%	0.206	35%	0.352	C	S	.	.	H	α-helix	trans	-56.4	-46.7	176	170.7	163.2	-133.9	0	0	112.2	L221 I230 T231 K237 I238 V239	L221-E235 HydrophobicContact CB-CG 4.21Å; L221-E235 WeakPolarHBondContact CB-OE1 3.23Å; L221-E235 HydrophobicContact CD1-CB 4.49Å; L221-E235 HydrophobicContact CD1-CG 3.98Å; L221-E235 HydrophobicContact CG-CG 3.98Å; L221-E235 PolarHBondContact N-OE1 3.37Å; I230-E235 HydrophobicContact CG2-CB 3.98Å; T231-E235 WeakPolarHBondContact O-CB 3.46Å; T231-E235 PolarHBondContact O-N 2.84Å; E235-K237 PolarHBondContact O-N 3.02Å; E235-I238 PolarHBondContact O-N 3.05Å; E235-V239 WeakPolarHBondContact O-CG2 3.4Å; E235-V239 PolarHBondContact O-N 3.16Å
236	S	89.5	Confident	87.4	Confident	79 Å²	79	64.7 Å²	64.7	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-57	-47.1	174.9	-59.2	0	0	0	0	112.2	P232 T234 I238 V239 E240	P232-S236 WeakPolarHBondContact O-CB 3.37Å; P232-S236 PolarHBondContact O-N 3.1Å; P232-S236 PolarHBondContact O-OG 3.48Å; T234-S236 PolarHBondContact O-N 3.19Å; S236-I238 PolarHBondContact O-N 2.91Å; S236-V239 PolarHBondContact O-N 3.26Å; S236-E240 PolarHBondContact O-N 3.43Å
237	K	92.5	Very high	88.1	Confident	119 Å²	119	67.7 Å²	67.7	52%	0.517	38%	0.376	S	S	.	.	H	α-helix	trans	-65.3	-35.7	176.8	-69.5	-170.1	175.5	-167.6	0	112.4	K233 T234 E235 I241	K233-K237 PolarHBondContact O-N 2.83Å; T234-K237 PolarHBondContact O-N 2.75Å; E235-K237 PolarHBondContact O-N 3.02Å; K237-I241 WeakPolarHBondContact O-CD1 3.38Å; K237-I241 VanDerWaalsContact O-CG1 3.3Å; K237-I241 WeakPolarHBondContact O-CG1 2.92Å; K237-I241 PolarHBondContact O-N 2.94Å; K237-I241 VanDerWaalsContact O-N 3.16Å
238	I	92.7	Very high	88.9	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-66.7	-44.2	174.8	-66.6	162.5	0	0	0	110.9	H194 A197 L201 L221 F227 T234 E235 S236 E240 I241 Y242	H194-I238 HydrophobicContact CB-CG1 3.88Å; A197-I238 HydrophobicContact CB-CD1 3.92Å; A197-I238 HydrophobicContact CB-CG1 4.06Å; A197-I238 HydrophobicContact CB-CG2 4.06Å; L201-I238 HydrophobicContact CD1-CG2 3.85Å; L221-I238 HydrophobicContact CD1-CB 4.03Å; L221-I238 HydrophobicContact CD1-CG2 3.69Å; F227-I238 HydrophobicContact CE1-CD1 3.75Å; F227-I238 HydrophobicContact CZ-CD1 3.93Å; T234-I238 HydrophobicContact CG2-CD1 3.78Å; T234-I238 VanDerWaalsContact O-CG1 3.3Å; T234-I238 WeakPolarHBondContact O-CG1 3.29Å; T234-I238 PolarHBondContact O-N 2.75Å; E235-I238 PolarHBondContact O-N 3.05Å; S236-I238 PolarHBondContact O-N 2.91Å; I238-E240 VanDerWaalsContact C-N 3.33Å; I238-E240 PolarHBondContact O-N 3.36Å; I238-I241 PolarHBondContact O-N 3.17Å; I238-Y242 WeakPolarHBondContact O-CB 3.32Å; I238-Y242 PolarHBondContact O-N 3.35Å
239	V	91.3	Very high	89.7	Confident	26 Å²	26	68.7 Å²	68.7	16%	0.158	38%	0.377	C	S	.	.	H	α-helix	trans	-62.8	-39.3	178.2	165.7	0	0	0	0	111.7	Y208 L221 E235 S236 Y242 K243	Y208-V239 HydrophobicContact CD2-CG1 4.37Å; Y208-V239 HydrophobicContact CE2-CG1 3.62Å; L221-V239 HydrophobicContact CD1-CG2 4Å; E235-V239 WeakPolarHBondContact O-CG2 3.4Å; E235-V239 PolarHBondContact O-N 3.16Å; S236-V239 PolarHBondContact O-N 3.26Å; V239-Y242 PolarHBondContact O-N 3.43Å; V239-K243 HydrophobicContact CG1-CD 4.26Å; V239-K243 VanDerWaalsContact O-CG 3.32Å; V239-K243 WeakPolarHBondContact O-CG 3.31Å; V239-K243 PolarHBondContact O-N 3.46Å
240	E	93.2	Very high	90.7	Very high	139 Å²	139	63.9 Å²	63.9	65%	0.65	35%	0.35	S	S	*	.	H	α-helix	trans	-61.6	-50.4	174.5	-177	175.5	-161.6	0	0	111.9	S236 I238 Y242 K243 S244	S236-E240 PolarHBondContact O-N 3.43Å; I238-E240 VanDerWaalsContact C-N 3.33Å; I238-E240 PolarHBondContact O-N 3.36Å; E240-Y242 VanDerWaalsContact C-N 3.33Å; E240-Y242 PolarHBondContact O-N 2.82Å; E240-K243 PolarHBondContact O-N 2.79Å; E240-S244 PolarHBondContact O-N 3.38Å
241	I	94.1	Very high	91.1	Very high	30 Å²	30	64 Å²	64	15%	0.154	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-41.1	176.8	-62	162.6	0	0	0	110.5	L191 H194 V195 A198 K237 I238 K243 S244	L191-I241 HydrophobicContact CD1-CD1 4.06Å; H194-I241 HydrophobicContact CB-CD1 3.68Å; V195-I241 HydrophobicContact CG2-CD1 4.12Å; V195-I241 HydrophobicContact CG2-CG2 4.19Å; A198-I241 HydrophobicContact CB-CB 3.96Å; A198-I241 HydrophobicContact CB-CG2 3.57Å; K237-I241 WeakPolarHBondContact O-CD1 3.38Å; K237-I241 VanDerWaalsContact O-CG1 3.3Å; K237-I241 WeakPolarHBondContact O-CG1 2.92Å; K237-I241 PolarHBondContact O-N 2.94Å; K237-I241 VanDerWaalsContact O-N 3.16Å; I238-I241 PolarHBondContact O-N 3.17Å; I241-K243 PolarHBondContact O-N 2.79Å; I241-S244 WeakPolarHBondContact O-CB 3.48Å; I241-S244 PolarHBondContact O-N 3.42Å; I241-S244 PolarHBondContact O-OG 3.3Å
242	Y	93.5	Very high	91.6	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-40.5	179.3	178.3	-150.6	0	0	0	112.2	L201 Q202 G206 D207 Y208 L211 I238 V239 E240 S244 L245	L201-Y242 HydrophobicContact CB-CD1 3.89Å; L201-Y242 HydrophobicContact CB-CD2 3.87Å; L201-Y242 HydrophobicContact CB-CE1 3.69Å; L201-Y242 HydrophobicContact CB-CE2 3.69Å; L201-Y242 HydrophobicContact CB-CG 3.98Å; L201-Y242 HydrophobicContact CD1-CD1 3.43Å; L201-Y242 VanDerWaalsContact CD1-CD1 3.43Å; L201-Y242 HydrophobicContact CD1-CE1 3.85Å; L201-Y242 HydrophobicContact CD1-CG 3.87Å; L201-Y242 HydrophobicContact CG-CD1 4.29Å; L201-Y242 HydrophobicContact CG-CE1 4.34Å; Q202-Y242 HydrophobicContact CB-CD2 4.35Å; Q202-Y242 HydrophobicContact CB-CE2 4.08Å; G206-Y242 VanDerWaalsContact O-CE2 3.29Å; G206-Y242 WeakPolarHBondContact O-CE2 3.47Å; G206-Y242 PolarHBondContact O-OH 3.48Å; D207-Y242 PolarHBondContact O-OH 3.27Å; Y208-Y242 AromaticContact CD2-CD1 3.8Å; Y208-Y242 HydrophobicContact CD2-CD1 3.8Å; Y208-Y242 AromaticContact CD2-CE1 3.94Å; Y208-Y242 HydrophobicContact CD2-CE1 3.94Å; L211-Y242 HydrophobicContact CB-CE1 4.15Å; L211-Y242 HydrophobicContact CD1-CE1 4.2Å; L211-Y242 HydrophobicContact CD2-CD1 4.28Å; L211-Y242 HydrophobicContact CD2-CE1 4Å; L211-Y242 HydrophobicContact CG-CE1 4.33Å; I238-Y242 WeakPolarHBondContact O-CB 3.32Å; I238-Y242 PolarHBondContact O-N 3.35Å; V239-Y242 PolarHBondContact O-N 3.43Å; E240-Y242 VanDerWaalsContact C-N 3.33Å; E240-Y242 PolarHBondContact O-N 2.82Å; Y242-S244 PolarHBondContact O-N 3.06Å; Y242-L245 WeakPolarHBondContact O-CB 3.48Å; Y242-L245 PolarHBondContact O-N 3.25Å
243	K	93.1	Very high	92.2	Very high	103 Å²	103	60.2 Å²	60.2	45%	0.448	32%	0.323	S	S	.	.	H	α-helix	trans	-57.6	-31.7	172	-74.4	165	179.1	174.8	0	113	Y208 V239 E240 I241 L245	Y208-K243 HydrophobicContact CD1-CD 4.45Å; Y208-K243 HydrophobicContact CD1-CG 3.81Å; Y208-K243 HydrophobicContact CD2-CG 4.08Å; Y208-K243 HydrophobicContact CE1-CD 4.32Å; Y208-K243 HydrophobicContact CE1-CG 4.17Å; Y208-K243 HydrophobicContact CE2-CG 4.43Å; Y208-K243 HydrophobicContact CG-CG 3.75Å; Y208-K243 WeakPolarHBondContact OH-CE 3.47Å; V239-K243 HydrophobicContact CG1-CD 4.26Å; V239-K243 VanDerWaalsContact O-CG 3.32Å; V239-K243 WeakPolarHBondContact O-CG 3.31Å; V239-K243 PolarHBondContact O-N 3.46Å; E240-K243 PolarHBondContact O-N 2.79Å; I241-K243 PolarHBondContact O-N 2.79Å; K243-L245 VanDerWaalsContact C-N 3.25Å; K243-L245 PolarHBondContact O-N 3.04Å
244	S	94	Very high	92.6	Very high	88 Å²	88	52.1 Å²	52.1	62%	0.615	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.8	175.7	82.3	0	0	0	0	114.6	E240 I241 Y242	E240-S244 PolarHBondContact O-N 3.38Å; I241-S244 WeakPolarHBondContact O-CB 3.48Å; I241-S244 PolarHBondContact O-N 3.42Å; I241-S244 PolarHBondContact O-OG 3.3Å; Y242-S244 PolarHBondContact O-N 3.06Å
245	L	92.8	Very high	92.9	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.016	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-0.2	178.8	-54.8	-176.7	0	0	0	113.6	A198 Q202 Y242 K243 G247 M248 K256	A198-L245 HydrophobicContact CB-CD1 3.9Å; A198-L245 WeakPolarHBondContact O-CD1 3.37Å; Q202-L245 HydrophobicContact CB-CB 4.28Å; Q202-L245 HydrophobicContact CB-CD1 4.03Å; Q202-L245 HydrophobicContact CG-CB 4.03Å; Q202-L245 PolarHBondContact NE2-O 3.18Å; Q202-L245 PolarHBondContact OE1-O 3.34Å; Y242-L245 WeakPolarHBondContact O-CB 3.48Å; Y242-L245 PolarHBondContact O-N 3.25Å; K243-L245 VanDerWaalsContact C-N 3.25Å; K243-L245 PolarHBondContact O-N 3.04Å; L245-G247 PolarHBondContact O-N 2.92Å; L245-M248 HydrophobicContact CD2-CE 4.36Å; L245-M248 HydrophobicContact CD2-SD 4.37Å; L245-M248 WeakPolarHBondContact O-CB 3.29Å; L245-M248 PolarHBondContact O-N 3.3Å; L245-K256 HydrophobicContact CD2-CD 4.25Å
246	K	92.3	Very high	93.1	Very high	113 Å²	113	53.2 Å²	53.2	49%	0.491	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	131.5	-174.7	-169.9	168.7	-172.9	161.7	0	112.7	D207 D209 M248	D207-K246 HydrophobicContact CB-CG 4.24Å; D207-K246 WeakPolarHBondContact OD1-CA 3.37Å; D207-K246 WeakPolarHBondContact OD2-CG 3.23Å; D209-K246 IonicContact OD1-NZ 2.72Å; D209-K246 PolarHBondContact OD1-NZ 2.81Å; D209-K246 IonicContact OD2-NZ 2.63Å; D209-K246 PolarHBondContact OD2-NZ 3.14Å; K246-M248 VanDerWaalsContact C-N 3.32Å
247	G	91	Very high	93.5	Very high	64 Å²	64	49.5 Å²	49.5	66%	0.66	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	-2.4	-175.9	0	0	0	0	0	115.1	D207 L245	D207-G247 PolarHBondContact OD1-N 3.48Å; D207-G247 PolarHBondContact OD2-N 2.66Å; L245-G247 PolarHBondContact O-N 2.92Å
248	M	93.4	Very high	93.7	Very high	56 Å²	56	43.8 Å²	43.8	28%	0.276	24%	0.241	S	C	.	.			trans	-73.1	130.7	174.1	-175.5	167.7	-70.4	0	0	110.6	Q202 L245 K246 D252 A253 K256	Q202-M248 HydrophobicContact CG-CB 4.06Å; Q202-M248 PolarHBondContact NE2-O 3.48Å; L245-M248 HydrophobicContact CD2-CE 4.36Å; L245-M248 HydrophobicContact CD2-SD 4.37Å; L245-M248 WeakPolarHBondContact O-CB 3.29Å; L245-M248 PolarHBondContact O-N 3.3Å; K246-M248 VanDerWaalsContact C-N 3.32Å; M248-D252 HydrophobicContact CG-CB 3.78Å; M248-A253 HydrophobicContact CG-CB 4.29Å; M248-A253 HydrophobicContact SD-CB 4.26Å; M248-K256 HydrophobicContact CE-CD 3.85Å; M248-K256 HydrophobicContact SD-CB 4.47Å; M248-K256 HydrophobicContact SD-CD 3.82Å
249	S	92	Very high	93.9	Very high	51 Å²	51	48 Å²	48	36%	0.357	26%	0.261	S	S	.	.			trans	-69.6	154.8	178.3	91.1	0	0	0	0	111.4	N251 D252 A253	S249-N251 VanDerWaalsContact C-N 3.25Å; S249-N251 PolarHBondContact O-N 2.78Å; S249-N251 PolarHBondContact OG-N 3.48Å; S249-D252 WeakPolarHBondContact CB-OD2 3.04Å; S249-D252 PolarHBondContact O-N 2.95Å; S249-D252 VanDerWaalsContact OG-CG 3.24Å; S249-D252 PolarHBondContact OG-N 3.44Å; S249-D252 PolarHBondContact OG-OD2 2.82Å; S249-A253 PolarHBondContact O-N 3.4Å
250	M	92	Very high	94.1	Very high	38 Å²	38	48.4 Å²	48.4	19%	0.187	26%	0.262	C	S	.	.	H	α-helix	trans	-48.3	-48.4	174.4	179.4	170.4	-64	0	0	112.2	A203 D252 A253 E254 S412	A203-M250 WeakPolarHBondContact O-CE 3.26Å; M250-D252 VanDerWaalsContact C-N 3.28Å; M250-D252 PolarHBondContact O-N 3.44Å; M250-A253 PolarHBondContact O-N 3.46Å; M250-E254 WeakPolarHBondContact O-CG 3.46Å; M250-E254 PolarHBondContact O-N 2.97Å; M250-S412 WeakPolarHBondContact CE-OG 3.41Å
251	N	91.7	Very high	94.2	Very high	31 Å²	31	41.8 Å²	41.8	17%	0.166	23%	0.231	C	C	.	.	H	α-helix	trans	-63.9	-33.9	-179.1	-61.1	26.7	0	0	0	111.8	E167 S249 N255 S408	E167-N251 PolarHBondContact OE1-ND2 2.78Å; E167-N251 PolarHBondContact OE2-ND2 3.32Å; S249-N251 VanDerWaalsContact C-N 3.25Å; S249-N251 PolarHBondContact O-N 2.78Å; S249-N251 PolarHBondContact OG-N 3.48Å; N251-N255 PolarHBondContact O-N 2.9Å; N251-N255 PolarHBondContact O-ND2 3.43Å; N251-N255 PolarHBondContact O-OD1 3.21Å; N251-S408 WeakPolarHBondContact OD1-CB 3.4Å; N251-S408 PolarHBondContact OD1-OG 3.44Å
252	D	94.7	Very high	94.2	Very high	81 Å²	81	41.3 Å²	41.3	43%	0.433	23%	0.231	S	C	.	.	H	α-helix	trans	-80.1	-34	178.7	-58.4	-49.4	0	0	0	112.1	M248 S249 M250 N255 K256	M248-D252 HydrophobicContact CG-CB 3.78Å; S249-D252 WeakPolarHBondContact CB-OD2 3.04Å; S249-D252 PolarHBondContact O-N 2.95Å; S249-D252 VanDerWaalsContact OG-CG 3.24Å; S249-D252 PolarHBondContact OG-N 3.44Å; S249-D252 PolarHBondContact OG-OD2 2.82Å; M250-D252 VanDerWaalsContact C-N 3.28Å; M250-D252 PolarHBondContact O-N 3.44Å; D252-N255 PolarHBondContact O-N 2.75Å; D252-K256 VanDerWaalsContact O-CB 3.24Å; D252-K256 WeakPolarHBondContact O-CB 3.49Å; D252-K256 PolarHBondContact O-N 2.74Å
253	A	95.4	Very high	94.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.6	-40.5	170.3	0	0	0	0	0	111.4	Q202 A203 M248 S249 M250 F257	Q202-A253 HydrophobicContact CB-CB 3.9Å; Q202-A253 HydrophobicContact CG-CB 3.85Å; A203-A253 HydrophobicContact CB-CB 4.15Å; M248-A253 HydrophobicContact CG-CB 4.29Å; M248-A253 HydrophobicContact SD-CB 4.26Å; S249-A253 PolarHBondContact O-N 3.4Å; M250-A253 PolarHBondContact O-N 3.46Å; A253-F257 WeakPolarHBondContact O-CB 3.17Å; A253-F257 PolarHBondContact O-N 2.89Å
254	E	95.3	Very high	94.2	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-48.8	170.1	-74.4	177.7	-152.5	0	0	112	Y171 Y174 A203 M250 K256 F257 L258	Y171-E254 WeakPolarHBondContact CD2-OE1 3.4Å; Y171-E254 WeakPolarHBondContact CD2-OE2 3.21Å; Y174-E254 HydrophobicContact CD1-CG 4.1Å; Y174-E254 HydrophobicContact CD2-CG 4.31Å; Y174-E254 HydrophobicContact CE1-CG 4.47Å; Y174-E254 HydrophobicContact CG-CG 4.04Å; A203-E254 HydrophobicContact CB-CG 4.28Å; M250-E254 WeakPolarHBondContact O-CG 3.46Å; M250-E254 PolarHBondContact O-N 2.97Å; E254-K256 PolarHBondContact O-N 2.99Å; E254-F257 WeakPolarHBondContact O-CB 3.37Å; E254-F257 PolarHBondContact O-N 2.93Å; E254-L258 VanDerWaalsContact O-CG 3.29Å; E254-L258 WeakPolarHBondContact O-CG 3.2Å; E254-L258 PolarHBondContact O-N 3.21Å
255	N	95.9	Very high	93.9	Very high	24 Å²	24	44.1 Å²	44.1	13%	0.128	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-46.4	176.9	-65.8	-31.7	0	0	0	111	V161 R170 N251 D252 F257 L258 E259	V161-N255 HydrophobicContact CG2-CB 4.1Å; R170-N255 PolarHBondContact NE-OD1 2.9Å; N251-N255 PolarHBondContact O-N 2.9Å; N251-N255 PolarHBondContact O-ND2 3.43Å; N251-N255 PolarHBondContact O-OD1 3.21Å; D252-N255 PolarHBondContact O-N 2.75Å; N255-F257 VanDerWaalsContact C-N 3.33Å; N255-F257 PolarHBondContact O-N 3.16Å; N255-L258 WeakPolarHBondContact O-CB 3.37Å; N255-L258 PolarHBondContact O-N 3.13Å; N255-L258 VanDerWaalsContact O-N 3.11Å; N255-E259 WeakPolarHBondContact O-CG 3.35Å; N255-E259 PolarHBondContact O-N 2.99Å
256	K	95.9	Very high	93.8	Very high	65 Å²	65	44.9 Å²	44.9	28%	0.283	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-34.2	177.3	-174.9	173.1	180	174.4	0	112.6	L245 M248 D252 E254 N260	L245-K256 HydrophobicContact CD2-CD 4.25Å; M248-K256 HydrophobicContact CE-CD 3.85Å; M248-K256 HydrophobicContact SD-CB 4.47Å; M248-K256 HydrophobicContact SD-CD 3.82Å; D252-K256 VanDerWaalsContact O-CB 3.24Å; D252-K256 WeakPolarHBondContact O-CB 3.49Å; D252-K256 PolarHBondContact O-N 2.74Å; E254-K256 PolarHBondContact O-N 2.99Å; K256-N260 PolarHBondContact O-N 2.81Å; K256-N260 PolarHBondContact O-ND2 3.01Å
257	F	97	Very high	93.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.3	-48.9	169.9	179.3	-79.1	0	0	0	110.6	Y174 L177 L181 L196 C199 I200 A253 E254 N255 N260 A261	Y174-F257 HydrophobicContact CD2-CB 4.22Å; Y174-F257 AromaticContact CD2-CD1 3.59Å; Y174-F257 HydrophobicContact CD2-CD1 3.59Å; Y174-F257 HydrophobicContact CD2-CD2 4.38Å; Y174-F257 HydrophobicContact CD2-CE1 4.02Å; Y174-F257 AromaticContact CD2-CG 3.8Å; Y174-F257 HydrophobicContact CD2-CG 3.8Å; Y174-F257 HydrophobicContact CE2-CB 4.38Å; Y174-F257 HydrophobicContact CE2-CD1 4.1Å; Y174-F257 HydrophobicContact CE2-CD2 4.06Å; Y174-F257 HydrophobicContact CE2-CE1 4.43Å; Y174-F257 HydrophobicContact CE2-CE2 4.39Å; Y174-F257 AromaticContact CE2-CG 3.92Å; Y174-F257 HydrophobicContact CE2-CG 3.92Å; L177-F257 HydrophobicContact CB-CE1 3.71Å; L177-F257 HydrophobicContact CB-CZ 4.35Å; L181-F257 HydrophobicContact CD2-CE2 4.35Å; L196-F257 HydrophobicContact CB-CD2 4.02Å; L196-F257 HydrophobicContact CB-CE2 3.74Å; L196-F257 HydrophobicContact CD1-CE2 4.34Å; L196-F257 HydrophobicContact CD1-CZ 4.43Å; L196-F257 HydrophobicContact CD2-CD1 4.5Å; L196-F257 HydrophobicContact CD2-CD2 3.74Å; L196-F257 HydrophobicContact CD2-CE2 3.95Å; L196-F257 HydrophobicContact CD2-CG 4.03Å; L196-F257 HydrophobicContact CD2-CZ 4.41Å; L196-F257 WeakPolarHBondContact CD2-O 3.46Å; L196-F257 HydrophobicContact CG-CD2 4.41Å; L196-F257 HydrophobicContact CG-CE2 4.22Å; L196-F257 WeakPolarHBondContact O-CD2 3.42Å; C199-F257 HydrophobicContact CB-CB 3.92Å; C199-F257 HydrophobicContact CB-CD2 4.26Å; I200-F257 HydrophobicContact CD1-CD2 4.39Å; I200-F257 HydrophobicContact CD1-CE2 3.67Å; I200-F257 HydrophobicContact CD1-CZ 4.48Å; I200-F257 HydrophobicContact CG1-CD2 3.92Å; I200-F257 HydrophobicContact CG1-CE2 3.69Å; A253-F257 WeakPolarHBondContact O-CB 3.17Å; A253-F257 PolarHBondContact O-N 2.89Å; E254-F257 WeakPolarHBondContact O-CB 3.37Å; E254-F257 PolarHBondContact O-N 2.93Å; N255-F257 VanDerWaalsContact C-N 3.33Å; N255-F257 PolarHBondContact O-N 3.16Å; F257-N260 PolarHBondContact O-N 3.15Å; F257-A261 HydrophobicContact CD1-CB 4.36Å; F257-A261 HydrophobicContact CE1-CB 4.1Å; F257-A261 VanDerWaalsContact O-CB 3.28Å; F257-A261 WeakPolarHBondContact O-CB 3.42Å; F257-A261 PolarHBondContact O-N 3.45Å
258	L	96.8	Very high	94	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-45.5	-178.7	-70	175.9	0	0	0	112.6	P160 V161 R170 L173 L177 E254 N255 N260 A261 A262	P160-L258 HydrophobicContact CB-CB 4.21Å; P160-L258 HydrophobicContact CG-CB 3.83Å; V161-L258 HydrophobicContact CG2-CB 4.41Å; R170-L258 HydrophobicContact CB-CD1 3.61Å; R170-L258 HydrophobicContact CG-CD1 4.18Å; L173-L258 HydrophobicContact CB-CD2 4.15Å; L173-L258 HydrophobicContact CD2-CD2 3.89Å; L173-L258 HydrophobicContact CG-CD2 3.74Å; L177-L258 HydrophobicContact CD1-CD2 3.71Å; E254-L258 VanDerWaalsContact O-CG 3.29Å; E254-L258 WeakPolarHBondContact O-CG 3.2Å; E254-L258 PolarHBondContact O-N 3.21Å; N255-L258 WeakPolarHBondContact O-CB 3.37Å; N255-L258 PolarHBondContact O-N 3.13Å; N255-L258 VanDerWaalsContact O-N 3.11Å; L258-N260 VanDerWaalsContact C-N 3.29Å; L258-N260 PolarHBondContact O-N 3.43Å; L258-A261 PolarHBondContact O-N 3.12Å; L258-A262 VanDerWaalsContact O-CB 3.32Å; L258-A262 WeakPolarHBondContact O-CB 3.16Å; L258-A262 PolarHBondContact O-N 2.95Å
259	E	96	Very high	93.9	Very high	89 Å²	89	34.5 Å²	34.5	42%	0.416	18%	0.175	S	C	.	.	H	α-helix	trans	-58.6	-38.9	176.5	-74.9	171.6	-159.7	0	0	112.5	V161 N255 K263	V161-E259 HydrophobicContact CG2-CG 3.79Å; N255-E259 WeakPolarHBondContact O-CG 3.35Å; N255-E259 PolarHBondContact O-N 2.99Å; E259-K263 WeakPolarHBondContact O-CE 3.5Å; E259-K263 WeakPolarHBondContact O-CG 3.48Å
260	N	95.2	Very high	93.7	Very high	34 Å²	34	33.2 Å²	33.2	18%	0.182	16%	0.164	C	C	.	.	H	α-helix	trans	-80.9	-39.4	179.9	-70.5	-52.2	0	0	0	112.1	L196 K256 F257 L258 A262 K263 F264	L196-N260 HydrophobicContact CD2-CB 3.81Å; K256-N260 PolarHBondContact O-N 2.81Å; K256-N260 PolarHBondContact O-ND2 3.01Å; F257-N260 PolarHBondContact O-N 3.15Å; L258-N260 VanDerWaalsContact C-N 3.29Å; L258-N260 PolarHBondContact O-N 3.43Å; N260-A262 VanDerWaalsContact C-N 3.28Å; N260-A262 PolarHBondContact O-N 3.35Å; N260-K263 WeakPolarHBondContact O-CB 3.49Å; N260-K263 PolarHBondContact O-N 2.74Å; N260-K263 PolarHBondContact OD1-NZ 2.73Å; N260-F264 VanDerWaalsContact O-CD1 3.31Å; N260-F264 WeakPolarHBondContact O-CD1 3.41Å; N260-F264 WeakPolarHBondContact O-CE1 3.28Å
261	A	96	Very high	93.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-33.5	175.6	0	0	0	0	0	112.5	L177 L186 L196 F257 L258 K263 F264 Y267	L177-A261 HydrophobicContact CD1-CB 4.12Å; L186-A261 HydrophobicContact CD2-CB 4Å; L196-A261 HydrophobicContact CD1-CB 4.26Å; L196-A261 HydrophobicContact CD2-CB 4.19Å; F257-A261 HydrophobicContact CD1-CB 4.36Å; F257-A261 HydrophobicContact CE1-CB 4.1Å; F257-A261 VanDerWaalsContact O-CB 3.28Å; F257-A261 WeakPolarHBondContact O-CB 3.42Å; F257-A261 PolarHBondContact O-N 3.45Å; L258-A261 PolarHBondContact O-N 3.12Å; A261-K263 PolarHBondContact O-N 2.86Å; A261-F264 PolarHBondContact O-N 3.21Å; A261-Y267 WeakPolarHBondContact O-CB 3.42Å; A261-Y267 VanDerWaalsContact O-CD2 3.28Å; A261-Y267 WeakPolarHBondContact O-CD2 3.44Å
262	A	94.8	Very high	93.6	Very high	19 Å²	19	34.6 Å²	34.6	16%	0.157	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.1	176.9	0	0	0	0	0	114.3	P160 L258 N260 F264 Y267	P160-A262 HydrophobicContact CG-CB 4Å; L258-A262 VanDerWaalsContact O-CB 3.32Å; L258-A262 WeakPolarHBondContact O-CB 3.16Å; L258-A262 PolarHBondContact O-N 2.95Å; N260-A262 VanDerWaalsContact C-N 3.28Å; N260-A262 PolarHBondContact O-N 3.35Å; A262-F264 VanDerWaalsContact C-N 3.34Å; A262-Y267 HydrophobicContact CB-CD2 4.48Å; A262-Y267 HydrophobicContact CB-CE2 4.2Å
263	K	93.3	Very high	93.6	Very high	141 Å²	141	34.7 Å²	34.7	61%	0.613	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-14.7	179.6	-62.5	164.3	-168.4	164.2	0	113.1	E259 N260 A261	E259-K263 WeakPolarHBondContact O-CE 3.5Å; E259-K263 WeakPolarHBondContact O-CG 3.48Å; N260-K263 WeakPolarHBondContact O-CB 3.49Å; N260-K263 PolarHBondContact O-N 2.74Å; N260-K263 PolarHBondContact OD1-NZ 2.73Å; A261-K263 PolarHBondContact O-N 2.86Å
264	F	92	Very high	93.6	Very high	12 Å²	12	34.7 Å²	34.7	5%	0.053	17%	0.17	C	C	.	.	S	Bend	trans	-78.3	139.9	-172.4	-70.7	17.1	0	0	0	111.2	L186 I187 E192 M193 L196 N260 A261 A262 T266 Y267	L186-F264 HydrophobicContact CD1-CB 3.98Å; L186-F264 HydrophobicContact CD1-CD2 3.63Å; L186-F264 HydrophobicContact CD1-CG 4.18Å; L186-F264 HydrophobicContact CG-CD2 3.79Å; L186-F264 HydrophobicContact CG-CE2 4.22Å; I187-F264 VanDerWaalsContact C-CD2 3.43Å; I187-F264 WeakPolarHBondContact O-CD2 3.33Å; E192-F264 HydrophobicContact CB-CE1 3.64Å; E192-F264 HydrophobicContact CB-CZ 3.64Å; E192-F264 HydrophobicContact CG-CE1 4.42Å; M193-F264 HydrophobicContact SD-CE2 3.72Å; M193-F264 HydrophobicContact SD-CZ 4.43Å; L196-F264 HydrophobicContact CD1-CD2 4.41Å; L196-F264 HydrophobicContact CD1-CE1 4.36Å; L196-F264 HydrophobicContact CD1-CE2 3.45Å; L196-F264 VanDerWaalsContact CD1-CE2 3.45Å; L196-F264 HydrophobicContact CD1-CZ 3.42Å; L196-F264 VanDerWaalsContact CD1-CZ 3.42Å; L196-F264 HydrophobicContact CG-CE2 4.46Å; L196-F264 HydrophobicContact CG-CZ 3.98Å; N260-F264 VanDerWaalsContact O-CD1 3.31Å; N260-F264 WeakPolarHBondContact O-CD1 3.41Å; N260-F264 WeakPolarHBondContact O-CE1 3.28Å; A261-F264 PolarHBondContact O-N 3.21Å; A262-F264 VanDerWaalsContact C-N 3.34Å; F264-T266 PolarHBondContact O-N 2.93Å; F264-T266 VanDerWaalsContact O-N 3.1Å; F264-Y267 WeakPolarHBondContact O-CB 3.43Å; F264-Y267 PolarHBondContact O-N 3.04Å
265	E	88.7	Confident	93.6	Very high	97 Å²	97	36.2 Å²	36.2	45%	0.453	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.9	178.7	-58.4	-150.4	137.5	0	0	113.4	Y267 I269 Y294 K299	E265-Y267 VanDerWaalsContact C-N 3.31Å; E265-I269 VanDerWaalsContact O-CD1 3.28Å; E265-I269 WeakPolarHBondContact O-CD1 3.24Å; E265-Y294 PolarHBondContact O-OH 2.96Å; E265-K299 WeakPolarHBondContact OE1-CE 3.49Å; E265-K299 IonicContact OE1-NZ 3.07Å; E265-K299 PolarHBondContact OE1-NZ 2.92Å; E265-K299 VanDerWaalsContact OE2-CB 3.3Å; E265-K299 WeakPolarHBondContact OE2-CB 3.4Å; E265-K299 IonicContact OE2-NZ 3.3Å
266	T	90.8	Very high	93.4	Very high	19 Å²	19	36.8 Å²	36.8	12%	0.117	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-0.4	-179.2	55.6	0	0	0	0	113.6	I187 F264 G268 I269	I187-T266 HydrophobicContact CB-CG2 4.11Å; I187-T266 HydrophobicContact CG1-CG2 4.48Å; I187-T266 PolarHBondContact N-OG1 3.08Å; I187-T266 PolarHBondContact O-OG1 3.45Å; F264-T266 PolarHBondContact O-N 2.93Å; F264-T266 VanDerWaalsContact O-N 3.1Å; T266-G268 PolarHBondContact O-N 2.96Å; T266-I269 WeakPolarHBondContact O-CB 3.26Å; T266-I269 PolarHBondContact O-N 3.4Å
267	Y	94.6	Very high	93.1	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.016	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	121.6	-176.5	172	-101.9	0	0	0	112.7	Y156 P157 L177 A261 A262 F264 E265 I269 H288	Y156-Y267 HydrophobicContact CD1-CE2 4.35Å; P157-Y267 WeakPolarHBondContact O-CE1 3.36Å; P157-Y267 PolarHBondContact O-OH 2.86Å; L177-Y267 HydrophobicContact CD1-CD2 4.38Å; L177-Y267 HydrophobicContact CD1-CE2 3.8Å; L177-Y267 HydrophobicContact CD2-CD2 3.93Å; L177-Y267 HydrophobicContact CD2-CE2 3.99Å; A261-Y267 WeakPolarHBondContact O-CB 3.42Å; A261-Y267 VanDerWaalsContact O-CD2 3.28Å; A261-Y267 WeakPolarHBondContact O-CD2 3.44Å; A262-Y267 HydrophobicContact CB-CD2 4.48Å; A262-Y267 HydrophobicContact CB-CE2 4.2Å; F264-Y267 WeakPolarHBondContact O-CB 3.43Å; F264-Y267 PolarHBondContact O-N 3.04Å; E265-Y267 VanDerWaalsContact C-N 3.31Å; Y267-I269 PolarHBondContact O-N 3.41Å; Y267-I269 VanDerWaalsContact O-N 3.13Å; Y267-H288 AromaticContact CE1-ND1 3.99Å
268	G	91.9	Very high	92.7	Very high	5 Å²	5	50.5 Å²	50.5	5%	0.052	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	-4.7	-177.8	0	0	0	0	0	115.8	R185 T266 E270	R185-G268 VanDerWaalsContact NH2-C 3.29Å; R185-G268 PolarHBondContact NH2-O 2.82Å; T266-G268 PolarHBondContact O-N 2.96Å; G268-E270 PolarHBondContact O-N 3.48Å
269	I	91.2	Very high	92.4	Very high	6 Å²	6	52.2 Å²	52.2	3%	0.031	25%	0.253	C	S	.	.			trans	-78	121.6	-172.8	-71.3	179.9	0	0	0	111.5	R185 E265 T266 Y267 P271 N287 I292 Y294	R185-I269 PolarHBondContact NE-O 2.86Å; R185-I269 PolarHBondContact NH2-O 3.17Å; E265-I269 VanDerWaalsContact O-CD1 3.28Å; E265-I269 WeakPolarHBondContact O-CD1 3.24Å; T266-I269 WeakPolarHBondContact O-CB 3.26Å; T266-I269 PolarHBondContact O-N 3.4Å; Y267-I269 PolarHBondContact O-N 3.41Å; Y267-I269 VanDerWaalsContact O-N 3.13Å; I269-P271 WeakPolarHBondContact O-CD 3.2Å; I269-N287 HydrophobicContact CD1-CB 4.5Å; I269-N287 HydrophobicContact CG1-CB 4.09Å; I269-I292 HydrophobicContact CD1-CB 4.41Å; I269-I292 HydrophobicContact CD1-CD1 4.18Å; I269-Y294 HydrophobicContact CD1-CE2 3.87Å; I269-Y294 VanDerWaalsContact CD1-OH 3.22Å; I269-Y294 WeakPolarHBondContact CD1-OH 3.49Å; I269-Y294 HydrophobicContact CG2-CE2 4.49Å
270	E	89.2	Confident	92.3	Very high	24 Å²	24	51 Å²	51	11%	0.112	25%	0.249	C	C	.	.			trans	-96.2	104.5	165.8	179.9	163.3	-146.3	0	0	108.8	R120 R128 G268 L272	R120-E270 IonicContact CZ-OE1 2.67Å; R120-E270 IonicContact NH1-OE1 2.74Å; R120-E270 PolarHBondContact NH1-OE1 2.94Å; R120-E270 IonicContact NH1-OE2 2.62Å; R120-E270 PolarHBondContact NH1-OE2 2.77Å; R120-E270 IonicContact NH2-OE1 3.15Å; R128-E270 VanDerWaalsContact CD-OE1 3.23Å; R128-E270 WeakPolarHBondContact CD-OE1 3.39Å; R128-E270 IonicContact CZ-OE1 2.84Å; R128-E270 IonicContact NE-OE1 3.58Å; R128-E270 IonicContact NH1-OE1 3.97Å; R128-E270 PolarHBondContact NH1-OE1 2.81Å; G268-E270 PolarHBondContact O-N 3.48Å; E270-L272 PolarHBondContact O-N 2.88Å
271	P	89.7	Confident	92.2	Very high	62 Å²	62	54.5 Å²	54.5	40%	0.403	26%	0.264	S	S	.	.			trans	-73.2	121.9	-172.1	27.4	-34.1	0	0	0	112.2	I269 Y283	I269-P271 WeakPolarHBondContact O-CD 3.2Å; P271-Y283 HydrophobicContact CB-CD1 4.1Å; P271-Y283 HydrophobicContact CB-CG 4.35Å
272	L	91.8	Very high	92.1	Very high	37 Å²	37	55.4 Å²	55.4	19%	0.194	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.5	175.3	-64	172.8	0	0	0	110.3	E270 V274 Y283 M284 L344 W347	E270-L272 PolarHBondContact O-N 2.88Å; L272-V274 PolarHBondContact O-N 3.29Å; L272-Y283 CarbonylContact O-C 3.46Å; L272-Y283 WeakPolarHBondContact O-CA 3.43Å; L272-M284 PolarHBondContact N-O 3.5Å; L272-M284 PolarHBondContact O-N 3.27Å; L272-L344 HydrophobicContact CD1-CB 4.19Å; L272-L344 HydrophobicContact CD1-CD1 3.89Å; L272-L344 HydrophobicContact CD1-CD2 4.23Å; L272-L344 HydrophobicContact CD1-CG 4.32Å; L272-W347 HydrophobicContact CD1-CE3 4.16Å; L272-W347 HydrophobicContact CD1-CZ3 3.89Å; L272-W347 HydrophobicContact CD2-CZ3 4.22Å; L272-W347 HydrophobicContact CG-CZ3 4.43Å
273	Y	93.7	Very high	92.1	Very high	82 Å²	82	58.3 Å²	58.3	32%	0.322	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	129.6	174.5	172.3	-85.1	0	0	0	111.3	Q275 H281 P336	Y273-Q275 HydrophobicContact CE1-CG 4.06Å; Y273-Q275 PolarHBondContact OH-NE2 3.03Å; Y273-H281 HydrophobicContact CE2-CB 4.03Å; Y273-H281 AromaticContact CE2-CD2 3.64Å; Y273-H281 AromaticContact CE2-CG 3.92Å; Y273-H281 AromaticContact CZ-CD2 3.79Å; Y273-H281 PolarHBondContact OH-CD2 3.01Å; Y273-H281 PolarHBondContact OH-CE1 2.81Å; Y273-H281 PolarHBondContact OH-NE2 2.85Å; Y273-P336 HydrophobicContact CD1-CG 4.06Å; Y273-P336 WeakPolarHBondContact O-CD 3.32Å
274	V	95.2	Very high	92.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	159.4	176.3	-61.5	0	0	0	0	111.4	L272 F282 M284 F333 L344	L272-V274 PolarHBondContact O-N 3.29Å; V274-F282 HydrophobicContact CG2-CB 4.12Å; V274-F282 PolarHBondContact N-O 3.36Å; V274-F282 PolarHBondContact O-N 3.13Å; V274-F282 VanDerWaalsContact O-O 3.05Å; V274-M284 HydrophobicContact CG1-CB 4.35Å; V274-M284 HydrophobicContact CG2-CB 3.92Å; V274-F333 HydrophobicContact CB-CB 4.18Å; V274-F333 HydrophobicContact CG2-CB 4.21Å; V274-F333 HydrophobicContact CG2-CD1 4.18Å; V274-L344 HydrophobicContact CG1-CD2 4.48Å
275	Q	95.3	Very high	92.2	Very high	40 Å²	40	51.1 Å²	51.1	19%	0.187	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.2	173.8	-64.4	175.3	-14	0	0	110.4	Y273 N280 F333 K334	Y273-Q275 HydrophobicContact CE1-CG 4.06Å; Y273-Q275 PolarHBondContact OH-NE2 3.03Å; Q275-N280 WeakPolarHBondContact CA-O 3.39Å; Q275-F333 CarbonylContact O-C 3.57Å; Q275-F333 WeakPolarHBondContact O-CA 3.37Å; Q275-K334 HydrophobicContact CB-CB 4.29Å; Q275-K334 PolarHBondContact N-O 3.37Å; Q275-K334 PolarHBondContact O-N 3.47Å
276	D	92.8	Very high	92.5	Very high	36 Å²	36	47 Å²	47	19%	0.193	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	167.8	167.2	171.1	53	0	0	0	111.3	K278 G279 N280 F282	D276-K278 PolarHBondContact O-N 3.36Å; D276-K278 VanDerWaalsContact O-N 3.13Å; D276-K278 WeakPolarHBondContact OD2-CB 3.44Å; D276-K278 WeakPolarHBondContact OD2-CG 3.49Å; D276-K278 PolarHBondContact OD2-N 3.36Å; D276-G279 PolarHBondContact O-N 2.77Å; D276-N280 HydrophobicContact CB-CB 4.42Å; D276-N280 PolarHBondContact N-O 3.04Å; D276-F282 HydrophobicContact CB-CD2 4.21Å; D276-F282 HydrophobicContact CB-CE2 3.74Å
277	R	88.4	Confident	92.6	Very high	178 Å²	178	46.9 Å²	46.9	67%	0.672	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-32.6	170.4	-61.2	-171.3	-177.2	-153.9	6	113.5	G279 T330	R277-G279 PolarHBondContact O-N 3.37Å; R277-T330 PolarHBondContact NH2-O 2.93Å
278	K	90.3	Very high	92.6	Very high	175 Å²	175	49.2 Å²	49.2	76%	0.761	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	1	175.8	-64.1	-178.5	178.5	-176.3	0	114.3	D276 N280	D276-K278 PolarHBondContact O-N 3.36Å; D276-K278 VanDerWaalsContact O-N 3.13Å; D276-K278 WeakPolarHBondContact OD2-CB 3.44Å; D276-K278 WeakPolarHBondContact OD2-CG 3.49Å; D276-K278 PolarHBondContact OD2-N 3.36Å; K278-N280 PolarHBondContact O-N 2.91Å
279	G	90	Very high	92.7	Very high	37 Å²	37	53 Å²	53	38%	0.381	25%	0.251	S	S	.	.			trans	78.7	-9.8	-172.9	0	0	0	0	0	114.6	D276 R277 H281	D276-G279 PolarHBondContact O-N 2.77Å; R277-G279 PolarHBondContact O-N 3.37Å; G279-H281 PolarHBondContact O-CE1 2.87Å; G279-H281 PolarHBondContact O-N 3.11Å; G279-H281 PolarHBondContact O-ND1 3.45Å
280	N	92.7	Very high	92.9	Very high	62 Å²	62	52.7 Å²	52.7	33%	0.332	25%	0.25	S	C	.	.			trans	-52.7	129.7	175.7	-74.2	-34.9	0	0	0	111.3	Q275 D276 K278 F282	Q275-N280 WeakPolarHBondContact CA-O 3.39Å; D276-N280 HydrophobicContact CB-CB 4.42Å; D276-N280 PolarHBondContact N-O 3.04Å; K278-N280 PolarHBondContact O-N 2.91Å; N280-F282 HydrophobicContact CB-CD2 4.34Å; N280-F282 HydrophobicContact CB-CE2 3.59Å; N280-F282 HydrophobicContact CB-CZ 4.19Å; N280-F282 WeakPolarHBondContact O-CD2 3.45Å
281	H	93.8	Very high	93.2	Very high	109 Å²	109	51.5 Å²	51.5	51%	0.505	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	133.5	-178.4	-65.7	20.1	0	0	0	110.6	Y273 G279	Y273-H281 HydrophobicContact CE2-CB 4.03Å; Y273-H281 AromaticContact CE2-CD2 3.64Å; Y273-H281 AromaticContact CE2-CG 3.92Å; Y273-H281 AromaticContact CZ-CD2 3.79Å; Y273-H281 PolarHBondContact OH-CD2 3.01Å; Y273-H281 PolarHBondContact OH-CE1 2.81Å; Y273-H281 PolarHBondContact OH-NE2 2.85Å; G279-H281 PolarHBondContact O-CE1 2.87Å; G279-H281 PolarHBondContact O-N 3.11Å; G279-H281 PolarHBondContact O-ND1 3.45Å
282	F	94.3	Very high	93.4	Very high	18 Å²	18	48.7 Å²	48.7	8%	0.079	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157.1	176.6	-64.5	-89	0	0	0	110.9	V274 D276 N280 Y294 R295 A300	V274-F282 HydrophobicContact CG2-CB 4.12Å; V274-F282 PolarHBondContact N-O 3.36Å; V274-F282 PolarHBondContact O-N 3.13Å; V274-F282 VanDerWaalsContact O-O 3.05Å; D276-F282 HydrophobicContact CB-CD2 4.21Å; D276-F282 HydrophobicContact CB-CE2 3.74Å; N280-F282 HydrophobicContact CB-CD2 4.34Å; N280-F282 HydrophobicContact CB-CE2 3.59Å; N280-F282 HydrophobicContact CB-CZ 4.19Å; N280-F282 WeakPolarHBondContact O-CD2 3.45Å; F282-Y294 CarbonylContact C-O 3.57Å; F282-Y294 VanDerWaalsContact CA-O 3.25Å; F282-Y294 WeakPolarHBondContact CA-O 3.37Å; F282-Y294 WeakPolarHBondContact CB-O 3.2Å; F282-Y294 WeakPolarHBondContact CD1-O 3.43Å; F282-R295 HydrophobicContact CD1-CB 4.02Å; F282-R295 HydrophobicContact CE1-CB 4Å; F282-R295 HydrophobicContact CE1-CG 4.47Å; F282-A300 HydrophobicContact CD1-CB 4.24Å; F282-A300 HydrophobicContact CE1-CB 3.91Å
283	Y	94.2	Very high	93.5	Very high	81 Å²	81	46.9 Å²	46.9	32%	0.318	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	140.4	155.6	-65.3	-82.6	0	0	0	108.9	P271 L272 T293 Y294 L669	P271-Y283 HydrophobicContact CB-CD1 4.1Å; P271-Y283 HydrophobicContact CB-CG 4.35Å; L272-Y283 CarbonylContact O-C 3.46Å; L272-Y283 WeakPolarHBondContact O-CA 3.43Å; Y283-T293 CarbonylContact O-C 3.58Å; Y283-T293 VanDerWaalsContact O-CA 3.25Å; Y283-T293 WeakPolarHBondContact O-CA 3.36Å; Y283-Y294 PolarHBondContact N-O 3.14Å; Y283-Y294 PolarHBondContact O-N 2.8Å; Y283-L669 HydrophobicContact CE2-CD2 4.36Å
284	M	94.5	Very high	93.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.5	177.3	-180	171.3	-79.7	0	0	110.5	L272 V274 V291 I292 T293 F318 I320 F333 L344	L272-M284 PolarHBondContact N-O 3.5Å; L272-M284 PolarHBondContact O-N 3.27Å; V274-M284 HydrophobicContact CG1-CB 4.35Å; V274-M284 HydrophobicContact CG2-CB 3.92Å; M284-V291 HydrophobicContact CE-CG1 3.88Å; M284-V291 HydrophobicContact CG-CG1 3.79Å; M284-V291 HydrophobicContact SD-CG1 3.64Å; M284-I292 CarbonylContact C-O 3.58Å; M284-I292 VanDerWaalsContact CA-O 3.32Å; M284-I292 WeakPolarHBondContact CA-O 3.37Å; M284-T293 HydrophobicContact CB-CG2 4.35Å; M284-T293 HydrophobicContact CE-CG2 3.52Å; M284-T293 HydrophobicContact CG-CG2 4.35Å; M284-F318 HydrophobicContact CE-CD1 4.31Å; M284-F318 HydrophobicContact CE-CE1 4.27Å; M284-F318 HydrophobicContact SD-CD1 3.72Å; M284-F318 HydrophobicContact SD-CE1 3.53Å; M284-F318 VanDerWaalsContact SD-CE1 3.53Å; M284-I320 HydrophobicContact CE-CD1 4.4Å; M284-F333 HydrophobicContact CE-CB 4.32Å; M284-F333 HydrophobicContact CE-CD1 3.98Å; M284-F333 HydrophobicContact CE-CD2 3.55Å; M284-F333 HydrophobicContact CE-CE1 4.13Å; M284-F333 HydrophobicContact CE-CE2 3.71Å; M284-F333 HydrophobicContact CE-CG 3.68Å; M284-F333 HydrophobicContact CE-CZ 4Å; M284-L344 HydrophobicContact SD-CD1 4.39Å; M284-L344 HydrophobicContact SD-CD2 3.87Å
285	G	93.7	Very high	93.3	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	163.9	177.9	0	0	0	0	0	112.6	I292	G285-I292 PolarHBondContact N-O 3.27Å; G285-I292 PolarHBondContact O-N 3.1Å
286	L	94.9	Very high	92.8	Very high	11 Å²	11	51.5 Å²	51.5	6%	0.058	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.1	173.8	-48.5	172	0	0	0	108.4	V291 W305 L344 W347 A348	L286-V291 HydrophobicContact CD2-CB 4.22Å; L286-V291 HydrophobicContact CD2-CG1 3.98Å; L286-V291 HydrophobicContact CD2-CG2 3.75Å; L286-W305 HydrophobicContact CD2-CH2 4.18Å; L286-L344 HydrophobicContact CD1-CD1 4.03Å; L286-L344 HydrophobicContact CD2-CD1 4.07Å; L286-L344 HydrophobicContact CG-CD1 4.28Å; L286-W347 HydrophobicContact CD1-CB 3.68Å; L286-A348 HydrophobicContact CD1-CB 4.17Å; L286-A348 HydrophobicContact CD2-CB 3.94Å
287	N	93.2	Very high	92.1	Very high	15 Å²	15	52.1 Å²	52.1	8%	0.08	25%	0.253	C	S	.	.			trans	-127.5	-164.6	178.2	72.5	-13.5	0	0	0	111.1	I269 E289 G290 I292 W305	I269-N287 HydrophobicContact CD1-CB 4.5Å; I269-N287 HydrophobicContact CG1-CB 4.09Å; N287-E289 VanDerWaalsContact C-N 3.3Å; N287-E289 WeakPolarHBondContact OD1-CB 3.4Å; N287-E289 PolarHBondContact OD1-N 2.88Å; N287-G290 PolarHBondContact N-O 3.25Å; N287-G290 VanDerWaalsContact N-O 3.16Å; N287-G290 PolarHBondContact OD1-N 3.49Å; N287-G290 PolarHBondContact OD1-O 2.74Å; N287-I292 WeakPolarHBondContact ND2-CD1 3.44Å; N287-W305 PolarHBondContact O-NE1 3.25Å
288	H	93.7	Very high	92	Very high	54 Å²	54	51.7 Å²	51.7	25%	0.25	25%	0.251	C	S	.	.	S	Bend	trans	-70.4	-24.5	175.6	61.8	-109.9	0	0	0	113.1	Y267 W305 F355	Y267-H288 AromaticContact CE1-ND1 3.99Å; H288-W305 PolarHBondContact O-NE1 3.06Å; H288-F355 HydrophobicContact CB-CD1 4.19Å; H288-F355 HydrophobicContact CB-CE1 3.67Å; H288-F355 HydrophobicContact CB-CE2 4.36Å; H288-F355 HydrophobicContact CB-CZ 3.78Å
289	E	94	Very high	92	Very high	83 Å²	83	47.6 Å²	47.6	39%	0.388	23%	0.234	S	C	.	.	S	Bend	trans	-81	-45.8	-178	-171.6	-170.8	-177	0	0	112.3	N287 V302 S304 W305	N287-E289 VanDerWaalsContact C-N 3.3Å; N287-E289 WeakPolarHBondContact OD1-CB 3.4Å; N287-E289 PolarHBondContact OD1-N 2.88Å; E289-V302 VanDerWaalsContact CD-CG1 3.48Å; E289-V302 HydrophobicContact CG-CG1 4.14Å; E289-V302 WeakPolarHBondContact OE1-CG1 3.25Å; E289-S304 VanDerWaalsContact O-CA 3.26Å; E289-S304 WeakPolarHBondContact O-CA 3.39Å; E289-S304 PolarHBondContact O-OG 2.97Å; E289-W305 PolarHBondContact O-N 3.07Å
290	G	94.6	Very high	92.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.4	-156.1	-173.9	0	0	0	0	0	116	N287 F303 W305	N287-G290 PolarHBondContact N-O 3.25Å; N287-G290 VanDerWaalsContact N-O 3.16Å; N287-G290 PolarHBondContact OD1-N 3.49Å; N287-G290 PolarHBondContact OD1-O 2.74Å; G290-F303 VanDerWaalsContact CA-O 3.26Å; G290-F303 WeakPolarHBondContact CA-O 3.41Å; G290-W305 VanDerWaalsContact CA-CE2 3.49Å; G290-W305 WeakPolarHBondContact O-CZ2 3.38Å
291	V	95.5	Very high	92.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	121.8	165.5	-175.4	0	0	0	0	108.1	M284 L286 F303 W305 I308 I320	M284-V291 HydrophobicContact CE-CG1 3.88Å; M284-V291 HydrophobicContact CG-CG1 3.79Å; M284-V291 HydrophobicContact SD-CG1 3.64Å; L286-V291 HydrophobicContact CD2-CB 4.22Å; L286-V291 HydrophobicContact CD2-CG1 3.98Å; L286-V291 HydrophobicContact CD2-CG2 3.75Å; V291-F303 HydrophobicContact CB-CB 4.36Å; V291-F303 HydrophobicContact CB-CD2 4.43Å; V291-F303 PolarHBondContact N-O 3.38Å; V291-F303 WeakPolarHBondContact O-CD2 3.43Å; V291-F303 PolarHBondContact O-N 2.61Å; V291-W305 HydrophobicContact CG2-CH2 3.83Å; V291-W305 HydrophobicContact CG2-CZ3 3.76Å; V291-I308 HydrophobicContact CB-CD1 4.39Å; V291-I308 HydrophobicContact CG2-CD1 3.75Å; V291-I320 HydrophobicContact CB-CD1 4.18Å; V291-I320 HydrophobicContact CG1-CD1 3.88Å; V291-I320 HydrophobicContact CG2-CD1 4.3Å
292	I	94.9	Very high	92.1	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	143.6	-176.4	-56.7	-169.2	0	0	0	109.8	I269 M284 G285 N287 Y294 K299 H301 V302	I269-I292 HydrophobicContact CD1-CB 4.41Å; I269-I292 HydrophobicContact CD1-CD1 4.18Å; M284-I292 CarbonylContact C-O 3.58Å; M284-I292 VanDerWaalsContact CA-O 3.32Å; M284-I292 WeakPolarHBondContact CA-O 3.37Å; G285-I292 PolarHBondContact N-O 3.27Å; G285-I292 PolarHBondContact O-N 3.1Å; N287-I292 WeakPolarHBondContact ND2-CD1 3.44Å; I292-Y294 HydrophobicContact CB-CE2 4.18Å; I292-Y294 HydrophobicContact CG2-CD2 4.12Å; I292-Y294 HydrophobicContact CG2-CE2 3.41Å; I292-Y294 VanDerWaalsContact CG2-CE2 3.41Å; I292-K299 HydrophobicContact CG2-CD 4.1Å; I292-K299 HydrophobicContact CG2-CG 3.82Å; I292-H301 CarbonylContact C-O 2.91Å; I292-H301 WeakPolarHBondContact CA-O 3.41Å; I292-V302 HydrophobicContact CD1-CG1 4.35Å; I292-V302 HydrophobicContact CD1-CG2 4.13Å; I292-V302 HydrophobicContact CG1-CG1 4.13Å; I292-V302 HydrophobicContact CG1-CG2 4.1Å; I292-V302 HydrophobicContact CG2-CG2 4.19Å
293	T	94.2	Very high	92.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	146.8	168.4	63.2	0	0	0	0	112.1	Y283 M284 A300 H301 F303 F333	Y283-T293 CarbonylContact O-C 3.58Å; Y283-T293 VanDerWaalsContact O-CA 3.25Å; Y283-T293 WeakPolarHBondContact O-CA 3.36Å; M284-T293 HydrophobicContact CB-CG2 4.35Å; M284-T293 HydrophobicContact CE-CG2 3.52Å; M284-T293 HydrophobicContact CG-CG2 4.35Å; T293-A300 PolarHBondContact O-N 2.61Å; T293-H301 PolarHBondContact N-O 2.97Å; T293-H301 PolarHBondContact O-N 3.14Å; T293-H301 PolarHBondContact OG1-N 2.86Å; T293-F303 HydrophobicContact CG2-CE2 4.36Å; T293-F333 HydrophobicContact CG2-CE1 4.2Å; T293-F333 HydrophobicContact CG2-CZ 4.37Å
294	Y	92.9	Very high	92.2	Very high	8 Å²	8	44.3 Å²	44.3	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143	178.4	-63.6	-97.4	0	0	0	110.1	E265 I269 F282 Y283 I292 R298 K299	E265-Y294 PolarHBondContact O-OH 2.96Å; I269-Y294 HydrophobicContact CD1-CE2 3.87Å; I269-Y294 VanDerWaalsContact CD1-OH 3.22Å; I269-Y294 WeakPolarHBondContact CD1-OH 3.49Å; I269-Y294 HydrophobicContact CG2-CE2 4.49Å; F282-Y294 CarbonylContact C-O 3.57Å; F282-Y294 VanDerWaalsContact CA-O 3.25Å; F282-Y294 WeakPolarHBondContact CA-O 3.37Å; F282-Y294 WeakPolarHBondContact CB-O 3.2Å; F282-Y294 WeakPolarHBondContact CD1-O 3.43Å; Y283-Y294 PolarHBondContact N-O 3.14Å; Y283-Y294 PolarHBondContact O-N 2.8Å; I292-Y294 HydrophobicContact CB-CE2 4.18Å; I292-Y294 HydrophobicContact CG2-CD2 4.12Å; I292-Y294 HydrophobicContact CG2-CE2 3.41Å; I292-Y294 VanDerWaalsContact CG2-CE2 3.41Å; Y294-R298 WeakPolarHBondContact CA-O 3.42Å; Y294-K299 HydrophobicContact CD1-CB 4.03Å; Y294-K299 HydrophobicContact CE1-CB 3.76Å; Y294-K299 HydrophobicContact CE1-CG 4.1Å
295	R	91.7	Very high	92.2	Very high	165 Å²	165	44.6 Å²	44.6	62%	0.623	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	101.9	174.7	-174.5	-178.9	178	-165.9	-2.2	108.3	F282 R298 A300	F282-R295 HydrophobicContact CD1-CB 4.02Å; F282-R295 HydrophobicContact CE1-CB 4Å; F282-R295 HydrophobicContact CE1-CG 4.47Å; R295-R298 PolarHBondContact N-O 3.14Å; R295-A300 HydrophobicContact CB-CB 4.27Å
296	G	83.9	Confident	92.1	Very high	45 Å²	45	51.5 Å²	51.5	46%	0.464	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	-139.3	-159.6	0	0	0	0	0	109.6	L669	G296-L669 WeakPolarHBondContact O-CD2 3.38Å
297	S	79.1	Confident	92.1	Very high	50 Å²	50	55.8 Å²	55.8	35%	0.35	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-25.7	174.2	48.1	0	0	0	0	113.9
298	R	86.3	Confident	92.1	Very high	168 Å²	168	55.4 Å²	55.4	63%	0.634	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	131.3	-171.1	-65.9	-176	173.8	177.9	-2.7	112.2	Y294 R295 A300 E674	Y294-R298 WeakPolarHBondContact CA-O 3.42Å; R295-R298 PolarHBondContact N-O 3.14Å; R298-A300 PolarHBondContact O-N 3Å; R298-E674 IonicContact NH2-OE1 2.68Å; R298-E674 PolarHBondContact NH2-OE1 2.95Å
299	K	90.4	Very high	92	Very high	89 Å²	89	56.5 Å²	56.5	39%	0.387	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	124.3	173.5	-170.6	174	71.2	-171.2	0	109.7	E265 I292 Y294 V302	E265-K299 WeakPolarHBondContact OE1-CE 3.49Å; E265-K299 IonicContact OE1-NZ 3.07Å; E265-K299 PolarHBondContact OE1-NZ 2.92Å; E265-K299 VanDerWaalsContact OE2-CB 3.3Å; E265-K299 WeakPolarHBondContact OE2-CB 3.4Å; E265-K299 IonicContact OE2-NZ 3.3Å; I292-K299 HydrophobicContact CG2-CD 4.1Å; I292-K299 HydrophobicContact CG2-CG 3.82Å; Y294-K299 HydrophobicContact CD1-CB 4.03Å; Y294-K299 HydrophobicContact CE1-CB 3.76Å; Y294-K299 HydrophobicContact CE1-CG 4.1Å; K299-V302 HydrophobicContact CD-CG2 3.8Å; K299-V302 HydrophobicContact CG-CG2 4.2Å
300	A	92	Very high	91.9	Very high	38 Å²	38	56.2 Å²	56.2	31%	0.314	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-51.2	-172.7	0	0	0	0	0	112.3	F282 T293 R295 R298	F282-A300 HydrophobicContact CD1-CB 4.24Å; F282-A300 HydrophobicContact CE1-CB 3.91Å; T293-A300 PolarHBondContact O-N 2.61Å; R295-A300 HydrophobicContact CB-CB 4.27Å; R298-A300 PolarHBondContact O-N 3Å
301	H	92.4	Very high	91.9	Very high	97 Å²	97	56.7 Å²	56.7	45%	0.449	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	148.7	179.2	-56	-50.1	0	0	0	111.7	I292 T293 F303	I292-H301 CarbonylContact C-O 2.91Å; I292-H301 WeakPolarHBondContact CA-O 3.41Å; T293-H301 PolarHBondContact N-O 2.97Å; T293-H301 PolarHBondContact O-N 3.14Å; T293-H301 PolarHBondContact OG1-N 2.86Å; H301-F303 HydrophobicContact CB-CE1 4.04Å; H301-F303 HydrophobicContact CB-CE2 3.82Å; H301-F303 HydrophobicContact CB-CZ 3.46Å; H301-F303 VanDerWaalsContact CB-CZ 3.46Å; H301-F303 AromaticContact CG-CZ 3.96Å
302	V	93.9	Very high	91.8	Very high	44 Å²	44	56.8 Å²	56.8	27%	0.267	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	114.7	172.9	179.4	0	0	0	0	109.4	E289 I292 K299	E289-V302 VanDerWaalsContact CD-CG1 3.48Å; E289-V302 HydrophobicContact CG-CG1 4.14Å; E289-V302 WeakPolarHBondContact OE1-CG1 3.25Å; I292-V302 HydrophobicContact CD1-CG1 4.35Å; I292-V302 HydrophobicContact CD1-CG2 4.13Å; I292-V302 HydrophobicContact CG1-CG1 4.13Å; I292-V302 HydrophobicContact CG1-CG2 4.1Å; I292-V302 HydrophobicContact CG2-CG2 4.19Å; K299-V302 HydrophobicContact CD-CG2 3.8Å; K299-V302 HydrophobicContact CG-CG2 4.2Å
303	F	94.5	Very high	91.8	Very high	23 Å²	23	57.9 Å²	57.9	10%	0.101	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	85.8	176.3	-50.4	-65.5	0	0	0	108.6	G290 V291 T293 H301 I308 I320 V322 L331 F333	G290-F303 VanDerWaalsContact CA-O 3.26Å; G290-F303 WeakPolarHBondContact CA-O 3.41Å; V291-F303 HydrophobicContact CB-CB 4.36Å; V291-F303 HydrophobicContact CB-CD2 4.43Å; V291-F303 PolarHBondContact N-O 3.38Å; V291-F303 WeakPolarHBondContact O-CD2 3.43Å; V291-F303 PolarHBondContact O-N 2.61Å; T293-F303 HydrophobicContact CG2-CE2 4.36Å; H301-F303 HydrophobicContact CB-CE1 4.04Å; H301-F303 HydrophobicContact CB-CE2 3.82Å; H301-F303 HydrophobicContact CB-CZ 3.46Å; H301-F303 VanDerWaalsContact CB-CZ 3.46Å; H301-F303 AromaticContact CG-CZ 3.96Å; F303-I308 HydrophobicContact CB-CD1 4.07Å; F303-I308 HydrophobicContact CB-CG1 4.28Å; F303-I308 VanDerWaalsContact O-CD1 3.28Å; F303-I308 WeakPolarHBondContact O-CD1 3.36Å; F303-I320 HydrophobicContact CD2-CD1 4.28Å; F303-V322 HydrophobicContact CB-CG2 4.36Å; F303-V322 HydrophobicContact CD1-CG1 4.26Å; F303-V322 HydrophobicContact CD1-CG2 4.02Å; F303-V322 HydrophobicContact CG-CG2 4.3Å; F303-L331 HydrophobicContact CD1-CD1 4.05Å; F303-L331 HydrophobicContact CE1-CD1 3.33Å; F303-L331 HydrophobicContact CE2-CD1 4.12Å; F303-L331 HydrophobicContact CZ-CD1 3.37Å; F303-F333 HydrophobicContact CE2-CE2 4.48Å; F303-F333 HydrophobicContact CE2-CZ 4.06Å; F303-F333 HydrophobicContact CZ-CZ 4.42Å
304	S	95.2	Very high	91.6	Very high	36 Å²	36	63.7 Å²	63.7	25%	0.252	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	141.2	-179.8	175.6	0	0	0	0	112	E289 Q306 K307 I308	E289-S304 VanDerWaalsContact O-CA 3.26Å; E289-S304 WeakPolarHBondContact O-CA 3.39Å; E289-S304 PolarHBondContact O-OG 2.97Å; S304-Q306 PolarHBondContact O-N 2.69Å; S304-K307 PolarHBondContact O-N 3.19Å; S304-I308 PolarHBondContact O-N 2.88Å
305	W	95.2	Very high	91.6	Very high	7 Å²	7	64.9 Å²	64.9	3%	0.027	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-53.4	-30.9	-176.4	-63.1	120.1	0	0	0	114.3	L286 N287 H288 E289 G290 V291 I308 I311 A348 R351 Q352 F355 T356	L286-W305 HydrophobicContact CD2-CH2 4.18Å; N287-W305 PolarHBondContact O-NE1 3.25Å; H288-W305 PolarHBondContact O-NE1 3.06Å; E289-W305 PolarHBondContact O-N 3.07Å; G290-W305 VanDerWaalsContact CA-CE2 3.49Å; G290-W305 WeakPolarHBondContact O-CZ2 3.38Å; V291-W305 HydrophobicContact CG2-CH2 3.83Å; V291-W305 HydrophobicContact CG2-CZ3 3.76Å; W305-I308 HydrophobicContact CE3-CD1 4.02Å; W305-I308 HydrophobicContact CZ3-CD1 4.27Å; W305-I308 PolarHBondContact O-N 3.14Å; W305-I311 HydrophobicContact CZ3-CD1 4.02Å; W305-A348 HydrophobicContact CH2-CB 4.38Å; W305-A348 HydrophobicContact CZ3-CB 4.47Å; W305-A348 WeakPolarHBondContact CZ3-O 3.42Å; W305-R351 HydrophobicContact CH2-CB 3.86Å; W305-R351 HydrophobicContact CZ2-CB 3.6Å; W305-Q352 HydrophobicContact CD2-CB 4.38Å; W305-Q352 HydrophobicContact CE3-CB 3.67Å; W305-Q352 HydrophobicContact CE3-CG 3.94Å; W305-Q352 HydrophobicContact CZ3-CB 3.94Å; W305-Q352 PolarHBondContact O-NE2 3.01Å; W305-F355 AromaticContact NE1-CD2 3.81Å; W305-T356 HydrophobicContact CB-CG2 3.66Å
306	Q	92.5	Very high	91.7	Very high	146 Å²	146	61.9 Å²	61.9	68%	0.682	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-72.5	-25.8	178.6	-56	-60.2	-19.1	0	0	113.2	S304	S304-Q306 PolarHBondContact O-N 2.69Å
307	K	93.2	Very high	92.2	Very high	102 Å²	102	62.4 Å²	62.4	44%	0.443	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-87.4	-10.1	176.7	-64	-175.6	179	178.6	0	112.6	S304 N309 V322 E323	S304-K307 PolarHBondContact O-N 3.19Å; K307-N309 PolarHBondContact O-N 2.88Å; K307-V322 HydrophobicContact CB-CG1 3.97Å; K307-V322 CarbonylContact O-C 3.49Å; K307-V322 WeakPolarHBondContact O-CA 3.4Å; K307-E323 PolarHBondContact O-N 3.39Å
308	I	94.4	Very high	93	Very high	7 Å²	7	60 Å²	60	4%	0.036	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	101.8	-177.3	-65.5	175.6	0	0	0	110.5	V291 F303 S304 W305 I311 I320 Q321 V322 Q352	V291-I308 HydrophobicContact CB-CD1 4.39Å; V291-I308 HydrophobicContact CG2-CD1 3.75Å; F303-I308 HydrophobicContact CB-CD1 4.07Å; F303-I308 HydrophobicContact CB-CG1 4.28Å; F303-I308 VanDerWaalsContact O-CD1 3.28Å; F303-I308 WeakPolarHBondContact O-CD1 3.36Å; S304-I308 PolarHBondContact O-N 2.88Å; W305-I308 HydrophobicContact CE3-CD1 4.02Å; W305-I308 HydrophobicContact CZ3-CD1 4.27Å; W305-I308 PolarHBondContact O-N 3.14Å; I308-I311 HydrophobicContact CG2-CD1 3.97Å; I308-I311 HydrophobicContact CG2-CG1 3.47Å; I308-I311 VanDerWaalsContact CG2-CG1 3.47Å; I308-I320 HydrophobicContact CB-CG2 4.45Å; I308-I320 HydrophobicContact CD1-CG2 4.04Å; I308-I320 HydrophobicContact CG1-CG2 3.91Å; I308-I320 HydrophobicContact CG2-CG2 3.78Å; I308-Q321 CarbonylContact C-O 3.59Å; I308-V322 HydrophobicContact CG1-CG2 4.41Å; I308-Q352 PolarHBondContact O-NE2 3.12Å
309	N	91.2	Very high	93.4	Very high	76 Å²	76	52.9 Å²	52.9	41%	0.406	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-33	177.4	-89.6	-70.8	0	0	0	113.4	K307 Q321 E323 R328	K307-N309 PolarHBondContact O-N 2.88Å; N309-Q321 PolarHBondContact N-O 3.4Å; N309-E323 PolarHBondContact ND2-OE2 3.45Å; N309-R328 PolarHBondContact OD1-NH2 3.11Å
310	K	92.1	Very high	93.7	Very high	78 Å²	78	48.7 Å²	48.7	34%	0.339	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	142.9	179.3	-178.7	176.7	172.4	-175.8	0	111.9	Q321 N369	K310-Q321 HydrophobicContact CB-CB 4.12Å; K310-Q321 HydrophobicContact CB-CG 4.23Å; K310-Q321 PolarHBondContact N-O 3.45Å; K310-Q321 PolarHBondContact O-N 2.81Å; K310-N369 PolarHBondContact NZ-OD1 3.37Å
311	I	94.6	Very high	93.8	Very high	10 Å²	10	49.9 Å²	49.9	5%	0.051	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.1	170	-42	-178.4	0	0	0	109.5	W305 I308 F318 W345 A348 V349 Q352	W305-I311 HydrophobicContact CZ3-CD1 4.02Å; I308-I311 HydrophobicContact CG2-CD1 3.97Å; I308-I311 HydrophobicContact CG2-CG1 3.47Å; I308-I311 VanDerWaalsContact CG2-CG1 3.47Å; I311-F318 HydrophobicContact CG2-CD2 4.41Å; I311-F318 HydrophobicContact CG2-CE2 3.33Å; I311-F318 HydrophobicContact CG2-CZ 3.59Å; I311-W345 PolarHBondContact O-NE1 2.88Å; I311-W345 VanDerWaalsContact O-NE1 3.16Å; I311-A348 HydrophobicContact CD1-CB 3.87Å; I311-A348 HydrophobicContact CG2-CB 4.24Å; I311-V349 HydrophobicContact CB-CG2 4.16Å; I311-Q352 HydrophobicContact CD1-CB 4.37Å
312	S	93.7	Very high	93.8	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	173.3	179.3	48.6	0	0	0	0	111.5	I319 W345 N369	S312-I319 PolarHBondContact N-O 2.8Å; S312-I319 PolarHBondContact O-N 3.25Å; S312-I319 VanDerWaalsContact O-O 3.1Å; S312-W345 VanDerWaalsContact CA-CD1 3.46Å; S312-N369 WeakPolarHBondContact CB-ND2 3.11Å; S312-N369 PolarHBondContact OG-ND2 2.9Å; S312-N369 VanDerWaalsContact OG-ND2 3.16Å
313	Y	93.6	Very high	93.6	Very high	26 Å²	26	46.9 Å²	46.9	10%	0.102	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	157.5	170.2	78.1	-68.5	0	0	0	110.7	L317 A341 E342 W345 A368 Q377	Y313-L317 CarbonylContact C-O 3.59Å; Y313-L317 WeakPolarHBondContact CA-O 3.46Å; Y313-L317 WeakPolarHBondContact CB-O 3.45Å; Y313-A341 HydrophobicContact CD2-CB 4.21Å; Y313-E342 HydrophobicContact CD2-CB 4.3Å; Y313-E342 HydrophobicContact CE1-CG 4.4Å; Y313-E342 HydrophobicContact CE2-CB 3.63Å; Y313-E342 HydrophobicContact CE2-CG 4.22Å; Y313-E342 PolarHBondContact OH-OE2 2.9Å; Y313-W345 HydrophobicContact CD1-CB 3.72Å; Y313-W345 AromaticContact CD1-CD2 3.59Å; Y313-W345 HydrophobicContact CD1-CD2 3.59Å; Y313-W345 AromaticContact CD1-CE3 3.72Å; Y313-W345 HydrophobicContact CD1-CE3 3.72Å; Y313-W345 AromaticContact CD1-CG 3.58Å; Y313-W345 HydrophobicContact CD1-CG 3.58Å; Y313-W345 AromaticContact CE1-CD2 3.8Å; Y313-W345 HydrophobicContact CE1-CD2 3.8Å; Y313-W345 AromaticContact CE1-CE3 3.43Å; Y313-W345 HydrophobicContact CE1-CE3 3.43Å; Y313-W345 VanDerWaalsContact CE1-CE3 3.43Å; Y313-W345 HydrophobicContact CE1-CG 4.26Å; Y313-W345 AromaticContact CE1-CZ3 3.94Å; Y313-W345 HydrophobicContact CE1-CZ3 3.94Å; Y313-W345 HydrophobicContact CG-CB 4.13Å; Y313-W345 HydrophobicContact CG-CG 4.4Å; Y313-A368 HydrophobicContact CD1-CB 4.16Å; Y313-A368 HydrophobicContact CE1-CB 3.55Å; Y313-Q377 PolarHBondContact OH-NE2 2.89Å; Y313-Q377 PolarHBondContact OH-OE1 2.72Å
314	E	92	Very high	93	Very high	121 Å²	121	52 Å²	52	57%	0.565	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.4	111.1	174.1	-177.3	164.6	-164.2	0	0	110.7	K316 L317 I319	E314-K316 PolarHBondContact O-N 3.32Å; E314-K316 VanDerWaalsContact O-N 3.14Å; E314-L317 PolarHBondContact N-O 3.14Å; E314-L317 WeakPolarHBondContact O-CB 3.43Å; E314-L317 PolarHBondContact O-N 3.47Å; E314-I319 HydrophobicContact CB-CD1 4.24Å
315	G	91.2	Very high	92.5	Very high	33 Å²	33	57 Å²	57	34%	0.34	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-117	-176.3	0	0	0	0	0	111.1	P338	G315-P338 VanDerWaalsContact O-CA 3.31Å; G315-P338 WeakPolarHBondContact O-CA 3.31Å; G315-P338 WeakPolarHBondContact O-CB 3.32Å
316	K	94.2	Very high	91.7	Very high	103 Å²	103	65.7 Å²	65.7	45%	0.448	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.9	173.9	-64.9	-165	179.7	-165.4	0	113.9	E314 C335 P336	E314-K316 PolarHBondContact O-N 3.32Å; E314-K316 VanDerWaalsContact O-N 3.14Å; K316-C335 PolarHBondContact O-N 2.94Å; K316-P336 WeakPolarHBondContact CD-O 3.49Å; K316-P336 VanDerWaalsContact CE-O 3.3Å; K316-P336 WeakPolarHBondContact CE-O 3.44Å; K316-P336 PolarHBondContact NZ-O 3.43Å
317	L	95.1	Very high	91.3	Very high	56 Å²	56	67 Å²	67	29%	0.293	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.8	-173.9	-167.9	71	0	0	0	110.8	Y313 E314 I319 K334	Y313-L317 CarbonylContact C-O 3.59Å; Y313-L317 WeakPolarHBondContact CA-O 3.46Å; Y313-L317 WeakPolarHBondContact CB-O 3.45Å; E314-L317 PolarHBondContact N-O 3.14Å; E314-L317 WeakPolarHBondContact O-CB 3.43Å; E314-L317 PolarHBondContact O-N 3.47Å; L317-I319 HydrophobicContact CB-CG1 4.49Å; L317-I319 HydrophobicContact CD2-CD1 3.95Å; L317-I319 HydrophobicContact CD2-CG1 3.87Å; L317-I319 HydrophobicContact CG-CD1 4.35Å; L317-I319 HydrophobicContact CG-CG1 3.85Å; L317-K334 HydrophobicContact CD1-CB 4.44Å
318	F	95.7	Very high	91	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.1	165	176.8	-118.8	0	0	0	109.5	M284 I311 I320 G332 F333 L344 W345 A348	M284-F318 HydrophobicContact CE-CD1 4.31Å; M284-F318 HydrophobicContact CE-CE1 4.27Å; M284-F318 HydrophobicContact SD-CD1 3.72Å; M284-F318 HydrophobicContact SD-CE1 3.53Å; M284-F318 VanDerWaalsContact SD-CE1 3.53Å; I311-F318 HydrophobicContact CG2-CD2 4.41Å; I311-F318 HydrophobicContact CG2-CE2 3.33Å; I311-F318 HydrophobicContact CG2-CZ 3.59Å; F318-I320 HydrophobicContact CD1-CG1 4.25Å; F318-I320 HydrophobicContact CE1-CD1 3.75Å; F318-I320 HydrophobicContact CE1-CG1 3.67Å; F318-I320 HydrophobicContact CZ-CD1 4.36Å; F318-I320 HydrophobicContact CZ-CG1 4.04Å; F318-G332 CarbonylContact O-C 3.53Å; F318-G332 WeakPolarHBondContact O-CA 3.23Å; F318-F333 HydrophobicContact CD1-CD2 4.47Å; F318-F333 PolarHBondContact N-O 2.98Å; F318-F333 PolarHBondContact O-N 2.79Å; F318-L344 HydrophobicContact CB-CD2 4.17Å; F318-L344 HydrophobicContact CD1-CD2 3.65Å; F318-L344 HydrophobicContact CD1-CG 3.97Å; F318-L344 HydrophobicContact CD2-CD2 4.31Å; F318-L344 HydrophobicContact CD2-CG 3.95Å; F318-L344 HydrophobicContact CE1-CD1 4.32Å; F318-L344 HydrophobicContact CE1-CD2 4.04Å; F318-L344 HydrophobicContact CE1-CG 3.98Å; F318-L344 HydrophobicContact CE2-CG 3.97Å; F318-L344 HydrophobicContact CG-CD2 3.79Å; F318-L344 HydrophobicContact CG-CG 3.95Å; F318-L344 HydrophobicContact CZ-CD1 4.28Å; F318-L344 HydrophobicContact CZ-CG 3.99Å; F318-W345 HydrophobicContact CD2-CB 4.33Å; F318-W345 HydrophobicContact CE2-CB 4.34Å; F318-A348 HydrophobicContact CE2-CB 4.33Å; F318-A348 HydrophobicContact CZ-CB 3.97Å
319	I	95.2	Very high	90.9	Very high	18 Å²	18	74.1 Å²	74.1	9%	0.092	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	120.7	-167.5	-54.4	172.3	0	0	0	110.3	S312 E314 L317 T330 L331	S312-I319 PolarHBondContact N-O 2.8Å; S312-I319 PolarHBondContact O-N 3.25Å; S312-I319 VanDerWaalsContact O-O 3.1Å; E314-I319 HydrophobicContact CB-CD1 4.24Å; L317-I319 HydrophobicContact CB-CG1 4.49Å; L317-I319 HydrophobicContact CD2-CD1 3.95Å; L317-I319 HydrophobicContact CD2-CG1 3.87Å; L317-I319 HydrophobicContact CG-CD1 4.35Å; L317-I319 HydrophobicContact CG-CG1 3.85Å; I319-T330 HydrophobicContact CG2-CG2 3.62Å; I319-L331 WeakPolarHBondContact CA-O 3.11Å
320	I	95.1	Very high	91	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.6	176.6	-39.6	176.4	0	0	0	108.8	M284 V291 F303 I308 F318 V322 L331 F333	M284-I320 HydrophobicContact CE-CD1 4.4Å; V291-I320 HydrophobicContact CB-CD1 4.18Å; V291-I320 HydrophobicContact CG1-CD1 3.88Å; V291-I320 HydrophobicContact CG2-CD1 4.3Å; F303-I320 HydrophobicContact CD2-CD1 4.28Å; I308-I320 HydrophobicContact CB-CG2 4.45Å; I308-I320 HydrophobicContact CD1-CG2 4.04Å; I308-I320 HydrophobicContact CG1-CG2 3.91Å; I308-I320 HydrophobicContact CG2-CG2 3.78Å; F318-I320 HydrophobicContact CD1-CG1 4.25Å; F318-I320 HydrophobicContact CE1-CD1 3.75Å; F318-I320 HydrophobicContact CE1-CG1 3.67Å; F318-I320 HydrophobicContact CZ-CD1 4.36Å; F318-I320 HydrophobicContact CZ-CG1 4.04Å; I320-V322 HydrophobicContact CB-CG2 4.21Å; I320-V322 HydrophobicContact CG2-CG2 3.61Å; I320-L331 PolarHBondContact N-O 3.44Å; I320-L331 PolarHBondContact O-N 3.13Å; I320-F333 HydrophobicContact CD1-CD2 4.43Å; I320-F333 HydrophobicContact CD1-CE2 4.04Å; I320-F333 HydrophobicContact CG1-CE2 4.49Å
321	Q	94.1	Very high	91.1	Very high	63 Å²	63	72 Å²	72	29%	0.294	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	112.7	168.2	-54.1	-163.2	-69.4	0	0	108.6	I308 N309 K310 H329 T330	I308-Q321 CarbonylContact C-O 3.59Å; N309-Q321 PolarHBondContact N-O 3.4Å; K310-Q321 HydrophobicContact CB-CB 4.12Å; K310-Q321 HydrophobicContact CB-CG 4.23Å; K310-Q321 PolarHBondContact N-O 3.45Å; K310-Q321 PolarHBondContact O-N 2.81Å; Q321-H329 CarbonylContact C-O 3.59Å; Q321-H329 WeakPolarHBondContact CA-O 3.39Å; Q321-T330 HydrophobicContact CG-CG2 4.13Å; Q321-T330 PolarHBondContact NE2-OG1 2.87Å
322	V	93.6	Very high	91	Very high	5 Å²	5	71.5 Å²	71.5	3%	0.03	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.7	-174	-170.9	0	0	0	0	109.2	F303 K307 I308 I320 H329 L331	F303-V322 HydrophobicContact CB-CG2 4.36Å; F303-V322 HydrophobicContact CD1-CG1 4.26Å; F303-V322 HydrophobicContact CD1-CG2 4.02Å; F303-V322 HydrophobicContact CG-CG2 4.3Å; K307-V322 HydrophobicContact CB-CG1 3.97Å; K307-V322 CarbonylContact O-C 3.49Å; K307-V322 WeakPolarHBondContact O-CA 3.4Å; I308-V322 HydrophobicContact CG1-CG2 4.41Å; I320-V322 HydrophobicContact CB-CG2 4.21Å; I320-V322 HydrophobicContact CG2-CG2 3.61Å; V322-H329 PolarHBondContact N-O 2.99Å; V322-H329 PolarHBondContact O-N 2.71Å; V322-L331 HydrophobicContact CG2-CD1 4.24Å
323	E	90.1	Very high	91.2	Very high	73 Å²	73	71.8 Å²	71.8	34%	0.341	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	126	168.2	-149.2	151.4	120.2	0	0	110.9	K307 N309 R327 R328	K307-E323 PolarHBondContact O-N 3.39Å; N309-E323 PolarHBondContact ND2-OE2 3.45Å; E323-R327 WeakPolarHBondContact CA-O 3.23Å; E323-R328 IonicContact OE2-NE 3.41Å; E323-R328 PolarHBondContact OE2-NE 3.26Å; E323-R328 IonicContact OE2-NH2 2.7Å
324	W	81.8	Confident	91.3	Very high	130 Å²	130	75.6 Å²	75.6	49%	0.492	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	131.3	179.1	-170.5	-86	0	0	0	108.1	Q326 R327	W324-Q326 PolarHBondContact O-N 3.36Å; W324-R327 PolarHBondContact N-O 3.33Å; W324-R327 CarbonylContact O-C 3.18Å; W324-R327 WeakPolarHBondContact O-CA 3.45Å; W324-R327 WeakPolarHBondContact O-CB 2.98Å; W324-R327 PolarHBondContact O-N 2.85Å
325	E	83.1	Confident	91.4	Very high	143 Å²	143	70.1 Å²	70.1	67%	0.668	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	42.9	-177.4	-67.9	159.9	-150.6	0	0	113.5	R327	E325-R327 PolarHBondContact O-N 2.93Å
326	Q	78.3	Confident	91.5	Very high	188 Å²	188	71.9 Å²	71.9	88%	0.879	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	7.8	-174.6	-53.1	178.5	1	0	0	115.2	W324	W324-Q326 PolarHBondContact O-N 3.36Å
327	R	84.7	Confident	91.5	Very high	173 Å²	173	69.4 Å²	69.4	65%	0.653	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	150.6	178.7	-68.1	172.9	175.5	175.3	-0.8	110.6	E323 W324 E325 H329	E323-R327 WeakPolarHBondContact CA-O 3.23Å; W324-R327 PolarHBondContact N-O 3.33Å; W324-R327 CarbonylContact O-C 3.18Å; W324-R327 WeakPolarHBondContact O-CA 3.45Å; W324-R327 WeakPolarHBondContact O-CB 2.98Å; W324-R327 PolarHBondContact O-N 2.85Å; E325-R327 PolarHBondContact O-N 2.93Å; R327-H329 PolarHBondContact O-CD2 2.87Å
328	R	88	Confident	91.4	Very high	176 Å²	176	69.1 Å²	69.1	66%	0.664	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	102.8	-179.3	-72.5	-178.6	173.1	168.9	-3.2	111.2	N309 E323	N309-R328 PolarHBondContact OD1-NH2 3.11Å; E323-R328 IonicContact OE2-NE 3.41Å; E323-R328 PolarHBondContact OE2-NE 3.26Å; E323-R328 IonicContact OE2-NH2 2.7Å
329	H	91.5	Very high	91.2	Very high	84 Å²	84	72.4 Å²	72.4	39%	0.389	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.8	179.3	-67.7	-103.3	0	0	0	110.2	Q321 V322 R327	Q321-H329 CarbonylContact C-O 3.59Å; Q321-H329 WeakPolarHBondContact CA-O 3.39Å; V322-H329 PolarHBondContact N-O 2.99Å; V322-H329 PolarHBondContact O-N 2.71Å; R327-H329 PolarHBondContact O-CD2 2.87Å
330	T	93.3	Very high	91.2	Very high	58 Å²	58	72.2 Å²	72.2	36%	0.356	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	97.3	179.1	-60.7	0	0	0	0	110.5	R277 I319 Q321	R277-T330 PolarHBondContact NH2-O 2.93Å; I319-T330 HydrophobicContact CG2-CG2 3.62Å; Q321-T330 HydrophobicContact CG-CG2 4.13Å; Q321-T330 PolarHBondContact NE2-OG1 2.87Å
331	L	93.6	Very high	91.1	Very high	50 Å²	50	72.2 Å²	72.2	26%	0.262	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	146	179.1	-54.6	179.3	0	0	0	110.1	F303 I319 I320 V322 F333	F303-L331 HydrophobicContact CD1-CD1 4.05Å; F303-L331 HydrophobicContact CE1-CD1 3.33Å; F303-L331 HydrophobicContact CE2-CD1 4.12Å; F303-L331 HydrophobicContact CZ-CD1 3.37Å; I319-L331 WeakPolarHBondContact CA-O 3.11Å; I320-L331 PolarHBondContact N-O 3.44Å; I320-L331 PolarHBondContact O-N 3.13Å; V322-L331 HydrophobicContact CG2-CD1 4.24Å; L331-F333 HydrophobicContact CB-CE2 3.79Å; L331-F333 HydrophobicContact CB-CZ 4.28Å
332	G	94.2	Very high	91.1	Very high	0 Å²	0	71 Å²	71	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	115.4	-175	0	0	0	0	0	111.8	F318	F318-G332 CarbonylContact O-C 3.53Å; F318-G332 WeakPolarHBondContact O-CA 3.23Å
333	F	96.1	Very high	91.1	Very high	7 Å²	7	70.9 Å²	70.9	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.5	-175.2	-58.7	-87.2	0	0	0	110.1	V274 Q275 M284 T293 F303 F318 I320 L331	V274-F333 HydrophobicContact CB-CB 4.18Å; V274-F333 HydrophobicContact CG2-CB 4.21Å; V274-F333 HydrophobicContact CG2-CD1 4.18Å; Q275-F333 CarbonylContact O-C 3.57Å; Q275-F333 WeakPolarHBondContact O-CA 3.37Å; M284-F333 HydrophobicContact CE-CB 4.32Å; M284-F333 HydrophobicContact CE-CD1 3.98Å; M284-F333 HydrophobicContact CE-CD2 3.55Å; M284-F333 HydrophobicContact CE-CE1 4.13Å; M284-F333 HydrophobicContact CE-CE2 3.71Å; M284-F333 HydrophobicContact CE-CG 3.68Å; M284-F333 HydrophobicContact CE-CZ 4Å; T293-F333 HydrophobicContact CG2-CE1 4.2Å; T293-F333 HydrophobicContact CG2-CZ 4.37Å; F303-F333 HydrophobicContact CE2-CE2 4.48Å; F303-F333 HydrophobicContact CE2-CZ 4.06Å; F303-F333 HydrophobicContact CZ-CZ 4.42Å; F318-F333 HydrophobicContact CD1-CD2 4.47Å; F318-F333 PolarHBondContact N-O 2.98Å; F318-F333 PolarHBondContact O-N 2.79Å; I320-F333 HydrophobicContact CD1-CD2 4.43Å; I320-F333 HydrophobicContact CD1-CE2 4.04Å; I320-F333 HydrophobicContact CG1-CE2 4.49Å; L331-F333 HydrophobicContact CB-CE2 3.79Å; L331-F333 HydrophobicContact CB-CZ 4.28Å
334	K	96.4	Very high	91.3	Very high	107 Å²	107	67.5 Å²	67.5	47%	0.465	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	114.2	-178.1	171.5	-171.2	167	-152.8	0	109.8	Q275 L317	Q275-K334 HydrophobicContact CB-CB 4.29Å; Q275-K334 PolarHBondContact N-O 3.37Å; Q275-K334 PolarHBondContact O-N 3.47Å; L317-K334 HydrophobicContact CD1-CB 4.44Å
335	C	95.2	Very high	92	Very high	6 Å²	6	61.3 Å²	61.3	4%	0.041	29%	0.291	C	S	.	.			trans	-85.9	163.6	176.8	-49.5	0	0	0	0	111.6	K316 T337 S340 A341	K316-C335 PolarHBondContact O-N 2.94Å; C335-T337 PolarHBondContact O-N 2.83Å; C335-S340 VanDerWaalsContact CB-OG 3.24Å; C335-S340 WeakPolarHBondContact CB-OG 3.47Å; C335-A341 HydrophobicContact CB-CB 4.12Å
336	P	93	Very high	92.5	Very high	69 Å²	69	55.5 Å²	55.5	45%	0.448	26%	0.264	S	S	.	.	S	Bend	trans	-60.4	-41.1	-179.9	-26.9	36.3	0	0	0	114.2	Y273 K316	Y273-P336 HydrophobicContact CD1-CG 4.06Å; Y273-P336 WeakPolarHBondContact O-CD 3.32Å; K316-P336 WeakPolarHBondContact CD-O 3.49Å; K316-P336 VanDerWaalsContact CE-O 3.3Å; K316-P336 WeakPolarHBondContact CE-O 3.44Å; K316-P336 PolarHBondContact NZ-O 3.43Å
337	T	93.4	Very high	93.2	Very high	51 Å²	51	47 Å²	47	31%	0.313	22%	0.224	S	C	.	.	S	Bend	trans	-133.5	153.5	-175.8	65.8	0	0	0	0	111.1	C335 E339 S340 A341	C335-T337 PolarHBondContact O-N 2.83Å; T337-E339 WeakPolarHBondContact CB-OE2 3.49Å; T337-E339 PolarHBondContact O-N 3.38Å; T337-S340 PolarHBondContact N-OG 3.19Å; T337-S340 VanDerWaalsContact N-OG 3.14Å; T337-S340 PolarHBondContact O-N 2.68Å; T337-S340 PolarHBondContact O-OG 2.87Å; T337-S340 VanDerWaalsContact OG1-CB 3.31Å; T337-S340 WeakPolarHBondContact OG1-CB 3.13Å; T337-S340 PolarHBondContact OG1-N 2.84Å; T337-S340 PolarHBondContact OG1-OG 3.42Å; T337-A341 PolarHBondContact O-N 2.74Å
338	P	92.6	Very high	93.8	Very high	50 Å²	50	38.8 Å²	38.8	33%	0.325	19%	0.193	S	C	.	.	H	α-helix	trans	-64.1	-29.7	174.6	26.8	-32.8	0	0	0	112.3	G315 S340 A341 E342	G315-P338 VanDerWaalsContact O-CA 3.31Å; G315-P338 WeakPolarHBondContact O-CA 3.31Å; G315-P338 WeakPolarHBondContact O-CB 3.32Å; P338-S340 VanDerWaalsContact C-N 3.33Å; P338-S340 PolarHBondContact O-N 2.86Å; P338-A341 PolarHBondContact O-N 3.01Å; P338-E342 PolarHBondContact O-N 2.95Å
339	E	92.4	Very high	94	Very high	70 Å²	70	30.6 Å²	30.6	33%	0.327	16%	0.162	S	C	.	.	H	α-helix	trans	-62.9	-38.3	173.3	-63.1	71.8	-158.4	0	0	111.7	Q127 T337 A343	Q127-E339 HydrophobicContact CB-CB 4.28Å; Q127-E339 HydrophobicContact CG-CB 4.26Å; T337-E339 WeakPolarHBondContact CB-OE2 3.49Å; T337-E339 PolarHBondContact O-N 3.38Å; E339-A343 VanDerWaalsContact O-CB 3.31Å; E339-A343 WeakPolarHBondContact O-CB 3.44Å; E339-A343 PolarHBondContact O-N 3.36Å
340	S	94	Very high	94.1	Very high	13 Å²	13	26.7 Å²	26.7	9%	0.091	14%	0.144	C	C	.	.	H	α-helix	trans	-70.6	-34.8	175.6	68.7	0	0	0	0	112.8	C335 T337 P338 L344	C335-S340 VanDerWaalsContact CB-OG 3.24Å; C335-S340 WeakPolarHBondContact CB-OG 3.47Å; T337-S340 PolarHBondContact N-OG 3.19Å; T337-S340 VanDerWaalsContact N-OG 3.14Å; T337-S340 PolarHBondContact O-N 2.68Å; T337-S340 PolarHBondContact O-OG 2.87Å; T337-S340 VanDerWaalsContact OG1-CB 3.31Å; T337-S340 WeakPolarHBondContact OG1-CB 3.13Å; T337-S340 PolarHBondContact OG1-N 2.84Å; T337-S340 PolarHBondContact OG1-OG 3.42Å; P338-S340 VanDerWaalsContact C-N 3.33Å; P338-S340 PolarHBondContact O-N 2.86Å; S340-L344 VanDerWaalsContact O-CB 3.26Å; S340-L344 WeakPolarHBondContact O-CB 3.48Å; S340-L344 PolarHBondContact O-N 2.86Å
341	A	94.3	Very high	94.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.9	-39.5	174.1	0	0	0	0	0	112.1	Y313 C335 T337 P338 W345	Y313-A341 HydrophobicContact CD2-CB 4.21Å; C335-A341 HydrophobicContact CB-CB 4.12Å; T337-A341 PolarHBondContact O-N 2.74Å; P338-A341 PolarHBondContact O-N 3.01Å; A341-W345 WeakPolarHBondContact O-CB 3.44Å; A341-W345 PolarHBondContact O-N 2.89Å
342	E	93.6	Very high	94.2	Very high	39 Å²	39	24 Å²	24	18%	0.182	13%	0.125	C	C	.	.	H	α-helix	trans	-63.7	-45.7	172.1	-179.8	179.8	135.9	0	0	111.6	Y313 P338 W345 K346 Q377	Y313-E342 HydrophobicContact CD2-CB 4.3Å; Y313-E342 HydrophobicContact CE1-CG 4.4Å; Y313-E342 HydrophobicContact CE2-CB 3.63Å; Y313-E342 HydrophobicContact CE2-CG 4.22Å; Y313-E342 PolarHBondContact OH-OE2 2.9Å; P338-E342 PolarHBondContact O-N 2.95Å; E342-W345 PolarHBondContact O-N 2.96Å; E342-K346 HydrophobicContact CG-CD 4.48Å; E342-K346 WeakPolarHBondContact O-CG 3.46Å; E342-K346 PolarHBondContact O-N 2.85Å; E342-K346 VanDerWaalsContact OE1-CE 3.27Å; E342-K346 WeakPolarHBondContact OE1-CE 3.41Å; E342-K346 IonicContact OE1-NZ 2.84Å; E342-K346 PolarHBondContact OE1-NZ 3.04Å; E342-Q377 PolarHBondContact OE1-OE1 2.73Å; E342-Q377 PolarHBondContact OE2-NE2 3.34Å; E342-Q377 PolarHBondContact OE2-OE1 3.05Å
343	A	93.4	Very high	94.2	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-58.5	-55.7	177.5	0	0	0	0	0	110.6	Q127 E339 W345 K346 W347	Q127-A343 HydrophobicContact CG-CB 4.15Å; E339-A343 VanDerWaalsContact O-CB 3.31Å; E339-A343 WeakPolarHBondContact O-CB 3.44Å; E339-A343 PolarHBondContact O-N 3.36Å; A343-W345 VanDerWaalsContact C-N 3.28Å; A343-W345 PolarHBondContact O-N 3.33Å; A343-K346 PolarHBondContact O-N 3.45Å; A343-K346 VanDerWaalsContact O-N 3.11Å; A343-W347 HydrophobicContact CB-CZ2 4.21Å; A343-W347 WeakPolarHBondContact O-CB 3.29Å; A343-W347 PolarHBondContact O-N 3.38Å; A343-W347 PolarHBondContact O-NE1 2.95Å
344	L	94.9	Very high	94.2	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-55.3	-41.1	177.9	175.8	50.9	0	0	0	112.3	L272 V274 M284 L286 F318 S340 W347 A348	L272-L344 HydrophobicContact CD1-CB 4.19Å; L272-L344 HydrophobicContact CD1-CD1 3.89Å; L272-L344 HydrophobicContact CD1-CD2 4.23Å; L272-L344 HydrophobicContact CD1-CG 4.32Å; V274-L344 HydrophobicContact CG1-CD2 4.48Å; M284-L344 HydrophobicContact SD-CD1 4.39Å; M284-L344 HydrophobicContact SD-CD2 3.87Å; L286-L344 HydrophobicContact CD1-CD1 4.03Å; L286-L344 HydrophobicContact CD2-CD1 4.07Å; L286-L344 HydrophobicContact CG-CD1 4.28Å; F318-L344 HydrophobicContact CB-CD2 4.17Å; F318-L344 HydrophobicContact CD1-CD2 3.65Å; F318-L344 HydrophobicContact CD1-CG 3.97Å; F318-L344 HydrophobicContact CD2-CD2 4.31Å; F318-L344 HydrophobicContact CD2-CG 3.95Å; F318-L344 HydrophobicContact CE1-CD1 4.32Å; F318-L344 HydrophobicContact CE1-CD2 4.04Å; F318-L344 HydrophobicContact CE1-CG 3.98Å; F318-L344 HydrophobicContact CE2-CG 3.97Å; F318-L344 HydrophobicContact CG-CD2 3.79Å; F318-L344 HydrophobicContact CG-CG 3.95Å; F318-L344 HydrophobicContact CZ-CD1 4.28Å; F318-L344 HydrophobicContact CZ-CG 3.99Å; S340-L344 VanDerWaalsContact O-CB 3.26Å; S340-L344 WeakPolarHBondContact O-CB 3.48Å; S340-L344 PolarHBondContact O-N 2.86Å; L344-W347 PolarHBondContact O-N 3.07Å; L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.29Å; L344-A348 PolarHBondContact O-N 3.43Å
345	W	95	Very high	94	Very high	1 Å²	1	20 Å²	20	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-60.1	-50.4	174	171.4	68.2	0	0	0	113.1	I311 S312 Y313 F318 A341 E342 A343 W347 A348 V349 S366 A368	I311-W345 PolarHBondContact O-NE1 2.88Å; I311-W345 VanDerWaalsContact O-NE1 3.16Å; S312-W345 VanDerWaalsContact CA-CD1 3.46Å; Y313-W345 HydrophobicContact CD1-CB 3.72Å; Y313-W345 AromaticContact CD1-CD2 3.59Å; Y313-W345 HydrophobicContact CD1-CD2 3.59Å; Y313-W345 AromaticContact CD1-CE3 3.72Å; Y313-W345 HydrophobicContact CD1-CE3 3.72Å; Y313-W345 AromaticContact CD1-CG 3.58Å; Y313-W345 HydrophobicContact CD1-CG 3.58Å; Y313-W345 AromaticContact CE1-CD2 3.8Å; Y313-W345 HydrophobicContact CE1-CD2 3.8Å; Y313-W345 AromaticContact CE1-CE3 3.43Å; Y313-W345 HydrophobicContact CE1-CE3 3.43Å; Y313-W345 VanDerWaalsContact CE1-CE3 3.43Å; Y313-W345 HydrophobicContact CE1-CG 4.26Å; Y313-W345 AromaticContact CE1-CZ3 3.94Å; Y313-W345 HydrophobicContact CE1-CZ3 3.94Å; Y313-W345 HydrophobicContact CG-CB 4.13Å; Y313-W345 HydrophobicContact CG-CG 4.4Å; F318-W345 HydrophobicContact CD2-CB 4.33Å; F318-W345 HydrophobicContact CE2-CB 4.34Å; A341-W345 WeakPolarHBondContact O-CB 3.44Å; A341-W345 PolarHBondContact O-N 2.89Å; E342-W345 PolarHBondContact O-N 2.96Å; A343-W345 VanDerWaalsContact C-N 3.28Å; A343-W345 PolarHBondContact O-N 3.33Å; W345-W347 VanDerWaalsContact C-N 3.3Å; W345-W347 PolarHBondContact O-N 2.9Å; W345-A348 PolarHBondContact O-N 3.24Å; W345-V349 WeakPolarHBondContact O-CG2 3.41Å; W345-V349 PolarHBondContact O-N 2.79Å; W345-S366 WeakPolarHBondContact CH2-O 3.34Å; W345-S366 WeakPolarHBondContact CZ2-O 3.15Å; W345-A368 HydrophobicContact CH2-CB 3.91Å; W345-A368 HydrophobicContact CZ2-CB 4.11Å; W345-A368 HydrophobicContact CZ3-CB 4.22Å
346	K	94	Very high	93.9	Very high	20 Å²	20	21.2 Å²	21.2	9%	0.087	12%	0.117	C	C	.	.	H	α-helix	trans	-58.1	-44.8	175.5	-66.6	175.7	-173.1	171.3	0	111	E132 E342 A343 A348 D350 Y379	E132-K346 IonicContact OE1-NZ 3.16Å; E132-K346 PolarHBondContact OE1-NZ 3.36Å; E132-K346 VanDerWaalsContact OE1-NZ 3.15Å; E342-K346 HydrophobicContact CG-CD 4.48Å; E342-K346 WeakPolarHBondContact O-CG 3.46Å; E342-K346 PolarHBondContact O-N 2.85Å; E342-K346 VanDerWaalsContact OE1-CE 3.27Å; E342-K346 WeakPolarHBondContact OE1-CE 3.41Å; E342-K346 IonicContact OE1-NZ 2.84Å; E342-K346 PolarHBondContact OE1-NZ 3.04Å; A343-K346 PolarHBondContact O-N 3.45Å; A343-K346 VanDerWaalsContact O-N 3.11Å; K346-A348 PolarHBondContact O-N 3.31Å; K346-D350 WeakPolarHBondContact O-CB 3.3Å; K346-D350 PolarHBondContact O-N 2.93Å; K346-Y379 HydrophobicContact CB-CD2 3.98Å; K346-Y379 HydrophobicContact CB-CE2 4.1Å; K346-Y379 HydrophobicContact CB-CG 4.49Å; K346-Y379 HydrophobicContact CD-CD2 4.16Å; K346-Y379 HydrophobicContact CG-CD2 3.72Å; K346-Y379 HydrophobicContact CG-CE2 4.27Å; K346-Y379 HydrophobicContact CG-CG 4.28Å
347	W	94.5	Very high	93.9	Very high	11 Å²	11	19.8 Å²	19.8	4%	0.042	11%	0.105	C	C	.	.	H	α-helix	trans	-67.1	-33.8	-176.1	-62.6	6.3	0	0	0	113.6	R128 W130 L272 L286 A343 L344 W345 R351	R128-W347 HydrophobicContact CB-CH2 4.03Å; R128-W347 HydrophobicContact CB-CZ2 4.12Å; R128-W347 VanDerWaalsContact O-CZ2 3.3Å; R128-W347 WeakPolarHBondContact O-CZ2 3.19Å; W130-W347 AromaticContact CD1-CD1 3.64Å; W130-W347 AromaticContact CD1-CE2 3.85Å; W130-W347 AromaticContact CD1-NE1 3.44Å; L272-W347 HydrophobicContact CD1-CE3 4.16Å; L272-W347 HydrophobicContact CD1-CZ3 3.89Å; L272-W347 HydrophobicContact CD2-CZ3 4.22Å; L272-W347 HydrophobicContact CG-CZ3 4.43Å; L286-W347 HydrophobicContact CD1-CB 3.68Å; A343-W347 HydrophobicContact CB-CZ2 4.21Å; A343-W347 WeakPolarHBondContact O-CB 3.29Å; A343-W347 PolarHBondContact O-N 3.38Å; A343-W347 PolarHBondContact O-NE1 2.95Å; L344-W347 PolarHBondContact O-N 3.07Å; W345-W347 VanDerWaalsContact C-N 3.3Å; W345-W347 PolarHBondContact O-N 2.9Å; W347-R351 WeakPolarHBondContact O-CG 3.28Å; W347-R351 PolarHBondContact O-N 3.2Å; W347-R351 PolarHBondContact O-NH1 2.8Å
348	A	95.4	Very high	93.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-79.5	-41.1	178.4	0	0	0	0	0	111.5	L286 W305 I311 F318 L344 W345 K346 R351 Q352	L286-A348 HydrophobicContact CD1-CB 4.17Å; L286-A348 HydrophobicContact CD2-CB 3.94Å; W305-A348 HydrophobicContact CH2-CB 4.38Å; W305-A348 HydrophobicContact CZ3-CB 4.47Å; W305-A348 WeakPolarHBondContact CZ3-O 3.42Å; I311-A348 HydrophobicContact CD1-CB 3.87Å; I311-A348 HydrophobicContact CG2-CB 4.24Å; F318-A348 HydrophobicContact CE2-CB 4.33Å; F318-A348 HydrophobicContact CZ-CB 3.97Å; L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.29Å; L344-A348 PolarHBondContact O-N 3.43Å; W345-A348 PolarHBondContact O-N 3.24Å; K346-A348 PolarHBondContact O-N 3.31Å; A348-R351 PolarHBondContact O-N 3.21Å; A348-Q352 WeakPolarHBondContact O-CB 3.3Å; A348-Q352 PolarHBondContact O-N 3.48Å
349	V	93.8	Very high	93.5	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.024	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-45.7	172.7	170.3	0	0	0	0	111.2	I311 W345 R351 Q352 C353 S366 Y379	I311-V349 HydrophobicContact CB-CG2 4.16Å; W345-V349 WeakPolarHBondContact O-CG2 3.41Å; W345-V349 PolarHBondContact O-N 2.79Å; V349-R351 PolarHBondContact O-N 2.81Å; V349-Q352 PolarHBondContact O-N 3.32Å; V349-C353 WeakPolarHBondContact O-CB 3.4Å; V349-C353 PolarHBondContact O-N 2.81Å; V349-C353 PolarHBondContact O-SG 2.8Å; V349-C353 VanDerWaalsContact O-SG 3.4Å; V349-S366 VanDerWaalsContact CG1-OG 3.27Å; V349-S366 WeakPolarHBondContact CG1-OG 3.1Å; V349-Y379 HydrophobicContact CB-CD1 4.23Å; V349-Y379 HydrophobicContact CG1-CD1 3.68Å; V349-Y379 HydrophobicContact CG1-CE1 4.24Å
350	D	93.9	Very high	93.2	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.011	12%	0.117	C	C	.	.	H	α-helix	trans	-56.4	-45.7	177.7	174.4	68.6	0	0	0	112.7	K154 H155 K346 F354 Y379	K154-D350 WeakPolarHBondContact CE-OD2 3.28Å; K154-D350 IonicContact NZ-OD1 3.79Å; K154-D350 PolarHBondContact NZ-OD1 3.18Å; K154-D350 IonicContact NZ-OD2 2.73Å; K154-D350 PolarHBondContact NZ-OD2 2.93Å; H155-D350 IonicContact CE1-OD2 2.66Å; H155-D350 PolarHBondContact CE1-OD2 3.29Å; H155-D350 IonicContact NE2-OD2 3.78Å; K346-D350 WeakPolarHBondContact O-CB 3.3Å; K346-D350 PolarHBondContact O-N 2.93Å; D350-F354 WeakPolarHBondContact O-CB 3.39Å; D350-F354 PolarHBondContact O-N 3.08Å; D350-Y379 HydrophobicContact CB-CE1 3.98Å; D350-Y379 PolarHBondContact OD1-OH 2.91Å
351	R	94.4	Very high	92.8	Very high	15 Å²	15	28.5 Å²	28.5	6%	0.057	15%	0.145	C	C	.	.	H	α-helix	trans	-69	-43	174.5	-76.1	171.9	-177.3	70.5	4.3	112.6	K154 W305 W347 A348 V349 C353 F354 F355	K154-R351 PolarHBondContact O-NH2 3.42Å; W305-R351 HydrophobicContact CH2-CB 3.86Å; W305-R351 HydrophobicContact CZ2-CB 3.6Å; W347-R351 WeakPolarHBondContact O-CG 3.28Å; W347-R351 PolarHBondContact O-N 3.2Å; W347-R351 PolarHBondContact O-NH1 2.8Å; A348-R351 PolarHBondContact O-N 3.21Å; V349-R351 PolarHBondContact O-N 2.81Å; R351-C353 VanDerWaalsContact C-N 3.29Å; R351-C353 PolarHBondContact O-N 2.68Å; R351-F354 PolarHBondContact O-N 2.8Å; R351-F354 VanDerWaalsContact O-N 3.14Å; R351-F355 HydrophobicContact CB-CD2 4.13Å; R351-F355 HydrophobicContact CB-CE2 4.13Å; R351-F355 HydrophobicContact CG-CE2 4.16Å; R351-F355 WeakPolarHBondContact O-CD2 3.37Å; R351-F355 PolarHBondContact O-N 2.83Å
352	Q	94.4	Very high	92.4	Very high	36 Å²	36	31.6 Å²	31.6	17%	0.168	16%	0.162	C	C	.	.	H	α-helix	trans	-57.1	-45.8	176.2	-168.8	175.7	28.9	0	0	110.6	W305 I308 I311 A348 V349 T356	W305-Q352 HydrophobicContact CD2-CB 4.38Å; W305-Q352 HydrophobicContact CE3-CB 3.67Å; W305-Q352 HydrophobicContact CE3-CG 3.94Å; W305-Q352 HydrophobicContact CZ3-CB 3.94Å; W305-Q352 PolarHBondContact O-NE2 3.01Å; I308-Q352 PolarHBondContact O-NE2 3.12Å; I311-Q352 HydrophobicContact CD1-CB 4.37Å; A348-Q352 WeakPolarHBondContact O-CB 3.3Å; A348-Q352 PolarHBondContact O-N 3.48Å; V349-Q352 PolarHBondContact O-N 3.32Å; Q352-T356 HydrophobicContact CG-CG2 4.1Å; Q352-T356 VanDerWaalsContact O-CB 3.32Å; Q352-T356 WeakPolarHBondContact O-CB 3.38Å; Q352-T356 WeakPolarHBondContact O-CG2 3.46Å; Q352-T356 PolarHBondContact O-N 2.68Å; Q352-T356 PolarHBondContact O-OG1 3.28Å
353	C	94	Very high	91.8	Very high	15 Å²	15	31 Å²	31	10%	0.101	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-44.6	174.7	-71.5	0	0	0	0	112.7	V349 R351 L357 F381	V349-C353 WeakPolarHBondContact O-CB 3.4Å; V349-C353 PolarHBondContact O-N 2.81Å; V349-C353 PolarHBondContact O-SG 2.8Å; V349-C353 VanDerWaalsContact O-SG 3.4Å; R351-C353 VanDerWaalsContact C-N 3.29Å; R351-C353 PolarHBondContact O-N 2.68Å; C353-L357 HydrophobicContact CB-CD1 3.84Å; C353-L357 WeakPolarHBondContact O-CB 2.69Å; C353-L357 WeakPolarHBondContact O-CD1 3.49Å; C353-L357 VanDerWaalsContact O-CG 3.31Å; C353-L357 WeakPolarHBondContact O-CG 3.14Å; C353-L357 PolarHBondContact O-N 2.85Å; C353-F381 HydrophobicContact CB-CB 3.9Å; C353-F381 HydrophobicContact CB-CD1 4.13Å; C353-F381 HydrophobicContact CB-CD2 3.56Å; C353-F381 HydrophobicContact CB-CE2 4.08Å; C353-F381 HydrophobicContact CB-CG 3.59Å
354	F	94.6	Very high	91.2	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-46.9	-178.8	-175.2	-94.5	0	0	0	113.5	Y116 H155 D350 R351 F381 R384 C385 Q386 L389	Y116-F354 HydrophobicContact CD1-CE1 4.16Å; Y116-F354 AromaticContact CD1-CZ 3.8Å; Y116-F354 HydrophobicContact CD1-CZ 3.8Å; Y116-F354 HydrophobicContact CD2-CZ 4.21Å; Y116-F354 AromaticContact CE1-CE1 3.86Å; Y116-F354 HydrophobicContact CE1-CE1 3.86Å; Y116-F354 AromaticContact CE1-CZ 3.66Å; Y116-F354 HydrophobicContact CE1-CZ 3.66Å; Y116-F354 HydrophobicContact CE2-CZ 4.14Å; Y116-F354 HydrophobicContact CG-CZ 4.08Å; Y116-F354 AromaticContact CZ-CZ 3.85Å; H155-F354 HydrophobicContact CB-CD1 3.78Å; H155-F354 HydrophobicContact CB-CE1 3.59Å; H155-F354 HydrophobicContact CB-CE2 4.41Å; H155-F354 HydrophobicContact CB-CG 4.28Å; H155-F354 HydrophobicContact CB-CZ 3.93Å; H155-F354 AromaticContact CD2-CD2 3.44Å; H155-F354 VanDerWaalsContact CD2-CD2 3.44Å; H155-F354 WeakPolarHBondContact CD2-CD2 3.42Å; H155-F354 AromaticContact CD2-CE2 3.64Å; H155-F354 AromaticContact CD2-CG 3.67Å; H155-F354 VanDerWaalsContact CE1-CB 3.46Å; H155-F354 WeakPolarHBondContact CE1-CB 3.37Å; H155-F354 AromaticContact CE1-CG 3.68Å; H155-F354 AromaticContact CG-CD1 3.62Å; H155-F354 AromaticContact CG-CD2 3.86Å; H155-F354 AromaticContact CG-CE1 3.86Å; H155-F354 AromaticContact CG-CG 3.62Å; H155-F354 AromaticContact ND1-CD1 3.78Å; H155-F354 AromaticContact ND1-CG 3.63Å; H155-F354 AromaticContact NE2-CD2 3.58Å; H155-F354 AromaticContact NE2-CG 3.73Å; D350-F354 WeakPolarHBondContact O-CB 3.39Å; D350-F354 PolarHBondContact O-N 3.08Å; R351-F354 PolarHBondContact O-N 2.8Å; R351-F354 VanDerWaalsContact O-N 3.14Å; F354-F381 HydrophobicContact CB-CE2 4.03Å; F354-F381 HydrophobicContact CB-CZ 4.23Å; F354-F381 HydrophobicContact CD2-CE2 4.5Å; F354-F381 HydrophobicContact CD2-CZ 4.21Å; F354-R384 WeakPolarHBondContact CD2-O 3.09Å; F354-R384 WeakPolarHBondContact CE2-O 3.27Å; F354-C385 WeakPolarHBondContact O-CB 3.48Å; F354-Q386 HydrophobicContact CD1-CB 4.1Å; F354-Q386 HydrophobicContact CE1-CB 3.74Å; F354-Q386 HydrophobicContact CE1-CG 4.16Å; F354-Q386 HydrophobicContact CZ-CB 4.18Å; F354-Q386 WeakPolarHBondContact O-CB 3.37Å; F354-Q386 PolarHBondContact O-N 3.42Å; F354-L389 HydrophobicContact CE2-CD1 3.56Å; F354-L389 HydrophobicContact CZ-CD1 3.75Å
355	F	94.2	Very high	90.3	Very high	15 Å²	15	44.5 Å²	44.5	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-86.8	-30.9	-174.4	-65.6	-67	0	0	0	114	H155 Y156 H288 W305 R351	H155-F355 HydrophobicContact CB-CZ 4.17Å; Y156-F355 WeakPolarHBondContact O-CZ 3.35Å; H288-F355 HydrophobicContact CB-CD1 4.19Å; H288-F355 HydrophobicContact CB-CE1 3.67Å; H288-F355 HydrophobicContact CB-CE2 4.36Å; H288-F355 HydrophobicContact CB-CZ 3.78Å; W305-F355 AromaticContact NE1-CD2 3.81Å; R351-F355 HydrophobicContact CB-CD2 4.13Å; R351-F355 HydrophobicContact CB-CE2 4.13Å; R351-F355 HydrophobicContact CG-CE2 4.16Å; R351-F355 WeakPolarHBondContact O-CD2 3.37Å; R351-F355 PolarHBondContact O-N 2.83Å
356	T	93	Very high	89.4	Confident	31 Å²	31	46.1 Å²	46.1	19%	0.19	24%	0.235	C	C	.	.	H	α-helix	trans	-89	-40.8	-175.3	66.4	0	0	0	0	113.9	W305 Q352 K387	W305-T356 HydrophobicContact CB-CG2 3.66Å; Q352-T356 HydrophobicContact CG-CG2 4.1Å; Q352-T356 VanDerWaalsContact O-CB 3.32Å; Q352-T356 WeakPolarHBondContact O-CB 3.38Å; Q352-T356 WeakPolarHBondContact O-CG2 3.46Å; Q352-T356 PolarHBondContact O-N 2.68Å; Q352-T356 PolarHBondContact O-OG1 3.28Å; T356-K387 PolarHBondContact O-NZ 3.37Å
357	L	91.8	Very high	88.3	Confident	38 Å²	38	51.3 Å²	51.3	20%	0.199	26%	0.258	C	S	.	.			trans	-71.9	145.8	-169.6	-61	175.2	0	0	0	112.4	C353 A363 C385	C353-L357 HydrophobicContact CB-CD1 3.84Å; C353-L357 WeakPolarHBondContact O-CB 2.69Å; C353-L357 WeakPolarHBondContact O-CD1 3.49Å; C353-L357 VanDerWaalsContact O-CG 3.31Å; C353-L357 WeakPolarHBondContact O-CG 3.14Å; C353-L357 PolarHBondContact O-N 2.85Å; L357-A363 HydrophobicContact CD1-CB 3.53Å; L357-C385 HydrophobicContact CB-CB 4.39Å; L357-C385 PolarHBondContact O-SG 2.97Å
358	N	88.6	Confident	86.8	Confident	95 Å²	95	51.4 Å²	51.4	51%	0.508	26%	0.261	S	S	.	.	S	Bend	trans	-80.6	-27	176.1	-67.7	-11.1	0	0	0	112.8	K387	N358-K387 VanDerWaalsContact OD1-CD 3.23Å; N358-K387 WeakPolarHBondContact OD1-CD 3.06Å; N358-K387 PolarHBondContact OD1-NZ 3.41Å
359	R	88.3	Confident	85.1	Confident	130 Å²	130	54.5 Å²	54.5	49%	0.491	28%	0.277	S	S	.	.	S	Bend	trans	-147.2	150.3	173.2	-51.3	171.1	-62.5	-174.7	6.6	110.2	V361 D362 C385	R359-V361 VanDerWaalsContact C-N 3.29Å; R359-V361 HydrophobicContact CB-CG2 3.96Å; R359-V361 PolarHBondContact O-N 3.4Å; R359-D362 WeakPolarHBondContact CB-OD2 3.48Å; R359-D362 IonicContact CZ-OD1 2.86Å; R359-D362 IonicContact CZ-OD2 2.74Å; R359-D362 IonicContact NE-OD1 2.73Å; R359-D362 IonicContact NE-OD2 3.87Å; R359-D362 PolarHBondContact NE-OD2 3.42Å; R359-D362 IonicContact NH2-OD1 3.32Å; R359-D362 PolarHBondContact NH2-OD1 3.4Å; R359-D362 IonicContact NH2-OD2 3.73Å; R359-D362 PolarHBondContact NH2-OD2 3.44Å; R359-D362 PolarHBondContact O-N 2.82Å; R359-C385 VanDerWaalsContact CA-SG 3.52Å
360	S	87.3	Confident	83.2	Confident	30 Å²	30	55.5 Å²	55.5	21%	0.21	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-54.4	-38.4	174.3	52.3	0	0	0	0	114.2	D362 A363 G383 E388	S360-D362 PolarHBondContact O-N 2.74Å; S360-A363 WeakPolarHBondContact O-CB 3.44Å; S360-A363 PolarHBondContact O-N 2.99Å; S360-A363 VanDerWaalsContact O-N 3.12Å; S360-G383 WeakPolarHBondContact CB-O 3.3Å; S360-E388 WeakPolarHBondContact CB-OE2 3.12Å; S360-E388 PolarHBondContact N-OE2 3.45Å; S360-E388 PolarHBondContact OG-OE1 3.28Å; S360-E388 PolarHBondContact OG-OE2 2.97Å
361	V	85.8	Confident	81.3	Confident	112 Å²	112	57.5 Å²	57.5	68%	0.679	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-64.4	-19.3	-179.5	-62.5	0	0	0	0	114.6	R359 A363	R359-V361 VanDerWaalsContact C-N 3.29Å; R359-V361 HydrophobicContact CB-CG2 3.96Å; R359-V361 PolarHBondContact O-N 3.4Å; V361-A363 PolarHBondContact O-N 2.93Å
362	D	85	Confident	79.4	Confident	66 Å²	66	64 Å²	64	35%	0.353	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-83	-4.1	179.2	-56.2	-50.9	0	0	0	111.8	R359 S360 K364	R359-D362 WeakPolarHBondContact CB-OD2 3.48Å; R359-D362 IonicContact CZ-OD1 2.86Å; R359-D362 IonicContact CZ-OD2 2.74Å; R359-D362 IonicContact NE-OD1 2.73Å; R359-D362 IonicContact NE-OD2 3.87Å; R359-D362 PolarHBondContact NE-OD2 3.42Å; R359-D362 IonicContact NH2-OD1 3.32Å; R359-D362 PolarHBondContact NH2-OD1 3.4Å; R359-D362 IonicContact NH2-OD2 3.73Å; R359-D362 PolarHBondContact NH2-OD2 3.44Å; R359-D362 PolarHBondContact O-N 2.82Å; S360-D362 PolarHBondContact O-N 2.74Å; D362-K364 PolarHBondContact O-N 3.23Å
363	A	82.6	Confident	77.8	Confident	27 Å²	27	71.1 Å²	71.1	22%	0.223	38%	0.376	C	S	.	.			trans	-72.3	117	178.8	0	0	0	0	0	112.6	L357 S360 V361 F381	L357-A363 HydrophobicContact CD1-CB 3.53Å; S360-A363 WeakPolarHBondContact O-CB 3.44Å; S360-A363 PolarHBondContact O-N 2.99Å; S360-A363 VanDerWaalsContact O-N 3.12Å; V361-A363 PolarHBondContact O-N 2.93Å; A363-F381 HydrophobicContact CB-CB 4.01Å; A363-F381 HydrophobicContact CB-CD1 4.09Å; A363-F381 HydrophobicContact CB-CG 4.47Å
364	K	79.8	Confident	76	Confident	180 Å²	180	77.7 Å²	77.7	78%	0.783	40%	0.402	S	S	*	.			trans	-88.8	143.9	177.3	-65.4	169.8	-174.3	168.3	0	110.9	D362 S366	D362-K364 PolarHBondContact O-N 3.23Å; K364-S366 PolarHBondContact O-N 2.94Å
365	E	75.9	Confident	74.5	Confident	106 Å²	106	89 Å²	89	50%	0.495	45%	0.445	S	S	.	.			trans	-55.7	115.5	173	-65.7	-167.6	147.5	0	0	111	K367	E365-K367 PolarHBondContact O-N 2.9Å
366	S	76	Confident	72.8	Confident	35 Å²	35	95.5 Å²	95.5	25%	0.245	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	121.1	179	-75.2	0	0	0	0	109.8	W345 V349 K364 F378 Y379	W345-S366 WeakPolarHBondContact CH2-O 3.34Å; W345-S366 WeakPolarHBondContact CZ2-O 3.15Å; V349-S366 VanDerWaalsContact CG1-OG 3.27Å; V349-S366 WeakPolarHBondContact CG1-OG 3.1Å; K364-S366 PolarHBondContact O-N 2.94Å; S366-F378 WeakPolarHBondContact O-CA 3.19Å; S366-Y379 PolarHBondContact N-O 2.92Å; S366-Y379 PolarHBondContact O-N 3.45Å
367	K	70.8	Confident	71.6	Confident	129 Å²	129	97.1 Å²	97.1	56%	0.561	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.6	-173.4	-53.8	-174.6	-178.4	176.6	0	108.9	E365 F378	E365-K367 PolarHBondContact O-N 2.9Å; K367-F378 HydrophobicContact CD-CD1 4.4Å; K367-F378 HydrophobicContact CD-CE1 3.94Å; K367-F378 HydrophobicContact CG-CD1 3.86Å; K367-F378 HydrophobicContact CG-CE1 3.87Å
368	A	62.8	Low	70.9	Confident	13 Å²	13	99.8 Å²	99.8	11%	0.107	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-61	147.1	168.5	0	0	0	0	0	109.8	Y313 W345 G370 Q377	Y313-A368 HydrophobicContact CD1-CB 4.16Å; Y313-A368 HydrophobicContact CE1-CB 3.55Å; W345-A368 HydrophobicContact CH2-CB 3.91Å; W345-A368 HydrophobicContact CZ2-CB 4.11Å; W345-A368 HydrophobicContact CZ3-CB 4.22Å; A368-G370 PolarHBondContact O-N 3.16Å; A368-Q377 HydrophobicContact CB-CB 4.01Å; A368-Q377 WeakPolarHBondContact CB-O 3.5Å; A368-Q377 PolarHBondContact N-O 3.07Å
369	N	60.1	Low	70.7	Confident	64 Å²	64	96.3 Å²	96.3	34%	0.342	46%	0.464	S	S	.	.			trans	-75.6	62.9	175.4	-64.7	-18.5	0	0	0	110.1	K310 S312 G371	K310-N369 PolarHBondContact NZ-OD1 3.37Å; S312-N369 WeakPolarHBondContact CB-ND2 3.11Å; S312-N369 PolarHBondContact OG-ND2 2.9Å; S312-N369 VanDerWaalsContact OG-ND2 3.16Å; N369-G371 PolarHBondContact O-N 3.04Å
370	G	53.8	Low	70.5	Confident	26 Å²	26	93 Å²	93	27%	0.268	46%	0.459	S	S	.	.			trans	-76.7	116.4	177.8	0	0	0	0	0	111.7	A368	A368-G370 PolarHBondContact O-N 3.16Å
371	G	54.2	Low	70.5	Confident	44 Å²	44	92.6 Å²	92.6	45%	0.454	45%	0.454	S	S	.	.			trans	-54.1	153	168.7	0	0	0	0	0	112.5	N369 F373 K374	N369-G371 PolarHBondContact O-N 3.04Å; G371-F373 PolarHBondContact O-N 3.46Å; G371-K374 PolarHBondContact O-N 3.41Å
372	L	55.8	Low	70.5	Confident	152 Å²	152	89.4 Å²	89.4	80%	0.796	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-24.2	-158.3	-65.6	172.1	0	0	0	117
373	F	59.3	Low	70.5	Confident	185 Å²	185	87.7 Å²	87.7	81%	0.811	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-8.9	-177.6	-57.5	-75.8	0	0	0	114.8	G371 L1538	G371-F373 PolarHBondContact O-N 3.46Å; F373-L1538 HydrophobicContact CE1-CD1 4.49Å
374	K	57.2	Low	70.9	Confident	153 Å²	153	88.8 Å²	88.8	67%	0.665	43%	0.431	S	S	*	.	S	Bend	trans	-87.8	136.4	174.2	-71	-178	178.8	175.2	0	109.7	G371 R376	G371-K374 PolarHBondContact O-N 3.41Å; K374-R376 PolarHBondContact O-N 2.92Å
375	R	62.1	Low	71.5	Confident	239 Å²	239	80.2 Å²	80.2	90%	0.902	39%	0.393	S	S	*	.			trans	-54.7	110.7	173.1	-179	177.6	-177.3	162.2	2.6	108.2	Q377	R375-Q377 PolarHBondContact O-N 3.41Å; R375-Q377 VanDerWaalsContact O-N 3.16Å
376	R	59.4	Low	72.3	Confident	151 Å²	151	76.2 Å²	76.2	57%	0.57	37%	0.374	S	S	*	.			trans	-55.2	122.2	-176.4	-71.5	-175.6	177.6	-174.2	-1	109.3	K374 F378	K374-R376 PolarHBondContact O-N 2.92Å; R376-F378 HydrophobicContact CB-CD2 4.38Å; R376-F378 HydrophobicContact CB-CE2 3.58Å; R376-F378 HydrophobicContact CB-CZ 3.83Å; R376-F378 VanDerWaalsContact O-CD2 3.3Å; R376-F378 WeakPolarHBondContact O-CD2 3.46Å; R376-F378 WeakPolarHBondContact O-CE2 3.29Å
377	Q	67.2	Low	73	Confident	64 Å²	64	77.7 Å²	77.7	30%	0.299	38%	0.377	S	S	.	.			trans	-84.8	131.3	171.5	-65.5	-155.7	22.4	0	0	109.5	Y313 E342 A368 R375	Y313-Q377 PolarHBondContact OH-NE2 2.89Å; Y313-Q377 PolarHBondContact OH-OE1 2.72Å; E342-Q377 PolarHBondContact OE1-OE1 2.73Å; E342-Q377 PolarHBondContact OE2-NE2 3.34Å; E342-Q377 PolarHBondContact OE2-OE1 3.05Å; A368-Q377 HydrophobicContact CB-CB 4.01Å; A368-Q377 WeakPolarHBondContact CB-O 3.5Å; A368-Q377 PolarHBondContact N-O 3.07Å; R375-Q377 PolarHBondContact O-N 3.41Å; R375-Q377 VanDerWaalsContact O-N 3.16Å
378	F	78	Confident	73.9	Confident	94 Å²	94	73.9 Å²	73.9	41%	0.412	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.8	173.3	-58.9	-93.2	0	0	0	106.7	S366 K367 R376	S366-F378 WeakPolarHBondContact O-CA 3.19Å; K367-F378 HydrophobicContact CD-CD1 4.4Å; K367-F378 HydrophobicContact CD-CE1 3.94Å; K367-F378 HydrophobicContact CG-CD1 3.86Å; K367-F378 HydrophobicContact CG-CE1 3.87Å; R376-F378 HydrophobicContact CB-CD2 4.38Å; R376-F378 HydrophobicContact CB-CE2 3.58Å; R376-F378 HydrophobicContact CB-CZ 3.83Å; R376-F378 VanDerWaalsContact O-CD2 3.3Å; R376-F378 WeakPolarHBondContact O-CD2 3.46Å; R376-F378 WeakPolarHBondContact O-CE2 3.29Å
379	Y	83	Confident	75.2	Confident	22 Å²	22	73.3 Å²	73.3	9%	0.086	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.6	168.1	-176.3	-97	0	0	0	109	K346 V349 D350 S366	K346-Y379 HydrophobicContact CB-CD2 3.98Å; K346-Y379 HydrophobicContact CB-CE2 4.1Å; K346-Y379 HydrophobicContact CB-CG 4.49Å; K346-Y379 HydrophobicContact CD-CD2 4.16Å; K346-Y379 HydrophobicContact CG-CD2 3.72Å; K346-Y379 HydrophobicContact CG-CE2 4.27Å; K346-Y379 HydrophobicContact CG-CG 4.28Å; V349-Y379 HydrophobicContact CB-CD1 4.23Å; V349-Y379 HydrophobicContact CG1-CD1 3.68Å; V349-Y379 HydrophobicContact CG1-CE1 4.24Å; D350-Y379 HydrophobicContact CB-CE1 3.98Å; D350-Y379 PolarHBondContact OD1-OH 2.91Å; S366-Y379 PolarHBondContact N-O 2.92Å; S366-Y379 PolarHBondContact O-N 3.45Å
380	T	84.4	Confident	76.5	Confident	62 Å²	62	74.7 Å²	74.7	38%	0.38	36%	0.361	S	S	.	.			trans	-118	120.6	179.9	-48.1	0	0	0	0	106.9
381	F	87.9	Confident	78.1	Confident	21 Å²	21	78.8 Å²	78.8	9%	0.092	37%	0.373	C	S	.	.			trans	-60.5	138.9	175.3	174.9	-108.4	0	0	0	110.1	C353 F354 A363 G383	C353-F381 HydrophobicContact CB-CB 3.9Å; C353-F381 HydrophobicContact CB-CD1 4.13Å; C353-F381 HydrophobicContact CB-CD2 3.56Å; C353-F381 HydrophobicContact CB-CE2 4.08Å; C353-F381 HydrophobicContact CB-CG 3.59Å; F354-F381 HydrophobicContact CB-CE2 4.03Å; F354-F381 HydrophobicContact CB-CZ 4.23Å; F354-F381 HydrophobicContact CD2-CE2 4.5Å; F354-F381 HydrophobicContact CD2-CZ 4.21Å; A363-F381 HydrophobicContact CB-CB 4.01Å; A363-F381 HydrophobicContact CB-CD1 4.09Å; A363-F381 HydrophobicContact CB-CG 4.47Å; F381-G383 VanDerWaalsContact CE1-O 3.29Å; F381-G383 WeakPolarHBondContact CE1-O 3.45Å
382	T	84.6	Confident	79.5	Confident	45 Å²	45	79.3 Å²	79.3	28%	0.276	37%	0.366	S	S	.	.			trans	-134.8	112.9	-179.4	59.4	0	0	0	0	110.7
383	G	86.6	Confident	80.8	Confident	30 Å²	30	72.9 Å²	72.9	31%	0.309	33%	0.332	S	S	.	.	S	Bend	trans	140.2	178	-176.6	0	0	0	0	0	110.5	D115 S360 F381	D115-G383 WeakPolarHBondContact OD1-CA 3.14Å; S360-G383 WeakPolarHBondContact CB-O 3.3Å; F381-G383 VanDerWaalsContact CE1-O 3.29Å; F381-G383 WeakPolarHBondContact CE1-O 3.45Å
384	R	90.4	Very high	81.9	Confident	50 Å²	50	68.5 Å²	68.5	19%	0.189	33%	0.325	C	S	.	.			trans	-82.1	148.3	167.3	-65	172.6	-73.2	176.1	5	109.4	I112 D115 F354 E388 L389	I112-R384 PolarHBondContact O-NH2 2.9Å; D115-R384 PolarHBondContact OD1-N 3.46Å; D115-R384 IonicContact OD1-NE 2.71Å; D115-R384 IonicContact OD2-CZ 3.88Å; D115-R384 IonicContact OD2-NE 3.14Å; D115-R384 PolarHBondContact OD2-NE 2.79Å; D115-R384 IonicContact OD2-NH2 2.99Å; D115-R384 PolarHBondContact OD2-NH2 3.19Å; F354-R384 WeakPolarHBondContact CD2-O 3.09Å; F354-R384 WeakPolarHBondContact CE2-O 3.27Å; R384-E388 HydrophobicContact CB-CB 4.38Å; R384-E388 HydrophobicContact CB-CG 4.11Å; R384-E388 HydrophobicContact CG-CG 4.21Å; R384-L389 HydrophobicContact CB-CD1 4.33Å; R384-L389 HydrophobicContact CB-CD2 3.92Å; R384-L389 HydrophobicContact CB-CG 3.79Å; R384-L389 VanDerWaalsContact CZ-CD2 3.45Å
385	C	92.9	Very high	82.7	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.323	C	S	.	.			trans	-81.2	165.8	171.2	67.4	0	0	0	0	111.5	F354 L357 R359 K387 E388 L389	F354-C385 WeakPolarHBondContact O-CB 3.48Å; L357-C385 HydrophobicContact CB-CB 4.39Å; L357-C385 PolarHBondContact O-SG 2.97Å; R359-C385 VanDerWaalsContact CA-SG 3.52Å; C385-K387 VanDerWaalsContact C-N 3.31Å; C385-K387 PolarHBondContact O-N 2.8Å; C385-E388 PolarHBondContact N-OE2 2.79Å; C385-E388 WeakPolarHBondContact O-CB 3.44Å; C385-E388 PolarHBondContact O-N 3Å; C385-E388 VanDerWaalsContact O-N 3.14Å; C385-E388 VanDerWaalsContact SG-CB 3.53Å; C385-L389 WeakPolarHBondContact O-CG 3.49Å; C385-L389 PolarHBondContact O-N 2.71Å
386	Q	92.1	Very high	83.1	Confident	21 Å²	21	57.4 Å²	57.4	10%	0.098	30%	0.296	C	S	.	.	H	α-helix	trans	-52.3	-47.2	-178.6	-169	-169.4	19.8	0	0	112.1	S158 E163 F354 E388 L389 M390	S158-Q386 PolarHBondContact OG-NE2 2.92Å; E163-Q386 VanDerWaalsContact CD-NE2 3.34Å; E163-Q386 PolarHBondContact OE1-NE2 3.3Å; E163-Q386 PolarHBondContact OE2-NE2 2.87Å; F354-Q386 HydrophobicContact CD1-CB 4.1Å; F354-Q386 HydrophobicContact CE1-CB 3.74Å; F354-Q386 HydrophobicContact CE1-CG 4.16Å; F354-Q386 HydrophobicContact CZ-CB 4.18Å; F354-Q386 WeakPolarHBondContact O-CB 3.37Å; F354-Q386 PolarHBondContact O-N 3.42Å; Q386-E388 PolarHBondContact O-N 3.16Å; Q386-L389 WeakPolarHBondContact O-CB 3.33Å; Q386-L389 PolarHBondContact O-N 2.79Å; Q386-M390 HydrophobicContact CG-SD 4.21Å; Q386-M390 VanDerWaalsContact O-CG 3.32Å; Q386-M390 WeakPolarHBondContact O-CG 3.13Å; Q386-M390 PolarHBondContact O-N 2.69Å
387	K	90.6	Very high	83.1	Confident	67 Å²	67	54.8 Å²	54.8	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-66.1	-36.2	-178.6	-66.5	168.5	-176.8	164.9	0	113.1	T356 N358 C385 Q391	T356-K387 PolarHBondContact O-NZ 3.37Å; N358-K387 VanDerWaalsContact OD1-CD 3.23Å; N358-K387 WeakPolarHBondContact OD1-CD 3.06Å; N358-K387 PolarHBondContact OD1-NZ 3.41Å; C385-K387 VanDerWaalsContact C-N 3.31Å; C385-K387 PolarHBondContact O-N 2.8Å; K387-Q391 WeakPolarHBondContact O-CB 3.22Å; K387-Q391 VanDerWaalsContact O-CG 3.22Å; K387-Q391 WeakPolarHBondContact O-CG 3.33Å; K387-Q391 PolarHBondContact O-N 2.62Å; K387-Q391 PolarHBondContact O-NE2 2.9Å
388	E	90.1	Very high	82.6	Confident	48 Å²	48	55.7 Å²	55.7	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-69.5	-34.9	174.9	-177.2	179.4	177.4	0	0	111.4	S360 R384 C385 Q386 L392	S360-E388 WeakPolarHBondContact CB-OE2 3.12Å; S360-E388 PolarHBondContact N-OE2 3.45Å; S360-E388 PolarHBondContact OG-OE1 3.28Å; S360-E388 PolarHBondContact OG-OE2 2.97Å; R384-E388 HydrophobicContact CB-CB 4.38Å; R384-E388 HydrophobicContact CB-CG 4.11Å; R384-E388 HydrophobicContact CG-CG 4.21Å; C385-E388 PolarHBondContact N-OE2 2.79Å; C385-E388 WeakPolarHBondContact O-CB 3.44Å; C385-E388 PolarHBondContact O-N 3Å; C385-E388 VanDerWaalsContact O-N 3.14Å; C385-E388 VanDerWaalsContact SG-CB 3.53Å; Q386-E388 PolarHBondContact O-N 3.16Å; E388-L392 WeakPolarHBondContact O-CB 3.27Å; E388-L392 PolarHBondContact O-N 3.42Å; E388-L392 VanDerWaalsContact O-N 3.1Å
389	L	89.3	Confident	81.2	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-69	-44.9	172.5	-69.1	159.5	0	0	0	111.9	D115 Y116 F354 R384 C385 Q386 Q391 L392 N393	D115-L389 HydrophobicContact CB-CD1 3.77Å; D115-L389 HydrophobicContact CB-CD2 4.13Å; Y116-L389 HydrophobicContact CD2-CD1 4.02Å; Y116-L389 HydrophobicContact CE2-CB 4.33Å; Y116-L389 HydrophobicContact CE2-CD1 3.67Å; Y116-L389 HydrophobicContact CE2-CG 4.5Å; F354-L389 HydrophobicContact CE2-CD1 3.56Å; F354-L389 HydrophobicContact CZ-CD1 3.75Å; R384-L389 HydrophobicContact CB-CD1 4.33Å; R384-L389 HydrophobicContact CB-CD2 3.92Å; R384-L389 HydrophobicContact CB-CG 3.79Å; R384-L389 VanDerWaalsContact CZ-CD2 3.45Å; C385-L389 WeakPolarHBondContact O-CG 3.49Å; C385-L389 PolarHBondContact O-N 2.71Å; Q386-L389 WeakPolarHBondContact O-CB 3.33Å; Q386-L389 PolarHBondContact O-N 2.79Å; L389-Q391 VanDerWaalsContact C-N 3.34Å; L389-Q391 PolarHBondContact O-N 2.8Å; L389-L392 PolarHBondContact O-N 2.82Å; L389-N393 WeakPolarHBondContact O-CB 3.46Å; L389-N393 PolarHBondContact O-N 3.19Å
390	M	87.6	Confident	79.4	Confident	93 Å²	93	61 Å²	61	46%	0.458	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-41.1	176.1	-67.8	173.9	86.1	0	0	111.6	E163 Q386 N393 S394	E163-M390 HydrophobicContact CG-CE 4.42Å; Q386-M390 HydrophobicContact CG-SD 4.21Å; Q386-M390 VanDerWaalsContact O-CG 3.32Å; Q386-M390 WeakPolarHBondContact O-CG 3.13Å; Q386-M390 PolarHBondContact O-N 2.69Å; M390-N393 PolarHBondContact O-N 2.73Å; M390-S394 WeakPolarHBondContact O-CB 3.41Å; M390-S394 PolarHBondContact O-N 2.91Å
391	Q	87.2	Confident	77.6	Confident	112 Å²	112	63.9 Å²	63.9	52%	0.523	37%	0.365	S	S	.	.	H	α-helix	trans	-59.2	-48.8	173.2	-75.8	163.1	40.6	0	0	111.4	K387 L389 S394 S395	K387-Q391 WeakPolarHBondContact O-CB 3.22Å; K387-Q391 VanDerWaalsContact O-CG 3.22Å; K387-Q391 WeakPolarHBondContact O-CG 3.33Å; K387-Q391 PolarHBondContact O-N 2.62Å; K387-Q391 PolarHBondContact O-NE2 2.9Å; L389-Q391 VanDerWaalsContact C-N 3.34Å; L389-Q391 PolarHBondContact O-N 2.8Å; Q391-S394 PolarHBondContact O-N 2.77Å; Q391-S394 VanDerWaalsContact O-N 3.13Å; Q391-S394 PolarHBondContact O-OG 3.15Å; Q391-S395 PolarHBondContact O-N 2.81Å; Q391-S395 PolarHBondContact O-OG 3.06Å
392	L	84.7	Confident	75.2	Confident	56 Å²	56	67.4 Å²	67.4	29%	0.293	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-40.6	177.1	-176.5	132.4	0	0	0	112.8	I112 E388 L389 S394 S395 M396	I112-L392 HydrophobicContact CG2-CD2 3.7Å; E388-L392 WeakPolarHBondContact O-CB 3.27Å; E388-L392 PolarHBondContact O-N 3.42Å; E388-L392 VanDerWaalsContact O-N 3.1Å; L389-L392 PolarHBondContact O-N 2.82Å; L392-S394 PolarHBondContact O-N 2.86Å; L392-S395 PolarHBondContact O-N 2.86Å; L392-S395 PolarHBondContact O-OG 2.88Å; L392-M396 HydrophobicContact CD2-SD 3.98Å; L392-M396 WeakPolarHBondContact O-CG 3.34Å; L392-M396 PolarHBondContact O-N 3.45Å; L392-M396 VanDerWaalsContact O-N 3.17Å
393	N	82.9	Confident	73	Confident	16 Å²	16	74.8 Å²	74.8	9%	0.086	42%	0.418	C	S	.	.	H	α-helix	trans	-61.7	-31.2	173.2	-88.7	8.7	0	0	0	112	E113 E163 R165 L389 M390	E113-N393 WeakPolarHBondContact CG-ND2 3.15Å; E113-N393 PolarHBondContact OE1-ND2 3.29Å; E163-N393 PolarHBondContact O-ND2 3Å; E163-N393 VanDerWaalsContact O-ND2 3.11Å; R165-N393 WeakPolarHBondContact CD-O 3.32Å; R165-N393 PolarHBondContact NH1-O 2.9Å; L389-N393 WeakPolarHBondContact O-CB 3.46Å; L389-N393 PolarHBondContact O-N 3.19Å; M390-N393 PolarHBondContact O-N 2.73Å
394	S	80.9	Confident	70.5	Confident	94 Å²	94	82.1 Å²	82.1	66%	0.657	44%	0.442	S	S	*	.	H	α-helix	trans	-78.4	-35.9	174.5	77	0	0	0	0	113.4	M390 Q391 L392	M390-S394 WeakPolarHBondContact O-CB 3.41Å; M390-S394 PolarHBondContact O-N 2.91Å; Q391-S394 PolarHBondContact O-N 2.77Å; Q391-S394 VanDerWaalsContact O-N 3.13Å; Q391-S394 PolarHBondContact O-OG 3.15Å; L392-S394 PolarHBondContact O-N 2.86Å
395	S	76	Confident	67.7	Low	90 Å²	90	86.2 Å²	86.2	63%	0.629	47%	0.466	S	S	*	.	H	α-helix	trans	-82.4	-18.1	-174.1	68.7	0	0	0	0	114.4	Q391 L392	Q391-S395 PolarHBondContact O-N 2.81Å; Q391-S395 PolarHBondContact O-OG 3.06Å; L392-S395 PolarHBondContact O-N 2.86Å; L392-S395 PolarHBondContact O-OG 2.88Å
396	M	69.9	Low	64.9	Low	69 Å²	69	89.1 Å²	89.1	34%	0.34	49%	0.486	S	S	.	.	S	Bend	trans	-71.1	136	173.6	-71.3	-175.9	73.3	0	0	110.6	I112 R165 L392	I112-M396 HydrophobicContact CD1-CE 3.86Å; I112-M396 HydrophobicContact CD1-SD 4.04Å; I112-M396 HydrophobicContact CG2-SD 4.06Å; R165-M396 PolarHBondContact NH1-O 2.94Å; R165-M396 PolarHBondContact NH2-O 3.36Å; R165-M396 VanDerWaalsContact NH2-O 3.15Å; L392-M396 HydrophobicContact CD2-SD 3.98Å; L392-M396 WeakPolarHBondContact O-CG 3.34Å; L392-M396 PolarHBondContact O-N 3.45Å; L392-M396 VanDerWaalsContact O-N 3.17Å
397	P	59.1	Low	62.4	Low	95 Å²	95	95.7 Å²	95.7	62%	0.617	52%	0.515	S	S	*	.			trans	-59.9	153	172.9	23.2	-31.2	0	0	0	110.8	I399	P397-I399 HydrophobicContact CB-CG1 4.43Å; P397-I399 HydrophobicContact CG-CD1 4.27Å; P397-I399 HydrophobicContact CG-CG1 4.01Å; P397-I399 PolarHBondContact O-N 2.78Å
398	A	56.6	Low	60.3	Low	83 Å²	83	93.2 Å²	93.2	69%	0.686	51%	0.506	S	S	*	.			trans	-74.6	61.7	175.8	0	0	0	0	0	111.2	R165 P400	R165-A398 VanDerWaalsContact NH2-CA 3.3Å; A398-P400 VanDerWaalsContact O-CD 3.26Å; A398-P400 WeakPolarHBondContact O-CD 3.41Å
399	I	49.1	Very low	58	Low	118 Å²	118	96.6 Å²	96.6	61%	0.605	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-58.2	118.6	172	-56.1	175.4	0	0	0	106.7	P397 Q401	P397-I399 HydrophobicContact CB-CG1 4.43Å; P397-I399 HydrophobicContact CG-CD1 4.27Å; P397-I399 HydrophobicContact CG-CG1 4.01Å; P397-I399 PolarHBondContact O-N 2.78Å; I399-Q401 PolarHBondContact O-N 3.47Å; I399-Q401 VanDerWaalsContact O-N 3.17Å
400	P	43.7	Very low	56.1	Low	111 Å²	111	99.6 Å²	99.6	72%	0.721	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-58.2	124.8	174.2	-22.6	34.1	0	0	0	108.5	A398 P402	A398-P400 VanDerWaalsContact O-CD 3.26Å; A398-P400 WeakPolarHBondContact O-CD 3.41Å; P400-P402 VanDerWaalsContact O-N 3.13Å
401	Q	48.3	Very low	54.3	Low	122 Å²	122	98.8 Å²	98.8	57%	0.57	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-53.4	124.3	167.6	-66.7	-62.8	-35.1	0	0	106.6	I399 K403	I399-Q401 PolarHBondContact O-N 3.47Å; I399-Q401 VanDerWaalsContact O-N 3.17Å; Q401-K403 PolarHBondContact O-N 2.77Å; Q401-K403 VanDerWaalsContact O-N 3.1Å
402	P	37.4	Very low	52.5	Low	94 Å²	94	94.6 Å²	94.6	61%	0.61	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-62.2	121.6	-170.1	22.7	-32.6	0	0	0	109.2	P400 K404	P400-P402 VanDerWaalsContact O-N 3.13Å; P402-K404 HydrophobicContact CB-CG 4.32Å; P402-K404 PolarHBondContact O-N 3.39Å
403	K	36.9	Very low	50.9	Low	201 Å²	201	96.8 Å²	96.8	87%	0.874	53%	0.528	S	S	*	.			trans	-69.6	44.4	175	-64.5	-172.3	175.7	-173.8	0	112.3	Q401 L405	Q401-K403 PolarHBondContact O-N 2.77Å; Q401-K403 VanDerWaalsContact O-N 3.1Å; K403-L405 PolarHBondContact O-N 2.81Å
404	K	34.4	Very low	49.6	Very low	184 Å²	184	100.3 Å²	100.3	80%	0.8	55%	0.547	S	S	*	.	S	Bend	trans	-90.4	82.9	177.5	-76.3	-170.6	172	-172.2	0	108.9	P402	P402-K404 HydrophobicContact CB-CG 4.32Å; P402-K404 PolarHBondContact O-N 3.39Å
405	L	32.7	Very low	48.1	Very low	135 Å²	135	97.8 Å²	97.8	71%	0.707	52%	0.524	S	S	*	.	S	Bend	trans	57.5	95.9	-175.6	-116.8	66.3	0	0	0	111.1	K403 F407 V410	K403-L405 PolarHBondContact O-N 2.81Å; L405-F407 PolarHBondContact O-N 3.38Å; L405-F407 VanDerWaalsContact O-N 3.13Å; L405-V410 HydrophobicContact CB-CG2 3.72Å; L405-V410 HydrophobicContact CD2-CG2 3.8Å; L405-V410 HydrophobicContact CG-CG2 3.81Å
406	C	33.4	Very low	47.1	Very low	61 Å²	61	96 Å²	96	41%	0.412	51%	0.507	S	S	.	.			trans	-46.1	122.5	-172.4	-51.9	0	0	0	0	110.5	S408 H409 V410	C406-S408 PolarHBondContact O-N 3.46Å; C406-H409 HydrophobicContact CB-CB 3.97Å; C406-H409 CarbonylContact O-C 3.42Å; C406-H409 WeakPolarHBondContact O-CA 3.39Å; C406-H409 PolarHBondContact O-N 3.14Å; C406-V410 PolarHBondContact O-N 3Å
407	F	40.2	Very low	46.3	Very low	160 Å²	160	97.2 Å²	97.2	70%	0.702	51%	0.514	S	S	*	.	H	α-helix	trans	-58.5	-35.9	-175.8	-125.4	-96.8	0	0	0	110.5	L405 V410 F411	L405-F407 PolarHBondContact O-N 3.38Å; L405-F407 VanDerWaalsContact O-N 3.13Å; F407-V410 PolarHBondContact O-N 3.24Å; F407-F411 HydrophobicContact CD1-CD2 4.01Å; F407-F411 HydrophobicContact CD1-CE2 4.17Å; F407-F411 HydrophobicContact CE1-CD2 4.15Å; F407-F411 AromaticContact CE1-CE2 3.86Å; F407-F411 HydrophobicContact CE1-CE2 3.86Å; F407-F411 WeakPolarHBondContact O-CB 3.42Å; F407-F411 PolarHBondContact O-N 2.89Å
408	S	45.1	Very low	46.2	Very low	15 Å²	15	97.6 Å²	97.6	11%	0.105	51%	0.51	C	S	.	.	H	α-helix	trans	-62	-39.2	169.7	58.6	0	0	0	0	114	N251 C406 S412	N251-S408 WeakPolarHBondContact OD1-CB 3.4Å; N251-S408 PolarHBondContact OD1-OG 3.44Å; C406-S408 PolarHBondContact O-N 3.46Å; S408-S412 WeakPolarHBondContact O-CA 3.36Å; S408-S412 WeakPolarHBondContact O-CB 3.26Å; S408-S412 PolarHBondContact O-N 2.85Å
409	H	41.9	Very low	46.1	Very low	119 Å²	119	96 Å²	96	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-76.2	-34.3	175.7	-74.4	50	0	0	0	113.2	C406 L413	C406-H409 HydrophobicContact CB-CB 3.97Å; C406-H409 CarbonylContact O-C 3.42Å; C406-H409 WeakPolarHBondContact O-CA 3.39Å; C406-H409 PolarHBondContact O-N 3.14Å; H409-L413 WeakPolarHBondContact O-CB 3.3Å; H409-L413 VanDerWaalsContact O-CD1 3.29Å; H409-L413 WeakPolarHBondContact O-CD1 3.23Å; H409-L413 PolarHBondContact O-N 3.35Å
410	V	50.5	Low	46.6	Very low	63 Å²	63	91.9 Å²	91.9	38%	0.382	47%	0.468	S	S	.	.	H	α-helix	trans	-72.9	-42.4	177.3	-178.2	0	0	0	0	110.4	L405 C406 F407 L414	L405-V410 HydrophobicContact CB-CG2 3.72Å; L405-V410 HydrophobicContact CD2-CG2 3.8Å; L405-V410 HydrophobicContact CG-CG2 3.81Å; C406-V410 PolarHBondContact O-N 3Å; F407-V410 PolarHBondContact O-N 3.24Å; V410-L414 WeakPolarHBondContact O-CB 3.43Å; V410-L414 PolarHBondContact O-N 2.86Å
411	F	48.7	Very low	47.2	Very low	77 Å²	77	93.1 Å²	93.1	34%	0.338	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-46.3	168.6	-98.3	-111.2	0	0	0	110.9	F407 L413 L414 F415	F407-F411 HydrophobicContact CD1-CD2 4.01Å; F407-F411 HydrophobicContact CD1-CE2 4.17Å; F407-F411 HydrophobicContact CE1-CD2 4.15Å; F407-F411 AromaticContact CE1-CE2 3.86Å; F407-F411 HydrophobicContact CE1-CE2 3.86Å; F407-F411 WeakPolarHBondContact O-CB 3.42Å; F407-F411 PolarHBondContact O-N 2.89Å; F411-L413 PolarHBondContact O-N 3.38Å; F411-L414 CarbonylContact O-C 3.55Å; F411-L414 PolarHBondContact O-N 3.07Å; F411-F415 WeakPolarHBondContact O-CA 3.17Å; F411-F415 WeakPolarHBondContact O-CB 3.39Å; F411-F415 PolarHBondContact O-N 3.46Å
412	S	49.7	Very low	47.8	Very low	23 Å²	23	91.3 Å²	91.3	16%	0.161	46%	0.458	C	S	.	.	H	α-helix	trans	-57.4	-51.8	178.6	177.8	0	0	0	0	112.5	M250 S408 L414 F415 L416	M250-S412 WeakPolarHBondContact CE-OG 3.41Å; S408-S412 WeakPolarHBondContact O-CA 3.36Å; S408-S412 WeakPolarHBondContact O-CB 3.26Å; S408-S412 PolarHBondContact O-N 2.85Å; S412-L414 PolarHBondContact O-N 3.3Å; S412-F415 PolarHBondContact O-N 2.85Å; S412-L416 VanDerWaalsContact O-CB 3.29Å; S412-L416 WeakPolarHBondContact O-CB 3.29Å; S412-L416 VanDerWaalsContact O-CG 3.23Å; S412-L416 WeakPolarHBondContact O-CG 3.49Å; S412-L416 PolarHBondContact O-N 2.87Å
413	L	52	Low	48.8	Very low	103 Å²	103	90.2 Å²	90.2	54%	0.539	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-45.9	175.3	-92.6	78.7	0	0	0	110.6	H409 F411 F415 L416 L417	H409-L413 WeakPolarHBondContact O-CB 3.3Å; H409-L413 VanDerWaalsContact O-CD1 3.29Å; H409-L413 WeakPolarHBondContact O-CD1 3.23Å; H409-L413 PolarHBondContact O-N 3.35Å; F411-L413 PolarHBondContact O-N 3.38Å; L413-F415 VanDerWaalsContact C-N 3.28Å; L413-F415 PolarHBondContact O-N 3.03Å; L413-L416 PolarHBondContact O-N 2.91Å; L413-L417 WeakPolarHBondContact O-CB 3.36Å; L413-L417 WeakPolarHBondContact O-CD1 3.34Å; L413-L417 WeakPolarHBondContact O-CG 3.48Å; L413-L417 PolarHBondContact O-N 2.83Å
414	L	54.3	Low	50	Low	90 Å²	90	84.5 Å²	84.5	47%	0.471	43%	0.426	S	S	.	.	H	α-helix	trans	-64.2	-34.2	179.7	-169.1	65.3	0	0	0	112.3	V410 F411 S412 I418	V410-L414 WeakPolarHBondContact O-CB 3.43Å; V410-L414 PolarHBondContact O-N 2.86Å; F411-L414 CarbonylContact O-C 3.55Å; F411-L414 PolarHBondContact O-N 3.07Å; S412-L414 PolarHBondContact O-N 3.3Å; L414-I418 HydrophobicContact CD1-CD1 4.28Å; L414-I418 HydrophobicContact CG-CD1 3.89Å; L414-I418 VanDerWaalsContact O-CB 3.23Å; L414-I418 WeakPolarHBondContact O-CB 3.46Å; L414-I418 WeakPolarHBondContact O-CD1 3.27Å; L414-I418 WeakPolarHBondContact O-CG1 3.24Å; L414-I418 PolarHBondContact O-N 3.03Å
415	F	49.7	Very low	51.4	Low	40 Å²	40	80.7 Å²	80.7	18%	0.175	41%	0.414	C	S	.	.	H	α-helix	trans	-76.1	-39.5	-179.7	-168	-107.1	0	0	0	111.2	E83 E204 F411 S412 L413 I418 R419	E83-F415 WeakPolarHBondContact OE2-CE2 3.34Å; E204-F415 HydrophobicContact CB-CE1 4.03Å; E204-F415 HydrophobicContact CG-CE1 3.82Å; E204-F415 HydrophobicContact CG-CZ 4.4Å; F411-F415 WeakPolarHBondContact O-CA 3.17Å; F411-F415 WeakPolarHBondContact O-CB 3.39Å; F411-F415 PolarHBondContact O-N 3.46Å; S412-F415 PolarHBondContact O-N 2.85Å; L413-F415 VanDerWaalsContact C-N 3.28Å; L413-F415 PolarHBondContact O-N 3.03Å; F415-I418 PolarHBondContact O-N 3.11Å; F415-R419 VanDerWaalsContact CE1-CD 3.47Å; F415-R419 VanDerWaalsContact CZ-CZ 3.41Å; F415-R419 WeakPolarHBondContact O-CB 3.32Å; F415-R419 WeakPolarHBondContact O-CG 3.43Å; F415-R419 PolarHBondContact O-N 2.85Å
416	L	54.5	Low	53.1	Low	53 Å²	53	79.1 Å²	79.1	28%	0.277	41%	0.406	S	S	.	.	H	α-helix	trans	-67.3	-41.2	169.6	-70.6	166.9	0	0	0	111.5	S412 L413 I418 R419 S420	S412-L416 VanDerWaalsContact O-CB 3.29Å; S412-L416 WeakPolarHBondContact O-CB 3.29Å; S412-L416 VanDerWaalsContact O-CG 3.23Å; S412-L416 WeakPolarHBondContact O-CG 3.49Å; S412-L416 PolarHBondContact O-N 2.87Å; L413-L416 PolarHBondContact O-N 2.91Å; L416-I418 VanDerWaalsContact C-N 3.33Å; L416-I418 PolarHBondContact O-N 2.89Å; L416-R419 PolarHBondContact O-N 3.09Å; L416-S420 WeakPolarHBondContact O-CB 3.45Å; L416-S420 PolarHBondContact O-N 2.81Å; L416-S420 PolarHBondContact O-OG 2.86Å
417	L	53.8	Low	54.6	Low	94 Å²	94	79 Å²	79	49%	0.492	41%	0.409	S	S	.	.	H	α-helix	trans	-64.2	-35.7	174	-71.7	168.3	0	0	0	111.9	L413 L423	L413-L417 WeakPolarHBondContact O-CB 3.36Å; L413-L417 WeakPolarHBondContact O-CD1 3.34Å; L413-L417 WeakPolarHBondContact O-CG 3.48Å; L413-L417 PolarHBondContact O-N 2.83Å; L417-L423 HydrophobicContact CD2-CD1 3.43Å; L417-L423 VanDerWaalsContact CD2-CD1 3.43Å
418	I	57.2	Low	55.8	Low	103 Å²	103	75.4 Å²	75.4	53%	0.528	39%	0.393	S	S	.	.	H	α-helix	trans	-80.1	-36	176.7	-73.6	168.1	0	0	0	112.4	L414 F415 L416 L424	L414-I418 HydrophobicContact CD1-CD1 4.28Å; L414-I418 HydrophobicContact CG-CD1 3.89Å; L414-I418 VanDerWaalsContact O-CB 3.23Å; L414-I418 WeakPolarHBondContact O-CB 3.46Å; L414-I418 WeakPolarHBondContact O-CD1 3.27Å; L414-I418 WeakPolarHBondContact O-CG1 3.24Å; L414-I418 PolarHBondContact O-N 3.03Å; F415-I418 PolarHBondContact O-N 3.11Å; L416-I418 VanDerWaalsContact C-N 3.33Å; L416-I418 PolarHBondContact O-N 2.89Å; I418-L424 VanDerWaalsContact O-CD1 3.28Å; I418-L424 WeakPolarHBondContact O-CD1 3.45Å
419	R	54.8	Low	57	Low	51 Å²	51	78 Å²	78	19%	0.192	41%	0.411	C	S	.	.	H	α-helix	trans	-85.2	-29.9	-177.2	-81	178.2	137.5	60.4	6.6	114.8	E83 Y214 F415 L416 R421	E83-R419 IonicContact OE1-CZ 2.63Å; E83-R419 VanDerWaalsContact OE1-CZ 3.32Å; E83-R419 IonicContact OE1-NH1 3.97Å; E83-R419 PolarHBondContact OE1-NH1 2.85Å; E83-R419 IonicContact OE1-NH2 2.92Å; E83-R419 PolarHBondContact OE1-NH2 3.39Å; E83-R419 IonicContact OE2-CZ 2.88Å; E83-R419 IonicContact OE2-NH1 3.3Å; E83-R419 PolarHBondContact OE2-NH1 3.16Å; E83-R419 IonicContact OE2-NH2 3.98Å; Y214-R419 HydrophobicContact CE2-CB 3.91Å; Y214-R419 WeakPolarHBondContact OH-CD 3.45Å; Y214-R419 PolarHBondContact OH-NE 3.3Å; F415-R419 VanDerWaalsContact CE1-CD 3.47Å; F415-R419 VanDerWaalsContact CZ-CZ 3.41Å; F415-R419 WeakPolarHBondContact O-CB 3.32Å; F415-R419 WeakPolarHBondContact O-CG 3.43Å; F415-R419 PolarHBondContact O-N 2.85Å; L416-R419 PolarHBondContact O-N 3.09Å; R419-R421 PolarHBondContact O-N 3.23Å
420	S	60.5	Low	58.5	Low	30 Å²	30	75.2 Å²	75.2	21%	0.21	40%	0.403	C	S	.	.			trans	-62.4	108.2	-174.7	51.1	0	0	0	0	110.6	L416 S422 L423 L424	L416-S420 WeakPolarHBondContact O-CB 3.45Å; L416-S420 PolarHBondContact O-N 2.81Å; L416-S420 PolarHBondContact O-OG 2.86Å; S420-S422 PolarHBondContact O-N 3.34Å; S420-S422 VanDerWaalsContact O-N 3.08Å; S420-L423 PolarHBondContact O-N 2.94Å; S420-L423 WeakPolarHBondContact OG-CB 3.45Å; S420-L423 WeakPolarHBondContact OG-CD1 3.35Å; S420-L423 WeakPolarHBondContact OG-CG 3.45Å; S420-L424 PolarHBondContact O-N 3.03Å
421	R	56.4	Low	59.5	Low	138 Å²	138	77.1 Å²	77.1	52%	0.521	41%	0.407	S	S	.	.	H	α-helix	trans	-47.8	-38.3	174.7	-83.7	172.8	155.1	168.3	-7.2	111	L215 R419 L424 N425	L215-R421 PolarHBondContact O-NH1 3.31Å; R419-R421 PolarHBondContact O-N 3.23Å; R421-L424 PolarHBondContact O-N 3.38Å; R421-N425 VanDerWaalsContact O-CB 3.24Å; R421-N425 WeakPolarHBondContact O-CB 3.44Å; R421-N425 PolarHBondContact O-N 3.1Å; R421-N425 PolarHBondContact O-ND2 2.74Å; R421-N425 PolarHBondContact O-OD1 2.85Å
422	S	59.1	Low	60.4	Low	83 Å²	83	78.1 Å²	78.1	58%	0.58	42%	0.416	S	S	*	.	H	α-helix	trans	-59	-43.9	176.6	-49.4	0	0	0	0	113.9	S420 L426	S420-S422 PolarHBondContact O-N 3.34Å; S420-S422 VanDerWaalsContact O-N 3.08Å; S422-L426 VanDerWaalsContact O-CB 3.29Å; S422-L426 WeakPolarHBondContact O-CB 3.37Å; S422-L426 PolarHBondContact O-N 2.86Å
423	L	60	Low	61.5	Low	71 Å²	71	82.2 Å²	82.2	37%	0.372	43%	0.431	S	S	.	.	H	α-helix	trans	-79.7	-32.1	177.7	-67.3	-179	0	0	0	112.7	L417 S420 L426 A427	L417-L423 HydrophobicContact CD2-CD1 3.43Å; L417-L423 VanDerWaalsContact CD2-CD1 3.43Å; S420-L423 PolarHBondContact O-N 2.94Å; S420-L423 WeakPolarHBondContact OG-CB 3.45Å; S420-L423 WeakPolarHBondContact OG-CD1 3.35Å; S420-L423 WeakPolarHBondContact OG-CG 3.45Å; L423-L426 HydrophobicContact CD2-CD2 4.15Å; L423-L426 PolarHBondContact O-N 2.78Å; L423-A427 WeakPolarHBondContact O-CB 3.25Å; L423-A427 PolarHBondContact O-N 2.92Å
424	L	60.9	Low	62	Low	82 Å²	82	84 Å²	84	43%	0.429	43%	0.431	S	S	.	.	H	α-helix	trans	-61.1	-45.1	169.3	-93.6	161.5	0	0	0	111.7	I418 S420 R421 A427 K428	I418-L424 VanDerWaalsContact O-CD1 3.28Å; I418-L424 WeakPolarHBondContact O-CD1 3.45Å; S420-L424 PolarHBondContact O-N 3.03Å; R421-L424 PolarHBondContact O-N 3.38Å; L424-A427 PolarHBondContact O-N 3.3Å; L424-K428 WeakPolarHBondContact O-CB 3.49Å; L424-K428 WeakPolarHBondContact O-CG 3.43Å; L424-K428 PolarHBondContact O-N 3.44Å
425	N	64.6	Low	62.4	Low	104 Å²	104	84.9 Å²	84.9	56%	0.556	43%	0.432	S	S	*	.	H	α-helix	trans	-68.7	-38.6	177.4	-69.7	-10.4	0	0	0	111.7	R421 S429	R421-N425 VanDerWaalsContact O-CB 3.24Å; R421-N425 WeakPolarHBondContact O-CB 3.44Å; R421-N425 PolarHBondContact O-N 3.1Å; R421-N425 PolarHBondContact O-ND2 2.74Å; R421-N425 PolarHBondContact O-OD1 2.85Å; N425-S429 VanDerWaalsContact O-CB 3.3Å; N425-S429 WeakPolarHBondContact O-CB 3.21Å; N425-S429 PolarHBondContact O-N 2.92Å
426	L	67.5	Low	63.1	Low	101 Å²	101	85.8 Å²	85.8	53%	0.529	44%	0.444	S	S	.	.	H	α-helix	trans	-65.1	-42.2	172.8	-177.7	62.3	0	0	0	111.8	S422 L423 S429 V430	S422-L426 VanDerWaalsContact O-CB 3.29Å; S422-L426 WeakPolarHBondContact O-CB 3.37Å; S422-L426 PolarHBondContact O-N 2.86Å; L423-L426 HydrophobicContact CD2-CD2 4.15Å; L423-L426 PolarHBondContact O-N 2.78Å; L426-S429 PolarHBondContact O-N 2.9Å; L426-V430 HydrophobicContact CD1-CG2 4.34Å; L426-V430 WeakPolarHBondContact O-CB 3.44Å; L426-V430 VanDerWaalsContact O-CG2 3.29Å; L426-V430 WeakPolarHBondContact O-CG2 3.31Å; L426-V430 PolarHBondContact O-N 2.91Å
427	A	65	Low	63.5	Low	59 Å²	59	89 Å²	89	49%	0.488	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-42.2	177.5	0	0	0	0	0	111.7	L423 L424 V430 H431	L423-A427 WeakPolarHBondContact O-CB 3.25Å; L423-A427 PolarHBondContact O-N 2.92Å; L424-A427 PolarHBondContact O-N 3.3Å; A427-V430 PolarHBondContact O-N 3.48Å; A427-H431 VanDerWaalsContact O-CB 3.32Å; A427-H431 WeakPolarHBondContact O-CB 3.49Å; A427-H431 PolarHBondContact O-N 3.19Å
428	K	64.7	Low	63.7	Low	84 Å²	84	87.1 Å²	87.1	37%	0.365	45%	0.452	S	S	.	.	H	α-helix	trans	-60	-53.8	170.8	-76	178.5	172.7	-176.5	0	111.1	L424 V430 H431 D432 D1283	L424-K428 WeakPolarHBondContact O-CB 3.49Å; L424-K428 WeakPolarHBondContact O-CG 3.43Å; L424-K428 PolarHBondContact O-N 3.44Å; K428-V430 VanDerWaalsContact C-N 3.28Å; K428-V430 PolarHBondContact O-N 2.66Å; K428-H431 CarbonylContact O-C 3.6Å; K428-H431 WeakPolarHBondContact O-CA 3.38Å; K428-H431 WeakPolarHBondContact O-CB 3.31Å; K428-H431 PolarHBondContact O-N 3.04Å; K428-D432 VanDerWaalsContact O-CG 3.23Å; K428-D432 PolarHBondContact O-N 3.4Å; K428-D432 VanDerWaalsContact O-OD2 3.12Å; K428-D1283 IonicContact NZ-OD1 3.21Å; K428-D1283 PolarHBondContact NZ-OD1 3.04Å; K428-D1283 IonicContact NZ-OD2 2.62Å
429	S	70.3	Confident	63.6	Low	69 Å²	69	86.9 Å²	86.9	48%	0.483	45%	0.449	S	S	.	.	H	α-helix	trans	-54	-41	177.1	-175.4	0	0	0	0	113.2	N425 L426 K433	N425-S429 VanDerWaalsContact O-CB 3.3Å; N425-S429 WeakPolarHBondContact O-CB 3.21Å; N425-S429 PolarHBondContact O-N 2.92Å; L426-S429 PolarHBondContact O-N 2.9Å; S429-K433 WeakPolarHBondContact O-CB 3.24Å; S429-K433 PolarHBondContact O-N 3.16Å
430	V	73.9	Confident	63.9	Low	61 Å²	61	89 Å²	89	37%	0.37	46%	0.464	S	S	.	.	H	α-helix	trans	-70.1	-35	175.1	169.3	0	0	0	0	112.2	L426 A427 K428 R434	L426-V430 HydrophobicContact CD1-CG2 4.34Å; L426-V430 WeakPolarHBondContact O-CB 3.44Å; L426-V430 VanDerWaalsContact O-CG2 3.29Å; L426-V430 WeakPolarHBondContact O-CG2 3.31Å; L426-V430 PolarHBondContact O-N 2.91Å; A427-V430 PolarHBondContact O-N 3.48Å; K428-V430 VanDerWaalsContact C-N 3.28Å; K428-V430 PolarHBondContact O-N 2.66Å; V430-R434 WeakPolarHBondContact O-CG 3.31Å; V430-R434 PolarHBondContact O-N 3.14Å; V430-R434 VanDerWaalsContact O-N 3.07Å
431	H	71.7	Confident	64	Low	103 Å²	103	91.6 Å²	91.6	48%	0.477	48%	0.475	S	S	.	.	H	α-helix	trans	-70.8	-47.3	176.5	-172.8	53.5	0	0	0	111.7	A427 K428 K433 R434 H435	A427-H431 VanDerWaalsContact O-CB 3.32Å; A427-H431 WeakPolarHBondContact O-CB 3.49Å; A427-H431 PolarHBondContact O-N 3.19Å; K428-H431 CarbonylContact O-C 3.6Å; K428-H431 WeakPolarHBondContact O-CA 3.38Å; K428-H431 WeakPolarHBondContact O-CB 3.31Å; K428-H431 PolarHBondContact O-N 3.04Å; H431-K433 VanDerWaalsContact C-N 3.3Å; H431-K433 PolarHBondContact O-N 3.36Å; H431-R434 PolarHBondContact O-N 3.18Å; H431-R434 VanDerWaalsContact O-N 3.16Å; H431-H435 AromaticContact CE1-CD2 3.3Å; H431-H435 PolarHBondContact CE1-CD2 3.4Å; H431-H435 AromaticContact CE1-NE2 3.23Å; H431-H435 PolarHBondContact CE1-NE2 3.12Å; H431-H435 AromaticContact ND1-CD2 3.66Å; H431-H435 AromaticContact ND1-NE2 3.98Å; H431-H435 AromaticContact NE2-CD2 3.59Å; H431-H435 AromaticContact NE2-NE2 3.64Å; H431-H435 PolarHBondContact O-N 3.37Å
432	D	68.7	Low	64.1	Low	99 Å²	99	90 Å²	90	53%	0.529	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-41.2	175.4	-60.2	-34.1	0	0	0	110.8	K428 H435 S436	K428-D432 VanDerWaalsContact O-CG 3.23Å; K428-D432 PolarHBondContact O-N 3.4Å; K428-D432 VanDerWaalsContact O-OD2 3.12Å; D432-H435 PolarHBondContact O-N 3.43Å; D432-S436 WeakPolarHBondContact O-CB 3.27Å; D432-S436 PolarHBondContact O-N 3.26Å; D432-S436 PolarHBondContact O-OG 2.95Å
433	K	71.9	Confident	64	Low	108 Å²	108	89.5 Å²	89.5	47%	0.47	47%	0.468	S	S	.	.	H	α-helix	trans	-65.9	-37.7	175.9	-164.5	164.4	-171.6	170.8	0	112.5	S429 H431 S436 Q437	S429-K433 WeakPolarHBondContact O-CB 3.24Å; S429-K433 PolarHBondContact O-N 3.16Å; H431-K433 VanDerWaalsContact C-N 3.3Å; H431-K433 PolarHBondContact O-N 3.36Å; K433-S436 WeakPolarHBondContact CA-OG 3.39Å; K433-S436 PolarHBondContact O-OG 3.19Å; K433-S436 VanDerWaalsContact O-OG 3.1Å; K433-Q437 WeakPolarHBondContact O-CB 3.3Å; K433-Q437 PolarHBondContact O-N 3.27Å
434	R	61.4	Low	63.9	Low	142 Å²	142	94.5 Å²	94.5	54%	0.536	48%	0.481	S	S	.	.	H	α-helix	trans	-67.7	-42.7	171.2	-72.6	179.8	-154	179.8	6.5	112.4	V430 H431 Q437 S438	V430-R434 WeakPolarHBondContact O-CG 3.31Å; V430-R434 PolarHBondContact O-N 3.14Å; V430-R434 VanDerWaalsContact O-N 3.07Å; H431-R434 PolarHBondContact O-N 3.18Å; H431-R434 VanDerWaalsContact O-N 3.16Å; R434-Q437 PolarHBondContact O-N 3.15Å; R434-S438 WeakPolarHBondContact O-CB 3.49Å; R434-S438 PolarHBondContact O-N 3.14Å; R434-S438 PolarHBondContact O-OG 3.15Å
435	H	64.5	Low	63.6	Low	108 Å²	108	97.6 Å²	97.6	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-51	179.6	-96.7	-72.7	0	0	0	111.6	H431 D432 Q437 S438 Q439	H431-H435 AromaticContact CE1-CD2 3.3Å; H431-H435 PolarHBondContact CE1-CD2 3.4Å; H431-H435 AromaticContact CE1-NE2 3.23Å; H431-H435 PolarHBondContact CE1-NE2 3.12Å; H431-H435 AromaticContact ND1-CD2 3.66Å; H431-H435 AromaticContact ND1-NE2 3.98Å; H431-H435 AromaticContact NE2-CD2 3.59Å; H431-H435 AromaticContact NE2-NE2 3.64Å; H431-H435 PolarHBondContact O-N 3.37Å; D432-H435 PolarHBondContact O-N 3.43Å; H435-Q437 VanDerWaalsContact C-N 3.31Å; H435-Q437 PolarHBondContact O-N 3.04Å; H435-S438 PolarHBondContact O-N 3.08Å; H435-S438 PolarHBondContact O-OG 3.39Å; H435-Q439 WeakPolarHBondContact O-CB 3.39Å; H435-Q439 PolarHBondContact O-N 3.35Å
436	S	62.9	Low	62.6	Low	59 Å²	59	101 Å²	101	41%	0.413	50%	0.497	S	S	.	.	H	α-helix	trans	-58.6	-39.5	174.3	53.7	0	0	0	0	112.5	D432 K433 Q439 N440	D432-S436 WeakPolarHBondContact O-CB 3.27Å; D432-S436 PolarHBondContact O-N 3.26Å; D432-S436 PolarHBondContact O-OG 2.95Å; K433-S436 WeakPolarHBondContact CA-OG 3.39Å; K433-S436 PolarHBondContact O-OG 3.19Å; K433-S436 VanDerWaalsContact O-OG 3.1Å; S436-Q439 PolarHBondContact O-N 2.74Å; S436-N440 WeakPolarHBondContact O-CB 3.46Å; S436-N440 PolarHBondContact O-N 3.28Å; S436-N440 PolarHBondContact O-ND2 3.11Å
437	Q	62.7	Low	61.8	Low	119 Å²	119	100 Å²	100	56%	0.556	50%	0.495	S	S	*	.	H	α-helix	trans	-66.7	-43.5	175.2	-167.9	161.1	4.5	0	0	111.9	K433 R434 H435 Q439 N440 D441	K433-Q437 WeakPolarHBondContact O-CB 3.3Å; K433-Q437 PolarHBondContact O-N 3.27Å; R434-Q437 PolarHBondContact O-N 3.15Å; H435-Q437 VanDerWaalsContact C-N 3.31Å; H435-Q437 PolarHBondContact O-N 3.04Å; Q437-Q439 VanDerWaalsContact C-N 3.31Å; Q437-Q439 PolarHBondContact O-N 3.01Å; Q437-N440 PolarHBondContact O-N 3.45Å; Q437-D441 WeakPolarHBondContact O-CB 3.37Å; Q437-D441 PolarHBondContact O-N 3.46Å
438	S	59	Low	61	Low	56 Å²	56	103 Å²	103	39%	0.392	50%	0.503	S	S	.	.	H	α-helix	trans	-64	-33.7	175.6	71.1	0	0	0	0	113.5	R434 H435 L442	R434-S438 WeakPolarHBondContact O-CB 3.49Å; R434-S438 PolarHBondContact O-N 3.14Å; R434-S438 PolarHBondContact O-OG 3.15Å; H435-S438 PolarHBondContact O-N 3.08Å; H435-S438 PolarHBondContact O-OG 3.39Å; S438-L442 VanDerWaalsContact O-CG 3.32Å; S438-L442 WeakPolarHBondContact O-CG 3.43Å; S438-L442 PolarHBondContact O-N 2.83Å
439	Q	55.6	Low	60	Low	97 Å²	97	102.6 Å²	102.6	45%	0.453	51%	0.511	S	S	.	.	H	α-helix	trans	-71.2	-46.4	175.7	-173.7	57.2	49.7	0	0	110.5	H435 S436 Q437 D441 L442 D443	H435-Q439 WeakPolarHBondContact O-CB 3.39Å; H435-Q439 PolarHBondContact O-N 3.35Å; S436-Q439 PolarHBondContact O-N 2.74Å; Q437-Q439 VanDerWaalsContact C-N 3.31Å; Q437-Q439 PolarHBondContact O-N 3.01Å; Q439-D441 VanDerWaalsContact C-N 3.29Å; Q439-D441 PolarHBondContact O-N 3.48Å; Q439-L442 WeakPolarHBondContact O-CB 3.38Å; Q439-L442 PolarHBondContact O-N 3.44Å; Q439-L442 VanDerWaalsContact O-N 3.11Å; Q439-D443 WeakPolarHBondContact CG-OD2 3.22Å; Q439-D443 PolarHBondContact NE2-OD1 3.36Å; Q439-D443 PolarHBondContact NE2-OD2 3.37Å; Q439-D443 WeakPolarHBondContact O-CB 3.35Å; Q439-D443 VanDerWaalsContact O-CG 3.29Å; Q439-D443 PolarHBondContact O-N 2.89Å
440	N	60.3	Low	58.6	Low	97 Å²	97	104.6 Å²	104.6	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-34.5	174.1	-79.6	-76.2	0	0	0	112.9	S436 Q437 R444	S436-N440 WeakPolarHBondContact O-CB 3.46Å; S436-N440 PolarHBondContact O-N 3.28Å; S436-N440 PolarHBondContact O-ND2 3.11Å; Q437-N440 PolarHBondContact O-N 3.45Å; N440-R444 VanDerWaalsContact O-CB 3.29Å; N440-R444 WeakPolarHBondContact O-CB 3.47Å; N440-R444 VanDerWaalsContact O-CG 3.31Å; N440-R444 WeakPolarHBondContact O-CG 3.48Å; N440-R444 PolarHBondContact O-N 3.2Å
441	D	63.7	Low	57.1	Low	83 Å²	83	109.1 Å²	109.1	44%	0.444	53%	0.534	S	S	.	.	H	α-helix	trans	-72.6	-29.1	175	-73.7	-25.2	0	0	0	112.8	Q437 Q439 K445	Q437-D441 WeakPolarHBondContact O-CB 3.37Å; Q437-D441 PolarHBondContact O-N 3.46Å; Q439-D441 VanDerWaalsContact C-N 3.29Å; Q439-D441 PolarHBondContact O-N 3.48Å; D441-K445 WeakPolarHBondContact O-CG 3.27Å; D441-K445 PolarHBondContact O-N 3.13Å
442	L	58.6	Low	55.5	Low	104 Å²	104	110.2 Å²	110.2	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-72.1	-47.1	169.9	-76.4	168.1	0	0	0	111.2	S438 Q439 K445 Y446	S438-L442 VanDerWaalsContact O-CG 3.32Å; S438-L442 WeakPolarHBondContact O-CG 3.43Å; S438-L442 PolarHBondContact O-N 2.83Å; Q439-L442 WeakPolarHBondContact O-CB 3.38Å; Q439-L442 PolarHBondContact O-N 3.44Å; Q439-L442 VanDerWaalsContact O-N 3.11Å; L442-K445 CarbonylContact O-C 3.55Å; L442-K445 WeakPolarHBondContact O-CB 3.01Å; L442-K445 PolarHBondContact O-N 3.4Å; L442-Y446 PolarHBondContact O-N 2.94Å
443	D	56.5	Low	54	Low	74 Å²	74	108 Å²	108	40%	0.396	53%	0.531	S	S	.	.	H	α-helix	trans	-68.4	-37.4	-178	-65.4	-33	0	0	0	111.5	Q439 Y446 V447	Q439-D443 WeakPolarHBondContact CG-OD2 3.22Å; Q439-D443 PolarHBondContact NE2-OD1 3.36Å; Q439-D443 PolarHBondContact NE2-OD2 3.37Å; Q439-D443 WeakPolarHBondContact O-CB 3.35Å; Q439-D443 VanDerWaalsContact O-CG 3.29Å; Q439-D443 PolarHBondContact O-N 2.89Å; D443-Y446 CarbonylContact O-C 3.49Å; D443-Y446 WeakPolarHBondContact O-CA 3.46Å; D443-Y446 WeakPolarHBondContact O-CB 3.48Å; D443-Y446 PolarHBondContact O-N 3.34Å; D443-Y446 VanDerWaalsContact O-N 3.1Å; D443-V447 WeakPolarHBondContact O-CG2 3.39Å; D443-V447 PolarHBondContact O-N 3.38Å
444	R	57.8	Low	52.6	Low	176 Å²	176	112.9 Å²	112.9	66%	0.664	56%	0.555	S	S	*	*	H	α-helix	trans	-58.6	-48	168.2	-81.5	-179.5	171	-167	-4.5	112	N440 Y446 V447 D448	N440-R444 VanDerWaalsContact O-CB 3.29Å; N440-R444 WeakPolarHBondContact O-CB 3.47Å; N440-R444 VanDerWaalsContact O-CG 3.31Å; N440-R444 WeakPolarHBondContact O-CG 3.48Å; N440-R444 PolarHBondContact O-N 3.2Å; R444-Y446 PolarHBondContact O-N 2.94Å; R444-V447 PolarHBondContact O-N 3.41Å; R444-D448 WeakPolarHBondContact O-CB 3.3Å; R444-D448 PolarHBondContact O-N 3.23Å
445	K	53.8	Low	51.7	Low	146 Å²	146	109.1 Å²	109.1	64%	0.635	55%	0.546	S	S	*	.	H	α-helix	trans	-61	-29.3	174	-82.4	177.8	174.9	173.1	0	112.8	D441 L442 S449	D441-K445 WeakPolarHBondContact O-CG 3.27Å; D441-K445 PolarHBondContact O-N 3.13Å; L442-K445 CarbonylContact O-C 3.55Å; L442-K445 WeakPolarHBondContact O-CB 3.01Å; L442-K445 PolarHBondContact O-N 3.4Å; K445-S449 VanDerWaalsContact O-CB 3.27Å; K445-S449 WeakPolarHBondContact O-CB 3.35Å; K445-S449 PolarHBondContact O-N 3.01Å; K445-S449 PolarHBondContact O-OG 3.13Å
446	Y	43.8	Very low	50.7	Low	175 Å²	175	108 Å²	108	69%	0.686	55%	0.551	S	S	*	*	H	α-helix	trans	-74.4	-39.1	175.7	-135.7	-94.7	0	0	0	112.1	L442 D443 R444 N450	L442-Y446 PolarHBondContact O-N 2.94Å; D443-Y446 CarbonylContact O-C 3.49Å; D443-Y446 WeakPolarHBondContact O-CA 3.46Å; D443-Y446 WeakPolarHBondContact O-CB 3.48Å; D443-Y446 PolarHBondContact O-N 3.34Å; D443-Y446 VanDerWaalsContact O-N 3.1Å; R444-Y446 PolarHBondContact O-N 2.94Å; Y446-N450 PolarHBondContact O-ND2 2.95Å
447	V	51.4	Low	50.3	Low	80 Å²	80	108.3 Å²	108.3	49%	0.485	55%	0.553	S	S	.	*	H	α-helix	trans	-71	-49.3	175.5	174.5	0	0	0	0	111.2	D443 R444 S449 N450 E451	D443-V447 WeakPolarHBondContact O-CG2 3.39Å; D443-V447 PolarHBondContact O-N 3.38Å; R444-V447 PolarHBondContact O-N 3.41Å; V447-S449 PolarHBondContact O-N 3.44Å; V447-N450 PolarHBondContact O-N 3.09Å; V447-E451 PolarHBondContact O-N 3.43Å
448	D	48.3	Very low	49.5	Very low	123 Å²	123	108.6 Å²	108.6	66%	0.658	55%	0.549	S	S	*	.	H	α-helix	trans	-56.8	-26.3	175.9	-71.5	-25	0	0	0	112.6	R444	R444-D448 WeakPolarHBondContact O-CB 3.3Å; R444-D448 PolarHBondContact O-N 3.23Å
449	S	43.4	Very low	48.8	Very low	75 Å²	75	111.1 Å²	111.1	52%	0.524	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	-16.7	176.8	-64.1	0	0	0	0	114.3	K445 V447	K445-S449 VanDerWaalsContact O-CB 3.27Å; K445-S449 WeakPolarHBondContact O-CB 3.35Å; K445-S449 PolarHBondContact O-N 3.01Å; K445-S449 PolarHBondContact O-OG 3.13Å; V447-S449 PolarHBondContact O-N 3.44Å
450	N	41	Very low	48.8	Very low	112 Å²	112	110.6 Å²	110.6	60%	0.599	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-25.9	-172.3	-81.9	-54.4	0	0	0	114.2	Y446 V447 N452	Y446-N450 PolarHBondContact O-ND2 2.95Å; V447-N450 PolarHBondContact O-N 3.09Å; N450-N452 VanDerWaalsContact C-N 3.31Å; N450-N452 PolarHBondContact O-N 3.09Å
451	E	42	Very low	48.8	Very low	156 Å²	156	114.1 Å²	114.1	73%	0.729	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	3.4	-173.7	-63.2	-161.9	149.5	0	0	115.6	V447	V447-E451 PolarHBondContact O-N 3.43Å
452	N	39.1	Very low	48.2	Very low	126 Å²	126	114.8 Å²	114.8	67%	0.674	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.8	23.4	-170	-107.6	-73.8	0	0	0	117.1	N450 R458	N450-N452 VanDerWaalsContact C-N 3.31Å; N450-N452 PolarHBondContact O-N 3.09Å; N452-R458 PolarHBondContact O-NH1 2.85Å
453	L	37	Very low	48.3	Very low	53 Å²	53	113.9 Å²	113.9	28%	0.277	56%	0.559	S	S	.	*			trans	-130.5	60.2	-175.8	-81.6	94.6	0	0	0	114.9	D455 R458 L462	L453-D455 PolarHBondContact O-N 3.27Å; L453-R458 HydrophobicContact CD2-CB 3.69Å; L453-R458 HydrophobicContact CG-CB 4.47Å; L453-L462 HydrophobicContact CD2-CD1 3.52Å
454	Q	41.1	Very low	48.4	Very low	209 Å²	209	117 Å²	117	98%	0.977	57%	0.57	S	S	*	*			trans	-74.3	21.9	172.1	-149.3	172	25.2	0	0	114.1
455	D	43.1	Very low	48.4	Very low	64 Å²	64	110.4 Å²	110.4	34%	0.342	56%	0.556	S	S	.	*			trans	-133.8	110.9	-171.7	175.8	20.2	0	0	0	112.2	L453 S457 R458 M459	L453-D455 PolarHBondContact O-N 3.27Å; D455-S457 PolarHBondContact O-N 2.85Å; D455-S457 VanDerWaalsContact O-N 3.11Å; D455-S457 WeakPolarHBondContact OD1-CA 3.37Å; D455-S457 WeakPolarHBondContact OD1-CB 2.85Å; D455-S457 PolarHBondContact OD1-N 2.98Å; D455-S457 PolarHBondContact OD1-OG 2.67Å; D455-S457 WeakPolarHBondContact OD2-CB 3.44Å; D455-R458 HydrophobicContact CB-CG 4.41Å; D455-R458 PolarHBondContact O-N 3.13Å; D455-M459 PolarHBondContact O-N 3.16Å
456	S	43	Very low	48.3	Very low	85 Å²	85	109.2 Å²	109.2	59%	0.594	56%	0.556	S	S	*	*	H	α-helix	trans	-56.2	-25.6	175.5	-174.3	0	0	0	0	113	R458 M459 N460	S456-R458 VanDerWaalsContact C-N 3.29Å; S456-R458 PolarHBondContact O-N 3.15Å; S456-M459 PolarHBondContact O-N 3.15Å; S456-N460 PolarHBondContact O-N 2.84Å; S456-N460 PolarHBondContact O-ND2 2.79Å; S456-N460 PolarHBondContact OG-ND2 2.78Å
457	S	55.3	Low	48.6	Very low	65 Å²	65	105.2 Å²	105.2	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-71.1	-20.3	176.6	-33.5	0	0	0	0	113	D455 R461	D455-S457 PolarHBondContact O-N 2.85Å; D455-S457 VanDerWaalsContact O-N 3.11Å; D455-S457 WeakPolarHBondContact OD1-CA 3.37Å; D455-S457 WeakPolarHBondContact OD1-CB 2.85Å; D455-S457 PolarHBondContact OD1-N 2.98Å; D455-S457 PolarHBondContact OD1-OG 2.67Å; D455-S457 WeakPolarHBondContact OD2-CB 3.44Å; S457-R461 PolarHBondContact O-NE 3.03Å; S457-R461 PolarHBondContact O-NH2 2.87Å
458	R	45.6	Very low	49	Very low	125 Å²	125	108.1 Å²	108.1	47%	0.472	56%	0.555	S	S	.	*	H	α-helix	trans	-88.1	-40.4	170.2	-66.3	177.2	92.7	-171.4	8.7	111	N452 L453 D455 S456 N460 R461 L462	N452-R458 PolarHBondContact O-NH1 2.85Å; L453-R458 HydrophobicContact CD2-CB 3.69Å; L453-R458 HydrophobicContact CG-CB 4.47Å; D455-R458 HydrophobicContact CB-CG 4.41Å; D455-R458 PolarHBondContact O-N 3.13Å; S456-R458 VanDerWaalsContact C-N 3.29Å; S456-R458 PolarHBondContact O-N 3.15Å; R458-N460 PolarHBondContact O-N 3.25Å; R458-R461 CarbonylContact O-C 3.59Å; R458-R461 WeakPolarHBondContact O-CA 3.31Å; R458-R461 WeakPolarHBondContact O-CB 3.29Å; R458-R461 PolarHBondContact O-N 3.14Å; R458-L462 PolarHBondContact O-N 3.39Å
459	M	45.2	Very low	48.9	Very low	108 Å²	108	108.4 Å²	108.4	53%	0.532	55%	0.552	S	S	.	*	H	α-helix	trans	-62.2	-42.8	178.6	-169.4	167.8	-74.9	0	0	112.3	D455 S456 R461 L462 I463	D455-M459 PolarHBondContact O-N 3.16Å; S456-M459 PolarHBondContact O-N 3.15Å; M459-R461 PolarHBondContact O-N 2.74Å; M459-L462 PolarHBondContact O-N 2.76Å; M459-L462 VanDerWaalsContact O-N 3.14Å; M459-I463 HydrophobicContact CG-CD1 4.1Å; M459-I463 WeakPolarHBondContact O-CG1 3.32Å; M459-I463 PolarHBondContact O-N 3.19Å
460	N	55	Low	49	Very low	87 Å²	87	112.9 Å²	112.9	47%	0.465	56%	0.557	S	S	.	*	H	α-helix	trans	-64.8	-23.6	173.2	-82.3	-79.3	0	0	0	113.9	S456 R458 K464	S456-N460 PolarHBondContact O-N 2.84Å; S456-N460 PolarHBondContact O-ND2 2.79Å; S456-N460 PolarHBondContact OG-ND2 2.78Å; R458-N460 PolarHBondContact O-N 3.25Å; N460-K464 WeakPolarHBondContact O-CB 3.49Å; N460-K464 WeakPolarHBondContact O-CG 3.45Å; N460-K464 PolarHBondContact O-N 2.9Å
461	R	61.2	Low	49.2	Very low	170 Å²	170	110.8 Å²	110.8	64%	0.642	55%	0.552	S	S	*	*	H	α-helix	trans	-79.9	-35	171.5	-84	-179.7	-84	-165.3	-4.5	112.1	S457 R458 M459 G465	S457-R461 PolarHBondContact O-NE 3.03Å; S457-R461 PolarHBondContact O-NH2 2.87Å; R458-R461 CarbonylContact O-C 3.59Å; R458-R461 WeakPolarHBondContact O-CA 3.31Å; R458-R461 WeakPolarHBondContact O-CB 3.29Å; R458-R461 PolarHBondContact O-N 3.14Å; M459-R461 PolarHBondContact O-N 2.74Å; R461-G465 PolarHBondContact O-N 3.34Å
462	L	50.1	Low	49.3	Very low	98 Å²	98	105.9 Å²	105.9	51%	0.513	53%	0.534	S	S	.	.	H	α-helix	trans	-67.6	-43.7	173.1	-77.2	164.3	0	0	0	112.2	L453 R458 M459 G465 L466	L453-L462 HydrophobicContact CD2-CD1 3.52Å; R458-L462 PolarHBondContact O-N 3.39Å; M459-L462 PolarHBondContact O-N 2.76Å; M459-L462 VanDerWaalsContact O-N 3.14Å; L462-G465 PolarHBondContact O-N 3.33Å; L462-L466 WeakPolarHBondContact O-CG 3.49Å; L462-L466 PolarHBondContact O-N 2.79Å
463	I	59.8	Low	49.2	Very low	84 Å²	84	104.8 Å²	104.8	43%	0.431	53%	0.528	S	S	.	.	H	α-helix	trans	-62.1	-50.1	175.7	-66.2	167.1	0	0	0	110.1	M459 G465 L466 D467	M459-I463 HydrophobicContact CG-CD1 4.1Å; M459-I463 WeakPolarHBondContact O-CG1 3.32Å; M459-I463 PolarHBondContact O-N 3.19Å; I463-G465 VanDerWaalsContact C-N 3.25Å; I463-G465 PolarHBondContact O-N 3.06Å; I463-L466 PolarHBondContact O-N 3.27Å; I463-L466 VanDerWaalsContact O-N 3.12Å; I463-D467 PolarHBondContact O-N 3.25Å
464	K	60.6	Low	49.4	Very low	140 Å²	140	106.8 Å²	106.8	61%	0.609	54%	0.536	S	S	*	.	H	α-helix	trans	-59.2	-35.5	173.9	-76.4	-178	176.1	-176.6	0	112.8	N460 H468	N460-K464 WeakPolarHBondContact O-CB 3.49Å; N460-K464 WeakPolarHBondContact O-CG 3.45Å; N460-K464 PolarHBondContact O-N 2.9Å; K464-H468 WeakPolarHBondContact O-CB 3.43Å; K464-H468 PolarHBondContact O-N 3.18Å; K464-H468 PolarHBondContact O-ND1 2.72Å
465	G	56.1	Low	49.3	Very low	37 Å²	37	99.9 Å²	99.9	38%	0.381	51%	0.508	S	S	.	.	H	α-helix	trans	-64.9	-43.3	174.2	0	0	0	0	0	112.9	R461 L462 I463 H468 H469	R461-G465 PolarHBondContact O-N 3.34Å; L462-G465 PolarHBondContact O-N 3.33Å; I463-G465 VanDerWaalsContact C-N 3.25Å; I463-G465 PolarHBondContact O-N 3.06Å; G465-H468 PolarHBondContact O-N 2.88Å; G465-H469 WeakPolarHBondContact O-CB 3.31Å; G465-H469 PolarHBondContact O-N 3.27Å
466	L	52.5	Low	48.9	Very low	121 Å²	121	107 Å²	107	63%	0.634	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-40.1	175.7	-74.9	166.4	0	0	0	112	L462 I463 H469 R470	L462-L466 WeakPolarHBondContact O-CG 3.49Å; L462-L466 PolarHBondContact O-N 2.79Å; I463-L466 PolarHBondContact O-N 3.27Å; I463-L466 VanDerWaalsContact O-N 3.12Å; L466-H469 PolarHBondContact O-N 3.25Å; L466-R470 VanDerWaalsContact O-CB 3.3Å; L466-R470 WeakPolarHBondContact O-CB 3.46Å; L466-R470 PolarHBondContact O-N 3.33Å
467	D	50.6	Low	48.5	Very low	92 Å²	92	112.6 Å²	112.6	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-65.8	-37.9	173.8	-74.9	-32.1	0	0	0	112	I463 H469 R470 S471	I463-D467 PolarHBondContact O-N 3.25Å; D467-H469 VanDerWaalsContact C-N 3.34Å; D467-R470 PolarHBondContact O-N 2.87Å; D467-S471 WeakPolarHBondContact O-CB 3.37Å; D467-S471 PolarHBondContact O-N 2.82Å
468	H	58.8	Low	47.6	Very low	140 Å²	140	115.3 Å²	115.3	65%	0.648	55%	0.548	S	S	*	.	H	α-helix	trans	-64.5	-39.5	170.4	-79.9	63.3	0	0	0	111.5	K464 G465 S472	K464-H468 WeakPolarHBondContact O-CB 3.43Å; K464-H468 PolarHBondContact O-N 3.18Å; K464-H468 PolarHBondContact O-ND1 2.72Å; G465-H468 PolarHBondContact O-N 2.88Å; H468-S472 WeakPolarHBondContact O-CB 3.34Å; H468-S472 PolarHBondContact O-N 3.42Å
469	H	47.4	Very low	46.9	Very low	130 Å²	130	114.8 Å²	114.8	60%	0.602	55%	0.554	S	S	*	*	H	α-helix	trans	-70	-35.8	179.2	-136.5	-56	0	0	0	112.6	G465 L466 D467 L473	G465-H469 WeakPolarHBondContact O-CB 3.31Å; G465-H469 PolarHBondContact O-N 3.27Å; L466-H469 PolarHBondContact O-N 3.25Å; D467-H469 VanDerWaalsContact C-N 3.34Å; H469-L473 VanDerWaalsContact O-CG 3.31Å; H469-L473 WeakPolarHBondContact O-CG 3.33Å; H469-L473 PolarHBondContact O-N 2.99Å; H469-L473 VanDerWaalsContact O-N 3.14Å
470	R	44.8	Very low	46.3	Very low	168 Å²	168	117.6 Å²	117.6	63%	0.634	57%	0.571	S	S	*	*	H	α-helix	trans	-71.7	-49.4	175.2	-173.5	173	-169.8	167.1	6.1	111.4	L466 D467 S472 L473 E474	L466-R470 VanDerWaalsContact O-CB 3.3Å; L466-R470 WeakPolarHBondContact O-CB 3.46Å; L466-R470 PolarHBondContact O-N 3.33Å; D467-R470 PolarHBondContact O-N 2.87Å; R470-S472 VanDerWaalsContact C-N 3.25Å; R470-S472 PolarHBondContact O-N 2.63Å; R470-L473 WeakPolarHBondContact O-CA 3.48Å; R470-L473 WeakPolarHBondContact O-CB 3.49Å; R470-L473 PolarHBondContact O-N 3.45Å; R470-E474 VanDerWaalsContact CG-OE2 3.27Å; R470-E474 WeakPolarHBondContact CG-OE2 3.25Å; R470-E474 IonicContact NE-OE2 3.71Å; R470-E474 PolarHBondContact O-N 2.78Å
471	S	45.8	Very low	44.9	Very low	69 Å²	69	121.3 Å²	121.3	48%	0.483	59%	0.586	S	S	.	*	H	α-helix	trans	-59.4	-36	173.8	-172.1	0	0	0	0	111.9	D467 E474 T475	D467-S471 WeakPolarHBondContact O-CB 3.37Å; D467-S471 PolarHBondContact O-N 2.82Å; S471-E474 PolarHBondContact O-N 2.92Å; S471-T475 WeakPolarHBondContact O-CB 3.36Å; S471-T475 WeakPolarHBondContact O-CG2 3.17Å; S471-T475 PolarHBondContact O-N 3.43Å; S471-T475 PolarHBondContact O-OG1 3.02Å
472	S	43.2	Very low	43.6	Very low	52 Å²	52	118.6 Å²	118.6	36%	0.364	58%	0.584	S	S	.	*	H	α-helix	trans	-66.7	-32.4	172.8	-175.6	0	0	0	0	113.3	H468 R470 T475 R476	H468-S472 WeakPolarHBondContact O-CB 3.34Å; H468-S472 PolarHBondContact O-N 3.42Å; R470-S472 VanDerWaalsContact C-N 3.25Å; R470-S472 PolarHBondContact O-N 2.63Å; S472-T475 WeakPolarHBondContact CA-OG1 3.48Å; S472-T475 PolarHBondContact O-OG1 3.27Å; S472-R476 WeakPolarHBondContact O-CB 3.09Å; S472-R476 WeakPolarHBondContact O-CG 3.4Å; S472-R476 PolarHBondContact O-N 3.06Å; S472-R476 VanDerWaalsContact O-N 3.09Å
473	L	37.5	Very low	42.9	Very low	104 Å²	104	120 Å²	120	55%	0.545	59%	0.591	S	S	.	*	H	α-helix	trans	-77.1	-40	174.2	-73.3	166.2	0	0	0	112.4	H469 R470 R477	H469-L473 VanDerWaalsContact O-CG 3.31Å; H469-L473 WeakPolarHBondContact O-CG 3.33Å; H469-L473 PolarHBondContact O-N 2.99Å; H469-L473 VanDerWaalsContact O-N 3.14Å; R470-L473 WeakPolarHBondContact O-CA 3.48Å; R470-L473 WeakPolarHBondContact O-CB 3.49Å; R470-L473 PolarHBondContact O-N 3.45Å; L473-R477 PolarHBondContact O-N 3.42Å
474	E	40.3	Very low	41.6	Very low	95 Å²	95	121.2 Å²	121.2	44%	0.444	60%	0.599	S	S	.	*	H	α-helix	trans	-67.2	-40.8	174.5	-104	71.7	-102.8	0	0	111.9	R470 S471 R477 N478	R470-E474 VanDerWaalsContact CG-OE2 3.27Å; R470-E474 WeakPolarHBondContact CG-OE2 3.25Å; R470-E474 IonicContact NE-OE2 3.71Å; R470-E474 PolarHBondContact O-N 2.78Å; S471-E474 PolarHBondContact O-N 2.92Å; E474-R477 WeakPolarHBondContact O-CB 3.44Å; E474-R477 PolarHBondContact O-N 3.07Å; E474-N478 PolarHBondContact O-N 3.18Å
475	T	39.6	Very low	40	Very low	64 Å²	64	120.6 Å²	120.6	39%	0.393	60%	0.602	S	S	.	*	H	α-helix	trans	-71	-37.9	175.9	49.2	0	0	0	0	112.7	S471 S472 R477 N478 N479	S471-T475 WeakPolarHBondContact O-CB 3.36Å; S471-T475 WeakPolarHBondContact O-CG2 3.17Å; S471-T475 PolarHBondContact O-N 3.43Å; S471-T475 PolarHBondContact O-OG1 3.02Å; S472-T475 WeakPolarHBondContact CA-OG1 3.48Å; S472-T475 PolarHBondContact O-OG1 3.27Å; T475-R477 PolarHBondContact O-N 2.93Å; T475-R477 VanDerWaalsContact O-N 3.1Å; T475-N478 PolarHBondContact O-N 3.29Å; T475-N478 VanDerWaalsContact O-N 3.16Å; T475-N479 PolarHBondContact O-N 3.14Å
476	R	34.7	Very low	38.9	Very low	212 Å²	212	122.6 Å²	122.6	80%	0.8	60%	0.604	S	S	*	*	H	α-helix	trans	-62.7	-10.9	168.8	-81.9	179.6	164.1	-157.3	-5.4	114.4	S472	S472-R476 WeakPolarHBondContact O-CB 3.09Å; S472-R476 WeakPolarHBondContact O-CG 3.4Å; S472-R476 PolarHBondContact O-N 3.06Å; S472-R476 VanDerWaalsContact O-N 3.09Å
477	R	33.6	Very low	37.9	Very low	204 Å²	204	122.1 Å²	122.1	77%	0.77	60%	0.602	S	S	*	*	H	α-helix	trans	-98.5	-16.3	176.9	-159.9	169.7	-170.4	144.2	4.4	113.7	L473 E474 T475	L473-R477 PolarHBondContact O-N 3.42Å; E474-R477 WeakPolarHBondContact O-CB 3.44Å; E474-R477 PolarHBondContact O-N 3.07Å; T475-R477 PolarHBondContact O-N 2.93Å; T475-R477 VanDerWaalsContact O-N 3.1Å
478	N	36.7	Very low	37.1	Very low	122 Å²	122	124.2 Å²	124.2	65%	0.652	61%	0.613	S	S	*	*	H	α-helix	trans	-118.8	-16.1	-172.6	-68.3	-19.2	0	0	0	114.3	E474 T475 N480	E474-N478 PolarHBondContact O-N 3.18Å; T475-N478 PolarHBondContact O-N 3.29Å; T475-N478 VanDerWaalsContact O-N 3.16Å; N478-N480 PolarHBondContact O-N 3.34Å
479	N	31.4	Very low	35.8	Very low	113 Å²	113	123.8 Å²	123.8	60%	0.604	62%	0.615	S	S	*	*			trans	-89	104.6	176.7	-71.4	13.9	0	0	0	111.1	T475 E481	T475-N479 PolarHBondContact O-N 3.14Å; N479-E481 VanDerWaalsContact C-N 3.31Å; N479-E481 PolarHBondContact O-N 3.2Å
480	N	31.9	Very low	35.2	Very low	167 Å²	167	123.1 Å²	123.1	89%	0.893	61%	0.61	S	S	*	*			trans	-80.2	72	173.3	-71.6	-41.6	0	0	0	111.5	N478	N478-N480 PolarHBondContact O-N 3.34Å
481	E	27.4	Very low	34.7	Very low	165 Å²	165	120.8 Å²	120.8	77%	0.771	61%	0.608	S	S	*	*			trans	-137.4	99.4	170.6	-73.4	-175.1	145	0	0	110.5	N479	N479-E481 VanDerWaalsContact C-N 3.31Å; N479-E481 PolarHBondContact O-N 3.2Å
482	L	32.9	Very low	34	Very low	114 Å²	114	123.6 Å²	123.6	60%	0.597	62%	0.618	S	S	*	*				-178.5	113.5	121.8	-123.4	68.2	0	0	0	110.9	D484 L485	L482-D484 VanDerWaalsContact C-N 3.29Å; L482-D484 HydrophobicContact CD2-CB 4.09Å; L482-D484 HydrophobicContact CG-CB 3.95Å; L482-D484 WeakPolarHBondContact CG-OD2 3.48Å; L482-L485 HydrophobicContact CD2-CD1 4.28Å; L482-L485 HydrophobicContact CD2-CG 4.22Å
483	D	35.3	Very low	33.6	Very low	126 Å²	126	127.5 Å²	127.5	67%	0.674	63%	0.628	S	S	*	*	S	Bend	trans	-79.9	-18.1	157.9	-103.7	-62	0	0	0	111	L485 N486	D483-L485 PolarHBondContact O-N 3.35Å; D483-N486 WeakPolarHBondContact O-CB 3.31Å; D483-N486 PolarHBondContact O-N 3.4Å; D483-N486 PolarHBondContact OD1-ND2 3.44Å
484	D	31.8	Very low	33.4	Very low	111 Å²	111	130.2 Å²	130.2	59%	0.594	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	19.2	-173.6	-39.9	-64.6	0	0	0	114.7	L482	L482-D484 VanDerWaalsContact C-N 3.29Å; L482-D484 HydrophobicContact CD2-CB 4.09Å; L482-D484 HydrophobicContact CG-CB 3.95Å; L482-D484 WeakPolarHBondContact CG-OD2 3.48Å
485	L	28.1	Very low	33.1	Very low	127 Å²	127	128.9 Å²	128.9	67%	0.665	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	5.9	166.4	-78.7	171.6	0	0	0	113.6	L482 D483 D487	L482-L485 HydrophobicContact CD2-CD1 4.28Å; L482-L485 HydrophobicContact CD2-CG 4.22Å; D483-L485 PolarHBondContact O-N 3.35Å; L485-D487 PolarHBondContact O-N 3.43Å
486	N	32.4	Very low	33	Very low	79 Å²	79	130 Å²	130	42%	0.422	64%	0.639	S	S	.	*	S	Bend	trans	-60.3	-31.2	162.7	-105.5	-55.4	0	0	0	112	D483 N488 L489 F490	D483-N486 WeakPolarHBondContact O-CB 3.31Å; D483-N486 PolarHBondContact O-N 3.4Å; D483-N486 PolarHBondContact OD1-ND2 3.44Å; N486-N488 PolarHBondContact O-N 3.45Å; N486-L489 PolarHBondContact O-N 3.11Å; N486-F490 HydrophobicContact CB-CD2 4.44Å; N486-F490 PolarHBondContact O-N 2.97Å
487	D	31.5	Very low	33.1	Very low	111 Å²	111	124.7 Å²	124.7	59%	0.594	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-29.6	-163	-68.8	-25.8	0	0	0	115.3	L485	L485-D487 PolarHBondContact O-N 3.43Å
488	N	33	Very low	33.2	Very low	135 Å²	135	122 Å²	122	72%	0.722	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-18.9	178.4	-77.9	-69.2	0	0	0	113.7	N486	N486-N488 PolarHBondContact O-N 3.45Å
489	L	33.5	Very low	33.1	Very low	131 Å²	131	122.9 Å²	122.9	69%	0.686	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-20.3	176.9	-140.8	73.9	0	0	0	112.6	N486 M491	N486-L489 PolarHBondContact O-N 3.11Å; L489-M491 VanDerWaalsContact C-N 3.29Å; L489-M491 PolarHBondContact O-N 2.88Å
490	F	33.6	Very low	33.3	Very low	117 Å²	117	120 Å²	120	51%	0.513	62%	0.615	S	S	.	*	H	α-helix	trans	-65.7	-26.1	178.8	-109.8	-93.7	0	0	0	114.3	N486 K493 R494	N486-F490 HydrophobicContact CB-CD2 4.44Å; N486-F490 PolarHBondContact O-N 2.97Å; F490-K493 PolarHBondContact O-N 3.44Å; F490-R494 PolarHBondContact O-N 3.16Å
491	M	34	Very low	33.5	Very low	118 Å²	118	113.3 Å²	113.3	58%	0.581	59%	0.586	S	S	*	*	H	α-helix	trans	-72.7	-34.3	-176.4	-68.1	-64.9	-86.5	0	0	113.4	L489 R494 S495	L489-M491 VanDerWaalsContact C-N 3.29Å; L489-M491 PolarHBondContact O-N 2.88Å; M491-R494 PolarHBondContact O-N 2.86Å; M491-S495 PolarHBondContact O-N 3.3Å; M491-S495 PolarHBondContact O-OG 2.99Å
492	N	32.3	Very low	33.9	Very low	129 Å²	129	107.4 Å²	107.4	69%	0.69	57%	0.57	S	S	*	*	H	α-helix	trans	-79.4	-18.9	175	-90.8	-48.9	0	0	0	113.9	T496	N492-T496 PolarHBondContact O-OG1 2.94Å
493	K	35.2	Very low	34.1	Very low	133 Å²	133	107.2 Å²	107.2	58%	0.578	57%	0.568	S	S	*	*	H	α-helix	trans	-76	-35.4	164.3	-79.1	-179.3	175.7	173.6	0	112.1	F490 S495 T496 D497	F490-K493 PolarHBondContact O-N 3.44Å; K493-S495 VanDerWaalsContact C-N 3.31Å; K493-S495 PolarHBondContact O-N 3.35Å; K493-T496 PolarHBondContact O-N 2.99Å; K493-T496 PolarHBondContact O-OG1 3.05Å; K493-T496 VanDerWaalsContact O-OG1 3.05Å; K493-D497 PolarHBondContact O-N 3.37Å
494	R	33.1	Very low	34.1	Very low	162 Å²	162	110.1 Å²	110.1	61%	0.611	57%	0.569	S	S	*	*	H	α-helix	trans	-59.3	-38.1	174.2	-99.3	-179.6	169.8	165.8	-1.1	113.4	F490 M491 Q498	F490-R494 PolarHBondContact O-N 3.16Å; M491-R494 PolarHBondContact O-N 2.86Å; R494-Q498 VanDerWaalsContact O-CG 3.31Å; R494-Q498 WeakPolarHBondContact O-CG 3.44Å; R494-Q498 PolarHBondContact O-N 3.35Å
495	S	33.1	Very low	34.4	Very low	66 Å²	66	111.7 Å²	111.7	46%	0.462	57%	0.573	S	S	.	*	H	α-helix	trans	-67.8	-36.8	177.4	-57.8	0	0	0	0	113.2	M491 K493	M491-S495 PolarHBondContact O-N 3.3Å; M491-S495 PolarHBondContact O-OG 2.99Å; K493-S495 VanDerWaalsContact C-N 3.31Å; K493-S495 PolarHBondContact O-N 3.35Å
496	T	37.3	Very low	34.9	Very low	87 Å²	87	111.7 Å²	111.7	53%	0.534	57%	0.57	S	S	.	*	H	α-helix	trans	-77.8	-31.7	177	47.3	0	0	0	0	112.5	N492 K493 L499 S500	N492-T496 PolarHBondContact O-OG1 2.94Å; K493-T496 PolarHBondContact O-N 2.99Å; K493-T496 PolarHBondContact O-OG1 3.05Å; K493-T496 VanDerWaalsContact O-OG1 3.05Å; T496-L499 PolarHBondContact O-N 3.42Å; T496-S500 PolarHBondContact O-N 3.32Å
497	D	36.3	Very low	35.1	Very low	102 Å²	102	113 Å²	113	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-78.6	-19.6	174	-80.1	-39.7	0	0	0	114.7	K493 S500 G501	K493-D497 PolarHBondContact O-N 3.37Å; D497-S500 WeakPolarHBondContact CA-OG 3.47Å; D497-S500 PolarHBondContact O-OG 3.26Å; D497-S500 PolarHBondContact OD1-OG 3.34Å; D497-G501 PolarHBondContact O-N 3.01Å
498	Q	36.6	Very low	35.4	Very low	148 Å²	148	113.8 Å²	113.8	69%	0.692	58%	0.576	S	S	*	*	H	α-helix	trans	-70.5	-34.2	166.1	-76.1	176	28.2	0	0	112	R494 G502	R494-Q498 VanDerWaalsContact O-CG 3.31Å; R494-Q498 WeakPolarHBondContact O-CG 3.44Å; R494-Q498 PolarHBondContact O-N 3.35Å; Q498-G502 PolarHBondContact O-N 3.25Å
499	L	35.3	Very low	35.5	Very low	139 Å²	139	110.6 Å²	110.6	73%	0.728	57%	0.565	S	S	*	*	H	α-helix	trans	-76	-31.3	172.1	-77	161.7	0	0	0	112.8	T496	T496-L499 PolarHBondContact O-N 3.42Å
500	S	33.7	Very low	35.7	Very low	52 Å²	52	111 Å²	111	36%	0.364	56%	0.563	S	S	.	*	H	α-helix	trans	-73.6	-33.1	172.7	90.6	0	0	0	0	112.4	T496 D497 R504	T496-S500 PolarHBondContact O-N 3.32Å; D497-S500 WeakPolarHBondContact CA-OG 3.47Å; D497-S500 PolarHBondContact O-OG 3.26Å; D497-S500 PolarHBondContact OD1-OG 3.34Å; S500-R504 PolarHBondContact O-N 2.82Å
501	G	36.8	Very low	35.9	Very low	27 Å²	27	109.2 Å²	109.2	28%	0.278	56%	0.562	S	S	.	*	H	α-helix	trans	-66.1	-41.2	179.2	0	0	0	0	0	114.4	D497 I503 R504 Q505	D497-G501 PolarHBondContact O-N 3.01Å; G501-I503 VanDerWaalsContact C-N 3.32Å; G501-I503 PolarHBondContact O-N 3.42Å; G501-R504 PolarHBondContact O-N 2.9Å; G501-R504 VanDerWaalsContact O-N 3.16Å; G501-Q505 PolarHBondContact O-N 3.15Å; G501-Q505 VanDerWaalsContact O-N 3.13Å
502	G	35.5	Very low	35.9	Very low	42 Å²	42	108.5 Å²	108.5	43%	0.433	56%	0.56	S	S	.	*	H	α-helix	trans	-59.9	-39.3	180	0	0	0	0	0	113.5	Q498 Q506	Q498-G502 PolarHBondContact O-N 3.25Å; G502-Q506 PolarHBondContact O-N 3.45Å
503	I	37.6	Very low	35.9	Very low	110 Å²	110	109.9 Å²	109.9	56%	0.564	56%	0.56	S	S	*	*	H	α-helix	trans	-72.7	-34.4	178.3	-64.2	172.3	0	0	0	111	G501 Q506 L507	G501-I503 VanDerWaalsContact C-N 3.32Å; G501-I503 PolarHBondContact O-N 3.42Å; I503-Q506 PolarHBondContact O-N 3.43Å; I503-L507 HydrophobicContact CG2-CD1 4.09Å; I503-L507 PolarHBondContact O-N 2.84Å
504	R	35.6	Very low	36	Very low	186 Å²	186	109.2 Å²	109.2	70%	0.702	56%	0.563	S	S	*	*	H	α-helix	trans	-68.3	-31.3	176.2	-79.6	-173.5	166.6	-164.9	-2.9	113.5	S500 G501 L507 Q508	S500-R504 PolarHBondContact O-N 2.82Å; G501-R504 PolarHBondContact O-N 2.9Å; G501-R504 VanDerWaalsContact O-N 3.16Å; R504-L507 PolarHBondContact O-N 2.91Å; R504-Q508 WeakPolarHBondContact O-CG 3.39Å; R504-Q508 PolarHBondContact O-N 3.01Å
505	Q	38.8	Very low	36.2	Very low	144 Å²	144	108 Å²	108	67%	0.673	56%	0.564	S	S	*	*	H	α-helix	trans	-75.4	-27.8	176.8	-71.1	-175.1	-11.7	0	0	113.6	G501 S509	G501-Q505 PolarHBondContact O-N 3.15Å; G501-Q505 VanDerWaalsContact O-N 3.13Å; Q505-S509 PolarHBondContact O-N 2.9Å; Q505-S509 PolarHBondContact O-OG 3.32Å
506	Q	36.9	Very low	36.4	Very low	127 Å²	127	112 Å²	112	59%	0.593	58%	0.575	S	S	*	*	H	α-helix	trans	-72.4	-36.4	169	-74.3	-172.3	-29.2	0	0	112.5	G502 I503 S509	G502-Q506 PolarHBondContact O-N 3.45Å; I503-Q506 PolarHBondContact O-N 3.43Å; Q506-S509 WeakPolarHBondContact CA-OG 3.16Å; Q506-S509 PolarHBondContact O-N 3.43Å; Q506-S509 PolarHBondContact O-OG 2.88Å; Q506-S509 VanDerWaalsContact O-OG 3.08Å
507	L	37.3	Very low	36.2	Very low	107 Å²	107	117 Å²	117	56%	0.56	59%	0.59	S	S	*	*	H	α-helix	trans	-72.8	-26.5	175.3	-84.4	154.1	0	0	0	113.9	I503 R504 T511	I503-L507 HydrophobicContact CG2-CD1 4.09Å; I503-L507 PolarHBondContact O-N 2.84Å; R504-L507 PolarHBondContact O-N 2.91Å; L507-T511 PolarHBondContact O-OG1 3.17Å
508	Q	37.3	Very low	36	Very low	127 Å²	127	117 Å²	117	59%	0.593	60%	0.598	S	S	*	*	H	α-helix	trans	-79.4	-16.5	172.6	-77.5	-175.7	-40.5	0	0	114.4	R504 T511	R504-Q508 WeakPolarHBondContact O-CG 3.39Å; R504-Q508 PolarHBondContact O-N 3.01Å; Q508-T511 WeakPolarHBondContact CA-OG1 3.49Å
509	S	36	Very low	35.7	Very low	68 Å²	68	118.1 Å²	118.1	48%	0.476	60%	0.603	S	S	.	*	H	α-helix	trans	-91.4	-11	178.7	39.6	0	0	0	0	114.4	Q505 Q506	Q505-S509 PolarHBondContact O-N 2.9Å; Q505-S509 PolarHBondContact O-OG 3.32Å; Q506-S509 WeakPolarHBondContact CA-OG 3.16Å; Q506-S509 PolarHBondContact O-N 3.43Å; Q506-S509 PolarHBondContact O-OG 2.88Å; Q506-S509 VanDerWaalsContact O-OG 3.08Å
510	Q	38.5	Very low	35.6	Very low	140 Å²	140	120.2 Å²	120.2	65%	0.654	61%	0.609	S	S	*	*	H	α-helix	trans	-86	-45.8	164.3	-73.3	179.1	-32.3	0	0	111.5	L512 K513	Q510-L512 PolarHBondContact O-N 3.19Å; Q510-K513 PolarHBondContact O-N 3.11Å; Q510-K513 VanDerWaalsContact O-N 3.15Å
511	T	36.9	Very low	35.6	Very low	79 Å²	79	126.4 Å²	126.4	49%	0.485	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.3	-8.1	179.7	43.1	0	0	0	0	115.3	L507 Q508	L507-T511 PolarHBondContact O-OG1 3.17Å; Q508-T511 WeakPolarHBondContact CA-OG1 3.49Å
512	L	33.7	Very low	35.2	Very low	104 Å²	104	132.7 Å²	132.7	55%	0.545	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.6	-5	175.4	-105.7	163	0	0	0	115.2	Q510	Q510-L512 PolarHBondContact O-N 3.19Å
513	K	33.6	Very low	35	Very low	157 Å²	157	138.7 Å²	138.7	68%	0.683	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-40.4	172.4	-70.2	-171.7	175.8	-176.5	0	112	Q510 Q515 Q516	Q510-K513 PolarHBondContact O-N 3.11Å; Q510-K513 VanDerWaalsContact O-N 3.15Å; K513-Q515 PolarHBondContact O-N 3.31Å; K513-Q516 PolarHBondContact O-N 3.25Å
514	D	36.5	Very low	34.8	Very low	120 Å²	120	141.8 Å²	141.8	64%	0.642	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-27.1	179.5	-54.4	-24.1	0	0	0	112.8
515	Q	36.9	Very low	34.5	Very low	135 Å²	135	140.8 Å²	140.8	63%	0.631	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-16.8	178	-69.8	-168.8	-5.8	0	0	114.4	K513	K513-Q515 PolarHBondContact O-N 3.31Å
516	Q	36.9	Very low	34	Very low	150 Å²	150	137.1 Å²	137.1	70%	0.701	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-24.3	178.6	-71.1	-169	-26.8	0	0	113.4	K513 S518	K513-Q516 PolarHBondContact O-N 3.25Å; Q516-S518 VanDerWaalsContact C-N 3.3Å; Q516-S518 PolarHBondContact O-N 3.1Å
517	F	33	Very low	33.5	Very low	194 Å²	194	134.2 Å²	134.2	85%	0.851	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-76.4	-15.5	177.7	-121.2	-89.7	0	0	0	114.1
518	S	32.6	Very low	32.9	Very low	102 Å²	102	134.2 Å²	134.2	71%	0.713	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-90.2	3.7	-172.2	-61.9	0	0	0	0	115.1	Q516	Q516-S518 VanDerWaalsContact C-N 3.3Å; Q516-S518 PolarHBondContact O-N 3.1Å
519	Q	31.7	Very low	32.3	Very low	171 Å²	171	130.3 Å²	130.3	80%	0.799	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-112.6	7.9	-174.1	-65.3	-165.8	3.4	0	0	115.6
520	Q	32.7	Very low	31.9	Very low	182 Å²	182	130.2 Å²	130.2	85%	0.85	65%	0.651	S	S	*	*	S	Bend	trans	-112.6	6.3	-177.8	-68.9	-167	-7	0	0	116.1
521	Q	32.5	Very low	31.7	Very low	182 Å²	182	127.2 Å²	127.2	85%	0.85	64%	0.643	S	S	*	*			trans	-123.7	55.3	178.7	-64.5	-167.1	4	0	0	113.7
522	H	30	Very low	31.4	Very low	159 Å²	159	128.9 Å²	128.9	74%	0.736	65%	0.649	S	S	*	*			trans	-124.8	63.7	166.6	-100	-4.5	0	0	0	111.5
523	Q	30	Very low	31	Very low	168 Å²	168	130.9 Å²	130.9	79%	0.785	66%	0.66	S	S	*	*			trans	-168.4	155.8	163.7	-108.5	145.4	99.8	0	0	109.9
524	H	33.9	Very low	31	Very low	175 Å²	175	130.3 Å²	130.3	81%	0.81	66%	0.663	S	S	*	*			trans	57.7	95	-179.1	-49.4	-75.3	0	0	0	114.2
525	K	28.3	Very low	30.9	Very low	165 Å²	165	130.6 Å²	130.6	72%	0.717	66%	0.664	S	S	*	*			cis	70.6	127.1	47.7	-132.8	-166.8	-162.4	-161.1	0	114.1
526	S	29	Very low	30.8	Very low	68 Å²	68	131 Å²	131	48%	0.476	67%	0.669	S	S	.	*			trans	69	139.9	158.7	42.7	0	0	0	0	121.4	N1496	S526-N1496 WeakPolarHBondContact CB-OD1 3.36Å
527	S	27.1	Very low	30.6	Very low	65 Å²	65	129.9 Å²	129.9	46%	0.455	68%	0.675	S	S	.	*			trans	55.2	97.3	155.9	48.3	0	0	0	0	119.8
528	L	25	Very low	30.8	Very low	108 Å²	108	123.9 Å²	123.9	57%	0.565	67%	0.668	S	S	*	*				29.6	125	117.9	-90.8	-75.7	0	0	0	119.3	R1494	L528-R1494 WeakPolarHBondContact CD2-O 3.13Å
529	S	23.4	Very low	30.8	Very low	45 Å²	45	126.4 Å²	126.4	32%	0.315	67%	0.672	S	S	.	*			trans	74.1	118.5	142.9	126.7	0	0	0	0	117.3	N1492 D1493	S529-N1492 WeakPolarHBondContact OG-CA 3.36Å; S529-N1492 PolarHBondContact OG-OD1 3.27Å; S529-D1493 PolarHBondContact OG-N 3.2Å
530	T	28.7	Very low	30.8	Very low	66 Å²	66	125.5 Å²	125.5	41%	0.405	67%	0.667	S	S	.	*				60.3	145	74.7	66.1	0	0	0	0	114.6	N1490 T1491	T530-N1490 VanDerWaalsContact CB-OD1 3.3Å; T530-N1490 WeakPolarHBondContact CB-OD1 3.48Å; T530-N1490 WeakPolarHBondContact CG2-OD1 3.29Å; T530-T1491 VanDerWaalsContact OG1-CA 3.24Å; T530-T1491 WeakPolarHBondContact OG1-CA 3.36Å; T530-T1491 PolarHBondContact OG1-N 2.88Å
531	P	33.9	Very low	30.8	Very low	76 Å²	76	124.2 Å²	124.2	49%	0.494	66%	0.661	S	S	.	*			cis	-140.2	174.4	19.7	44.9	-28.8	0	0	0	118.5	N1490 T1491	P531-N1490 WeakPolarHBondContact CA-OD1 3.46Å; P531-N1490 HydrophobicContact CB-CB 3.79Å; P531-N1490 WeakPolarHBondContact CB-OD1 3.37Å; P531-T1491 HydrophobicContact CB-CG2 4.16Å; P531-T1491 HydrophobicContact CG-CG2 3.89Å
532	N	29.8	Very low	30.5	Very low	114 Å²	114	121 Å²	121	61%	0.61	65%	0.649	S	S	*	*			trans	75.5	143.2	137	-80.7	-1.5	0	0	0	126.4	N1490	N532-N1490 PolarHBondContact OD1-ND2 3.17Å
533	L	26.8	Very low	30.6	Very low	147 Å²	147	118.3 Å²	118.3	77%	0.77	64%	0.641	S	S	*	*			trans	91.6	158.1	132.9	-85	166.2	0	0	0	123.5
534	I	32	Very low	30.5	Very low	145 Å²	145	117.1 Å²	117.1	74%	0.744	64%	0.637	S	S	*	*			trans	77.2	129.3	164.7	-65.9	142.2	0	0	0	115
535	N	35.8	Very low	30.3	Very low	125 Å²	125	112.1 Å²	112.1	67%	0.668	61%	0.614	S	S	*	*			cis	-147.3	157.8	5.2	-103.8	-9.1	0	0	0	109
536	I	33.2	Very low	30.5	Very low	145 Å²	145	109.9 Å²	109.9	74%	0.744	61%	0.614	S	S	*	*			cis	73.6	135.3	47.5	-60.5	179.3	0	0	0	113.2
537	P	34.3	Very low	30.5	Very low	125 Å²	125	111.7 Å²	111.7	81%	0.812	62%	0.619	S	S	*	*			cis	-136.6	-177	-15.2	40.5	-22.8	0	0	0	116.5
538	G	35.9	Very low	30.5	Very low	68 Å²	68	115.4 Å²	115.4	70%	0.701	63%	0.633	S	S	*	*			trans	142	112.9	133	0	0	0	0	0	123.4
539	I	32.7	Very low	30.8	Very low	156 Å²	156	116.2 Å²	116.2	80%	0.8	64%	0.638	S	S	*	*			trans	82.3	106.5	137.9	-58.8	175.7	0	0	0	121.5
540	H	32.3	Very low	31.1	Very low	152 Å²	152	120.8 Å²	120.8	70%	0.704	66%	0.659	S	S	*	*			trans	57.7	145.6	148.5	-69.1	-131.1	0	0	0	119.2
541	Q	32.1	Very low	31.2	Very low	154 Å²	154	123.8 Å²	123.8	72%	0.72	67%	0.672	S	S	*	*			cis	-167	152.5	-0.7	-113.5	166	-20.8	0	0	105.3
542	N	27	Very low	31	Very low	114 Å²	114	124.3 Å²	124.3	61%	0.61	68%	0.682	S	S	*	*			cis	-164.9	141.1	-9.8	-131.3	53	0	0	0	106.6
543	D	30.7	Very low	31	Very low	104 Å²	104	126.8 Å²	126.8	56%	0.556	69%	0.69	S	S	*	*			trans	63.5	160.3	155.7	-38.4	-33	0	0	0	117.5
544	M	29.8	Very low	31.1	Very low	143 Å²	143	126.4 Å²	126.4	70%	0.704	68%	0.682	S	S	*	*			cis	-149.2	106.9	-7.5	-131.4	161.3	-172.1	0	0	111.5
545	E	29.3	Very low	30.8	Very low	69 Å²	69	127 Å²	127	32%	0.322	68%	0.679	S	S	.	*				85.9	63.2	109.2	-71.7	-150.5	116.2	0	0	122.2	T1479 D1480	E545-T1479 VanDerWaalsContact CB-CB 3.49Å; E545-T1479 HydrophobicContact CB-CG2 3.39Å; E545-T1479 VanDerWaalsContact CG-CB 3.47Å; E545-T1479 HydrophobicContact CG-CG2 3.65Å; E545-T1479 WeakPolarHBondContact OE1-CB 3.28Å; E545-T1479 WeakPolarHBondContact OE1-CG2 3.46Å; E545-T1479 PolarHBondContact OE1-OG1 2.84Å; E545-D1480 HydrophobicContact CG-CB 4.46Å; E545-D1480 WeakPolarHBondContact CG-OD2 3.31Å; E545-D1480 VanDerWaalsContact N-CG 3.26Å; E545-D1480 PolarHBondContact N-OD1 2.78Å
546	T	31.9	Very low	30.5	Very low	119 Å²	119	126 Å²	126	73%	0.73	68%	0.683	S	S	*	*			trans	-153.5	143.8	149.2	-65.9	0	0	0	0	113.5	D1480	T546-D1480 VanDerWaalsContact C-N 3.29Å; T546-D1480 CarbonylContact O-C 3.56Å
547	N	28.7	Very low	30.2	Very low	106 Å²	106	123.1 Å²	123.1	57%	0.567	68%	0.675	S	S	*	*			trans	-129.8	173.4	173.5	-111	-48.1	0	0	0	112.6	T1479 D1480	N547-T1479 PolarHBondContact ND2-O 3.31Å; N547-T1479 VanDerWaalsContact ND2-O 3.12Å; N547-D1480 PolarHBondContact ND2-O 2.97Å; N547-D1480 PolarHBondContact OD1-O 2.82Å
548	D	28.3	Very low	29.7	Very low	142 Å²	142	121.3 Å²	121.3	76%	0.759	66%	0.662	S	S	*	*			trans	-59.3	152.9	165.8	-73.3	-58	0	0	0	112.9
549	D	29.7	Very low	29.4	Very low	125 Å²	125	123.7 Å²	123.7	67%	0.668	66%	0.657	S	S	*	*			trans	-143.2	132	155.7	-143.2	-14.5	0	0	0	112
550	N	29.9	Very low	29.3	Very low	141 Å²	141	121.7 Å²	121.7	75%	0.754	65%	0.645	S	S	*	*			trans	-109.1	120.9	-174.6	-75.1	-104.4	0	0	0	109.8
551	I	31.8	Very low	29.3	Very low	130 Å²	130	117.2 Å²	117.2	67%	0.667	64%	0.639	S	S	*	*			trans	-151	139.9	174.2	-102.3	139.8	0	0	0	114.3
552	A	29.7	Very low	29.2	Very low	86 Å²	86	117.2 Å²	117.2	71%	0.711	64%	0.644	S	S	*	*			trans	57.4	134.5	168.3	0	0	0	0	0	118.7
553	E	28.5	Very low	29.4	Very low	167 Å²	167	117.8 Å²	117.8	78%	0.78	65%	0.647	S	S	*	*			cis	82.2	139.6	34.2	-72.5	-136.9	132.3	0	0	117.6
554	K	29	Very low	29.3	Very low	139 Å²	139	120 Å²	120	60%	0.604	66%	0.657	S	S	*	*			trans	78.3	118.7	160.3	-74.6	167.8	-174.2	163.1	0	120.5
555	K	25.3	Very low	29.2	Very low	156 Å²	156	116.5 Å²	116.5	68%	0.678	64%	0.644	S	S	*	*			trans	77.9	174.9	143.5	-64.1	176.6	-178.9	176.9	0	117.3	S1469	K555-S1469 PolarHBondContact NZ-O 2.86Å
556	S	29.6	Very low	29.1	Very low	106 Å²	106	119.5 Å²	119.5	74%	0.741	66%	0.663	S	S	*	*			trans	-64.3	159.4	-169.2	-48.7	0	0	0	0	115.7
557	S	26.8	Very low	28.9	Very low	84 Å²	84	120.3 Å²	120.3	59%	0.587	66%	0.656	S	S	*	*			trans	66.4	114.4	134.5	63.8	0	0	0	0	120
558	T	24.5	Very low	28.9	Very low	87 Å²	87	123.5 Å²	123.5	53%	0.534	67%	0.665	S	S	.	*				89.7	137.7	118.7	-62.8	0	0	0	0	118.6
559	I	29.4	Very low	28.7	Very low	117 Å²	117	124.1 Å²	124.1	60%	0.6	66%	0.661	S	S	*	*			trans	76.5	117	162.4	-85.1	167.3	0	0	0	118.1
560	Q	30.7	Very low	28.3	Very low	115 Å²	115	123.7 Å²	123.7	54%	0.537	66%	0.658	S	S	.	*				51.8	130.1	123	-148.9	169.3	-33.4	0	0	120.8	T883	Q560-T883 VanDerWaalsContact CA-O 3.3Å; Q560-T883 WeakPolarHBondContact CA-O 3.2Å; Q560-T883 VanDerWaalsContact CB-O 3.27Å; Q560-T883 WeakPolarHBondContact CB-O 3.28Å; Q560-T883 PolarHBondContact N-O 2.65Å
561	G	33.2	Very low	28.3	Very low	58 Å²	58	124.7 Å²	124.7	60%	0.598	66%	0.662	S	S	*	*			trans	145.8	121.7	162.7	0	0	0	0	0	111.9
562	D	29.3	Very low	28	Very low	153 Å²	153	123.2 Å²	123.2	82%	0.818	66%	0.655	S	S	*	*			trans	58.3	150.2	145.4	-59.5	-5.8	0	0	0	120.5
563	L	30.7	Very low	28	Very low	127 Å²	127	125 Å²	125	67%	0.665	66%	0.657	S	S	*	*			cis	-149.1	133.5	-38.3	-146.5	59	0	0	0	103.8
564	L	28.9	Very low	27.9	Very low	149 Å²	149	122.3 Å²	122.3	78%	0.78	65%	0.652	S	S	*	*				43.8	152.4	77.4	-111.4	80.3	0	0	0	115.3
565	T	28.1	Very low	28	Very low	70 Å²	70	121.6 Å²	121.6	43%	0.429	65%	0.653	S	S	.	*			trans	62.5	78.3	166.1	43.7	0	0	0	0	117.8	K568	T565-K568 HydrophobicContact CG2-CB 4.47Å; T565-K568 HydrophobicContact CG2-CD 3.62Å
566	D	26.1	Very low	28.2	Very low	132 Å²	132	121.3 Å²	121.3	71%	0.706	66%	0.655	S	S	*	*	S	Bend		-157.1	126.1	124.9	-113	2.3	0	0	0	109.5
567	K	28.7	Very low	28.2	Very low	136 Å²	136	123.6 Å²	123.6	59%	0.591	65%	0.653	S	S	*	*			cis	-134.4	139.4	-19.3	-101.4	124.2	179.1	145.5	0	104.7	K569	K567-K569 HydrophobicContact CB-CB 4.49Å; K567-K569 HydrophobicContact CG-CG 4.25Å
568	K	28.4	Very low	28.4	Very low	174 Å²	174	126.1 Å²	126.1	76%	0.757	65%	0.654	S	S	*	*			cis	53	39.7	18.2	-141.2	-176.6	-175.2	-176.4	0	115.2	T565	T565-K568 HydrophobicContact CG2-CB 4.47Å; T565-K568 HydrophobicContact CG2-CD 3.62Å
569	K	24.7	Very low	28.7	Very low	154 Å²	154	126.9 Å²	126.9	67%	0.67	66%	0.655	S	S	*	*			trans	-119.5	134.3	142.1	-88.5	-172.7	174.3	-175	0	106.4	K567	K567-K569 HydrophobicContact CB-CB 4.49Å; K567-K569 HydrophobicContact CG-CG 4.25Å
570	L	21.5	Very low	28.8	Very low	116 Å²	116	127.6 Å²	127.6	61%	0.607	66%	0.655	S	S	*	*				51.8	120.4	78.7	-71.2	72.8	0	0	0	108.4	N572	L570-N572 WeakPolarHBondContact CD2-OD1 3.38Å; L570-N572 VanDerWaalsContact CG-OD1 3.29Å; L570-N572 WeakPolarHBondContact CG-OD1 3.45Å
571	I	28.7	Very low	29	Very low	162 Å²	162	125.3 Å²	125.3	83%	0.831	65%	0.651	S	S	*	*				-127.6	115.4	56.9	-81	150.1	0	0	0	108.4
572	N	26.8	Very low	28.8	Very low	100 Å²	100	131.5 Å²	131.5	54%	0.535	66%	0.661	S	S	.	*				71.5	129.8	77.2	-78.6	6.8	0	0	0	112.1	L570	L570-N572 WeakPolarHBondContact CD2-OD1 3.38Å; L570-N572 VanDerWaalsContact CG-OD1 3.29Å; L570-N572 WeakPolarHBondContact CG-OD1 3.45Å
573	V	29.2	Very low	28.9	Very low	122 Å²	122	131.7 Å²	131.7	74%	0.739	66%	0.655	S	S	*	*			trans	66.6	127	151.7	179.2	0	0	0	0	113.2
574	T	27	Very low	28.9	Very low	112 Å²	112	129.1 Å²	129.1	69%	0.687	65%	0.647	S	S	*	*			cis	-143.7	142.5	45.1	-27.3	0	0	0	0	107.4
575	I	30.4	Very low	29	Very low	123 Å²	123	127.5 Å²	127.5	63%	0.631	64%	0.64	S	S	*	*				33.2	117.1	90.3	-29.2	172.2	0	0	0	110
576	E	30.4	Very low	29.2	Very low	151 Å²	151	130.5 Å²	130.5	71%	0.706	65%	0.652	S	S	*	*			cis	-132.5	153.9	44.7	-66.7	169.4	-155.1	0	0	111.4	K578	E576-K578 IonicContact OE2-NZ 2.61Å; E576-K578 PolarHBondContact OE2-NZ 2.97Å
577	E	28.2	Very low	29.3	Very low	153 Å²	153	130.6 Å²	130.6	72%	0.715	65%	0.649	S	S	*	*			cis	66.3	78.4	41.5	-72	-157.1	155.9	0	0	115.9
578	K	32.1	Very low	29.4	Very low	138 Å²	138	130.5 Å²	130.5	60%	0.6	66%	0.656	S	S	*	*				-157.1	136.1	125.1	-87.4	116.1	-145	155.1	0	106.6	E576	E576-K578 IonicContact OE2-NZ 2.61Å; E576-K578 PolarHBondContact OE2-NZ 2.97Å
579	N	29.5	Very low	29.8	Very low	102 Å²	102	125.7 Å²	125.7	55%	0.545	66%	0.655	S	S	.	*			cis	76.9	123.5	49.8	-65	1.2	0	0	0	110
580	E	33	Very low	30	Very low	132 Å²	132	124.4 Å²	124.4	62%	0.617	65%	0.651	S	S	*	*			cis	-144.9	-122.2	21.6	-130.2	169.3	-162.1	0	0	117	D770	E580-D770 PolarHBondContact N-OD2 3.02Å
581	P	33.9	Very low	30.3	Very low	68 Å²	68	126.5 Å²	126.5	44%	0.442	66%	0.656	S	S	.	*				-107.6	128.4	-90.6	32	-26.2	0	0	0	115.7	Y772	P581-Y772 VanDerWaalsContact O-CE2 3.22Å; P581-Y772 WeakPolarHBondContact O-CE2 3.43Å
582	K	29.8	Very low	30.4	Very low	187 Å²	187	126.2 Å²	126.2	81%	0.813	65%	0.651	S	S	*	*			trans	-24.7	138.7	141.7	-51.7	149.9	-176.9	163.5	0	113.5
583	K	31.1	Very low	30.6	Very low	157 Å²	157	130.6 Å²	130.6	68%	0.683	66%	0.66	S	S	*	*				-149.6	123.6	112.3	-86.7	-155.3	175.3	176.3	0	109.1	Y772	K583-Y772 VanDerWaalsContact C-OH 3.29Å; K583-Y772 PolarHBondContact N-OH 2.99Å; K583-Y772 WeakPolarHBondContact O-CE1 3.06Å; K583-Y772 VanDerWaalsContact O-CZ 3.24Å; K583-Y772 PolarHBondContact O-OH 3.14Å
584	S	30.8	Very low	30.7	Very low	73 Å²	73	129.3 Å²	129.3	51%	0.51	65%	0.652	S	S	.	*				65.2	139.8	73.8	90.3	0	0	0	0	110.9
585	D	31.2	Very low	30.7	Very low	116 Å²	116	127.5 Å²	127.5	62%	0.62	64%	0.644	S	S	*	*			cis	-138.2	147.8	30.3	-88.4	-65	0	0	0	111.7
586	I	31.2	Very low	30.7	Very low	133 Å²	133	128.6 Å²	128.6	68%	0.682	66%	0.657	S	S	*	*				66.3	132.6	77.1	-88.1	-171.2	0	0	0	110.9
587	M	29.9	Very low	31.1	Very low	133 Å²	133	128.1 Å²	128.1	66%	0.655	65%	0.652	S	S	*	*			cis	-159.3	154.2	11.2	-117.5	163	16	0	0	112.9
588	D	30.4	Very low	31.2	Very low	135 Å²	135	125.7 Å²	125.7	72%	0.722	65%	0.648	S	S	*	*			trans	58.9	-179.6	139.2	-55.8	-15	0	0	0	122.2
589	G	35.3	Very low	31	Very low	72 Å²	72	125.3 Å²	125.3	74%	0.742	65%	0.653	S	S	*	*			trans	89.6	35.5	-177.2	0	0	0	0	0	114.3
590	E	29.1	Very low	30.9	Very low	128 Å²	128	126.5 Å²	126.5	60%	0.598	66%	0.655	S	S	*	*				53.2	101.4	81.1	-81.7	-112	125.6	0	0	115.7
591	K	29.2	Very low	30.9	Very low	160 Å²	160	127.7 Å²	127.7	70%	0.696	66%	0.663	S	S	*	*			trans	73.2	160.1	139.4	-61	171	179.6	144.1	0	119.5
592	Q	30.7	Very low	30.6	Very low	155 Å²	155	131.4 Å²	131.4	72%	0.724	68%	0.679	S	S	*	*			trans	79	133.2	172.9	-52.8	-171.1	75.7	0	0	115.1
593	R	30.5	Very low	30.7	Very low	192 Å²	192	128.7 Å²	128.7	73%	0.725	67%	0.672	S	S	*	*			cis	-157.5	131.1	-4.4	-131.2	168.9	169.1	153.2	-15.4	113.7
594	T	30.3	Very low	30.5	Very low	95 Å²	95	126.1 Å²	126.1	58%	0.583	67%	0.67	S	S	*	*			trans	56.5	114.7	145.6	46.6	0	0	0	0	121	K597	T594-K597 PolarHBondContact O-NZ 2.87Å
595	S	28.6	Very low	30.4	Very low	75 Å²	75	129.2 Å²	129.2	52%	0.524	68%	0.68	S	S	.	*	S	Bend		75.4	117.7	127.7	69.5	0	0	0	0	120.7	K597	S595-K597 VanDerWaalsContact O-CD 3.22Å; S595-K597 WeakPolarHBondContact O-CD 3.48Å; S595-K597 WeakPolarHBondContact O-CE 3.36Å; S595-K597 WeakPolarHBondContact O-CG 3.4Å
596	T	29	Very low	30.4	Very low	146 Å²	146	130.7 Å²	130.7	90%	0.896	69%	0.687	S	S	*	*	S	Bend	trans	53.3	62.6	152.1	61.8	0	0	0	0	114.3
597	K	38.7	Very low	30.6	Very low	140 Å²	140	131.7 Å²	131.7	61%	0.609	69%	0.69	S	S	*	*			trans	-160.1	150.1	-158.4	-91.8	170.6	-164.5	166.9	0	110.8	T594 S595	T594-K597 PolarHBondContact O-NZ 2.87Å; S595-K597 VanDerWaalsContact O-CD 3.22Å; S595-K597 WeakPolarHBondContact O-CD 3.48Å; S595-K597 WeakPolarHBondContact O-CE 3.36Å; S595-K597 WeakPolarHBondContact O-CG 3.4Å
598	T	31.2	Very low	30.5	Very low	103 Å²	103	133 Å²	133	63%	0.632	70%	0.7	S	S	*	*			cis	-161.3	154.1	-20.4	6.8	0	0	0	0	106.3
599	D	28.4	Very low	30.6	Very low	130 Å²	130	133 Å²	133	70%	0.695	70%	0.699	S	S	*	*			trans	36.6	119.3	147.2	-43	-28.7	0	0	0	117.9
600	Q	27.6	Very low	30.5	Very low	127 Å²	127	134.9 Å²	134.9	59%	0.593	69%	0.691	S	S	*	*				51.5	143.8	65.6	-58.4	-164.5	4.2	0	0	114.3
601	M	31.1	Very low	30.6	Very low	157 Å²	157	136.6 Å²	136.6	77%	0.773	70%	0.699	S	S	*	*			trans	70.6	120.4	-176.6	-45	-164.4	-176.3	0	0	112
602	N	29.1	Very low	30.8	Very low	145 Å²	145	133.2 Å²	133.2	78%	0.775	70%	0.695	S	S	*	*			cis	63.8	157.8	32	-148.5	4.5	0	0	0	112.1
603	I	32.1	Very low	30.8	Very low	131 Å²	131	132.3 Å²	132.3	67%	0.672	70%	0.696	S	S	*	*			trans	77.2	100	-158.2	-50.5	159.2	0	0	0	109
604	T	26.8	Very low	30.9	Very low	103 Å²	103	128.6 Å²	128.6	63%	0.632	69%	0.694	S	S	*	*			cis	77.2	139.6	44	-44.2	0	0	0	0	112.9
605	N	29	Very low	31	Very low	137 Å²	137	130.1 Å²	130.1	73%	0.733	70%	0.699	S	S	*	*			trans	75.4	127.5	-178	-41.6	-76.1	0	0	0	115.6
606	I	30.8	Very low	31.3	Very low	148 Å²	148	133.9 Å²	133.9	76%	0.759	71%	0.708	S	S	*	*				171.7	126.9	107.4	-88	164.2	0	0	0	109.2
607	M	35.8	Very low	31.5	Very low	154 Å²	154	132 Å²	132	76%	0.759	69%	0.693	S	S	*	*			trans	62	107.6	174.1	-45.9	-106.7	-169.9	0	0	115.4	L609	M607-L609 HydrophobicContact SD-CD1 3.86Å
608	N	27.7	Very low	31.2	Very low	161 Å²	161	131 Å²	131	86%	0.861	69%	0.694	S	S	*	*			cis	67.9	78.7	8	-152	19.6	0	0	0	115.9
609	L	31.4	Very low	31.5	Very low	134 Å²	134	131.7 Å²	131.7	70%	0.702	69%	0.694	S	S	*	*			trans	-167.5	143.3	169.4	-115.4	110.1	0	0	0	108.2	M607	M607-L609 HydrophobicContact SD-CD1 3.86Å
610	I	33.4	Very low	31.7	Very low	112 Å²	112	131 Å²	131	57%	0.574	69%	0.694	S	S	*	*			cis	-167.4	149.8	-14.8	-152.1	173.7	0	0	0	110.8
611	Q	31.8	Very low	31.7	Very low	163 Å²	163	130.7 Å²	130.7	76%	0.762	70%	0.697	S	S	*	*			trans	63.9	151.8	157.2	-77.6	146.1	4.8	0	0	119.4
612	S	32.2	Very low	31.7	Very low	89 Å²	89	129.2 Å²	129.2	62%	0.622	69%	0.692	S	S	*	*			cis	-166.9	148	-7.1	45.9	0	0	0	0	113.7
613	N	31.9	Very low	31.5	Very low	137 Å²	137	126.8 Å²	126.8	73%	0.733	69%	0.686	S	S	*	*			trans	63	118.9	141.5	-60.2	7.8	0	0	0	119.5
614	T	31.3	Very low	31.1	Very low	113 Å²	113	128.7 Å²	128.7	69%	0.693	70%	0.697	S	S	*	*				68.8	151.5	90.7	88.8	0	0	0	0	113.6
615	D	32.6	Very low	31.1	Very low	128 Å²	128	128.6 Å²	128.6	68%	0.684	70%	0.7	S	S	*	*			cis	-138.2	-177	10	-100.3	-68.6	0	0	0	108.1
616	H	36.4	Very low	30.9	Very low	153 Å²	153	127.6 Å²	127.6	71%	0.708	70%	0.704	S	S	*	*			cis	-167	165.9	10.9	-130.2	30.2	0	0	0	105.2
617	N	33.3	Very low	30.8	Very low	108 Å²	108	123.5 Å²	123.5	58%	0.578	70%	0.699	S	S	*	*			cis	-168.3	169.3	-20.7	-144.8	-4.7	0	0	0	108.4
618	N	32.4	Very low	30.3	Very low	117 Å²	117	122.3 Å²	122.3	63%	0.626	70%	0.699	S	S	*	*			trans	61.6	146.2	157.3	-71.7	41.3	0	0	0	119.4
619	D	35.9	Very low	30.3	Very low	119 Å²	119	123.3 Å²	123.3	64%	0.636	70%	0.699	S	S	*	*			cis	-145.7	140	-0.1	-99.2	-35.1	0	0	0	107.7
620	V	32.6	Very low	30.3	Very low	116 Å²	116	120.5 Å²	120.5	70%	0.703	70%	0.695	S	S	*	*				61.5	121.2	79.9	172.8	0	0	0	0	111.3
621	N	27.8	Very low	30	Very low	120 Å²	120	122.8 Å²	122.8	64%	0.642	71%	0.708	S	S	*	*			cis	-164.3	-174.1	3.7	-127	29.2	0	0	0	112.1
622	D	30.8	Very low	30.1	Very low	126 Å²	126	119.9 Å²	119.9	67%	0.674	71%	0.713	S	S	*	*			trans	46.2	118.1	144.9	-59.3	-34.3	0	0	0	120.6
623	S	25.9	Very low	29.8	Very low	94 Å²	94	125 Å²	125	66%	0.657	73%	0.726	S	S	*	*				93.4	141.4	53.8	89.3	0	0	0	0	115.9
624	L	24	Very low	30	Very low	170 Å²	170	123.2 Å²	123.2	89%	0.89	73%	0.731	S	S	*	*			trans	36	95.9	147.6	-63.7	166.3	0	0	0	120.5
625	S	25.5	Very low	29.8	Very low	102 Å²	102	124.1 Å²	124.1	71%	0.713	74%	0.736	S	S	*	*			trans	-164	130	132.1	-163.4	0	0	0	0	109
626	S	24.7	Very low	29.9	Very low	115 Å²	115	127.2 Å²	127.2	80%	0.804	75%	0.747	S	S	*	*				52.7	117	66.1	48	0	0	0	0	116.1
627	G	29	Very low	29.4	Very low	63 Å²	63	126.7 Å²	126.7	65%	0.649	75%	0.745	S	S	*	*			trans	155.7	110.6	-178.3	0	0	0	0	0	108.6
628	V	26.2	Very low	29.3	Very low	128 Å²	128	127.9 Å²	127.9	78%	0.776	76%	0.758	S	S	*	*			cis	58.4	102.1	44.4	-167	0	0	0	0	107
629	E	27.2	Very low	29.1	Very low	183 Å²	183	128.7 Å²	128.7	86%	0.855	76%	0.762	S	S	*	*			cis	-164.7	177	34.8	-108.4	157	-165.7	0	0	108.4
630	A	31.9	Very low	28.6	Very low	74 Å²	74	131.4 Å²	131.4	61%	0.612	77%	0.77	S	S	*	*			cis	-161.8	162.5	-7.6	0	0	0	0	0	110.5
631	N	27.7	Very low	28.3	Very low	160 Å²	160	131 Å²	131	86%	0.856	77%	0.768	S	S	*	*			trans	36.3	110.8	145.6	-53.8	-17	0	0	0	121.6
632	A	32.8	Very low	28.1	Very low	103 Å²	103	132.5 Å²	132.5	85%	0.851	78%	0.776	S	S	*	*			trans	-164	85.1	135.3	0	0	0	0	0	112.8
633	E	27.1	Very low	27.9	Very low	196 Å²	196	132.4 Å²	132.4	92%	0.916	77%	0.774	S	S	*	*			trans	-12.8	116.3	151	-177.3	171.1	-137.7	0	0	118.7
634	A	34.6	Very low	27.8	Very low	99 Å²	99	134.4 Å²	134.4	82%	0.818	78%	0.778	S	S	*	*			trans	-156.3	124.1	151.9	0	0	0	0	0	110.4
635	T	27.7	Very low	28.1	Very low	132 Å²	132	133.7 Å²	133.7	81%	0.81	77%	0.774	S	S	*	*			trans	-105.7	132.7	-178.8	-60.4	0	0	0	0	110.8
636	E	33.9	Very low	28.1	Very low	194 Å²	194	134.2 Å²	134.2	91%	0.907	77%	0.769	S	S	*	*			trans	-150.6	145	155.9	-130.9	172.8	-139.4	0	0	112.8
637	Q	26	Very low	28.2	Very low	142 Å²	142	135.7 Å²	135.7	66%	0.664	77%	0.767	S	S	*	*			trans	-130.3	154.2	176.5	-65.5	-169.9	3.3	0	0	110.3
638	P	32.5	Very low	28.2	Very low	133 Å²	133	140.6 Å²	140.6	86%	0.864	78%	0.777	S	S	*	*			trans	-88.9	106.8	147.4	31.9	-26.1	0	0	0	110.1
639	L	27.2	Very low	28.3	Very low	133 Å²	133	142.2 Å²	142.2	70%	0.696	78%	0.781	S	S	*	*			trans	-63.4	156.6	-175.3	-76.2	158.7	0	0	0	115.2
640	Q	25.6	Very low	28.4	Very low	176 Å²	176	137.1 Å²	137.1	82%	0.822	78%	0.778	S	S	*	*			trans	-59.5	137.2	150.9	-70.5	176	-92.9	0	0	109.9
641	V	25.5	Very low	28.2	Very low	108 Å²	108	137.6 Å²	137.6	66%	0.655	79%	0.791	S	S	*	*			trans	-132.7	88.9	169.4	179.3	0	0	0	0	109.4	I643	V641-I643 HydrophobicContact CG1-CD1 3.47Å; V641-I643 VanDerWaalsContact CG1-CD1 3.47Å; V641-I643 HydrophobicContact CG1-CG1 3.59Å; V641-I643 PolarHBondContact O-N 2.93Å
642	D	24.2	Very low	28.2	Very low	152 Å²	152	133.9 Å²	133.9	81%	0.813	79%	0.79	S	S	*	*			trans	-71.6	112.1	158.9	-82.6	-54.7	0	0	0	108.7
643	I	26.2	Very low	28	Very low	123 Å²	123	136.1 Å²	136.1	63%	0.631	79%	0.792	S	S	*	*			trans	-116	100.9	166.2	-73.4	168.8	0	0	0	108.7	V641 L645	V641-I643 HydrophobicContact CG1-CD1 3.47Å; V641-I643 VanDerWaalsContact CG1-CD1 3.47Å; V641-I643 HydrophobicContact CG1-CG1 3.59Å; V641-I643 PolarHBondContact O-N 2.93Å; I643-L645 HydrophobicContact CG2-CB 4.29Å; I643-L645 HydrophobicContact CG2-CD1 3.57Å; I643-L645 HydrophobicContact CG2-CG 3.59Å; I643-L645 PolarHBondContact O-N 2.86Å
644	N	24.6	Very low	28	Very low	136 Å²	136	131.6 Å²	131.6	73%	0.727	78%	0.783	S	S	*	*			trans	-87.1	91.2	170.6	-174.7	-2.2	0	0	0	109.2	N646	N644-N646 PolarHBondContact OD1-ND2 2.85Å; N644-N646 VanDerWaalsContact OD1-ND2 3.09Å
645	L	29	Very low	27.7	Very low	156 Å²	156	130.7 Å²	130.7	82%	0.817	78%	0.783	S	S	*	*			trans	-98	85.4	176.3	-87.9	168.3	0	0	0	111.5	I643	I643-L645 HydrophobicContact CG2-CB 4.29Å; I643-L645 HydrophobicContact CG2-CD1 3.57Å; I643-L645 HydrophobicContact CG2-CG 3.59Å; I643-L645 PolarHBondContact O-N 2.86Å
646	N	25.9	Very low	27.6	Very low	112 Å²	112	133 Å²	133	60%	0.599	78%	0.782	S	S	*	*			trans	-76.2	151.3	155.6	-74.4	-70.3	0	0	0	110.2	N644	N644-N646 PolarHBondContact OD1-ND2 2.85Å; N644-N646 VanDerWaalsContact OD1-ND2 3.09Å
647	N	27.3	Very low	27.2	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	78%	0.782	S	S	*	*			trans	61.2	103.5	162.8	-56.1	-18.3	0	0	0	118.1
648	I	29.8	Very low	27.2	Very low	166 Å²	166	129.3 Å²	129.3	85%	0.851	79%	0.787	S	S	*	*				-178.4	153	103.2	-90.4	156.9	0	0	0	110.1
649	D	27.7	Very low	26.9	Very low	162 Å²	162	126.2 Å²	126.2	87%	0.866	78%	0.779	S	S	*	*			trans	-71.5	161.5	-170	-52.4	-90.4	0	0	0	116
650	G	28.4	Very low	26.7	Very low	76 Å²	76	125 Å²	125	78%	0.784	78%	0.781	S	S	*	*			trans	156.3	101.2	153.9	0	0	0	0	0	118
651	G	28.2	Very low	26.8	Very low	85 Å²	85	122.7 Å²	122.7	88%	0.876	78%	0.779	S	S	*	*			trans	47.9	106.1	147.1	0	0	0	0	0	120.4
652	G	27.3	Very low	26.8	Very low	81 Å²	81	123.3 Å²	123.3	84%	0.835	78%	0.779	S	S	*	*			trans	-93	168.2	170.6	0	0	0	0	0	114.9
653	V	30.1	Very low	27	Very low	150 Å²	150	121.8 Å²	121.8	91%	0.909	78%	0.775	S	S	*	*			trans	-136	136.8	165.3	-173.4	0	0	0	0	109
654	S	25.8	Very low	27	Very low	102 Å²	102	123.3 Å²	123.3	71%	0.713	78%	0.784	S	S	*	*			trans	-91.6	135.7	177.9	54.5	0	0	0	0	112.4
655	G	28.8	Very low	27.1	Very low	79 Å²	79	121.4 Å²	121.4	81%	0.814	78%	0.781	S	S	*	*			trans	-131.9	119.6	170.4	0	0	0	0	0	111.1
656	F	26.1	Very low	27.2	Very low	181 Å²	181	118.8 Å²	118.8	79%	0.794	78%	0.775	S	S	*	*			trans	-87.7	138.5	-179.2	-77	-104.7	0	0	0	111.6	T658	F656-T658 HydrophobicContact CD1-CG2 4.46Å
657	C	26	Very low	27.3	Very low	135 Å²	135	117.4 Å²	117.4	91%	0.912	78%	0.775	S	S	*	*			trans	-133.9	88.6	163.4	-74.8	0	0	0	0	110.2	G659	C657-G659 PolarHBondContact O-N 3.29Å
658	T	25.3	Very low	27.5	Very low	124 Å²	124	114.9 Å²	114.9	76%	0.761	77%	0.766	S	S	*	*			trans	-89.7	87.1	179.9	48.8	0	0	0	0	111.5	F656 S660	F656-T658 HydrophobicContact CD1-CG2 4.46Å; T658-S660 PolarHBondContact O-N 3.27Å
659	G	25.1	Very low	27.8	Very low	68 Å²	68	109.1 Å²	109.1	70%	0.701	74%	0.737	S	S	*	*			trans	-75.7	96.8	173.8	0	0	0	0	0	112.6	C657 V661	C657-G659 PolarHBondContact O-N 3.29Å; G659-V661 PolarHBondContact O-N 3.49Å; G659-V661 VanDerWaalsContact O-N 3.11Å
660	S	24.3	Very low	28.2	Very low	106 Å²	106	109 Å²	109	74%	0.741	73%	0.728	S	S	*	*			trans	-78.7	87.2	176.9	178.4	0	0	0	0	111.8	T658 N662	T658-S660 PolarHBondContact O-N 3.27Å; S660-N662 PolarHBondContact O-N 3.09Å
661	V	27	Very low	28.7	Very low	128 Å²	128	107.6 Å²	107.6	78%	0.776	71%	0.707	S	S	*	*			trans	-78	107.4	177.5	-153.6	0	0	0	0	110.5	G659 T663	G659-V661 PolarHBondContact O-N 3.49Å; G659-V661 VanDerWaalsContact O-N 3.11Å; V661-T663 PolarHBondContact O-N 3.39Å
662	N	26.1	Very low	29.3	Very low	122 Å²	122	107 Å²	107	65%	0.652	69%	0.686	S	S	*	*			trans	-72.5	105.1	176	-79.7	-29.6	0	0	0	110.8	S660 L664	S660-N662 PolarHBondContact O-N 3.09Å; N662-L664 PolarHBondContact O-N 2.84Å
663	T	27.8	Very low	29.9	Very low	119 Å²	119	108 Å²	108	73%	0.73	67%	0.673	S	S	*	*			trans	-78.7	58	175.5	44.1	0	0	0	0	112.7	V661	V661-T663 PolarHBondContact O-N 3.39Å
664	L	26.6	Very low	30.4	Very low	156 Å²	156	106.3 Å²	106.3	82%	0.817	66%	0.655	S	S	*	*			trans	-127.5	44.7	171.3	-74.7	178.4	0	0	0	112	N662	N662-L664 PolarHBondContact O-N 2.84Å
665	S	26.6	Very low	30.9	Very low	96 Å²	96	108.4 Å²	108.4	67%	0.671	66%	0.658	S	S	*	*			trans	-131.6	95.7	155.4	50.3	0	0	0	0	109.4	S667	S665-S667 PolarHBondContact O-N 3.25Å; S665-S667 VanDerWaalsContact O-N 3.11Å
666	S	31.4	Very low	31.6	Very low	100 Å²	100	111.7 Å²	111.7	70%	0.699	66%	0.657	S	S	*	*			trans	-70.4	92.2	149.2	43.9	0	0	0	0	106.4	P668	S666-P668 WeakPolarHBondContact O-CD 3.41Å; S666-P668 VanDerWaalsContact O-N 3.16Å
667	S	27	Very low	32.3	Very low	84 Å²	84	109.7 Å²	109.7	59%	0.587	65%	0.654	S	S	*	*			trans	-50.6	122.3	161.1	-59.4	0	0	0	0	106.8	S665 L669	S665-S667 PolarHBondContact O-N 3.25Å; S665-S667 VanDerWaalsContact O-N 3.11Å; S667-L669 PolarHBondContact O-N 2.97Å
668	P	32.7	Very low	32.9	Very low	92 Å²	92	110.9 Å²	110.9	60%	0.597	65%	0.652	S	S	*	*			trans	-54.4	137.3	175.1	-24.7	34.3	0	0	0	108.5	S666 K670	S666-P668 WeakPolarHBondContact O-CD 3.41Å; S666-P668 VanDerWaalsContact O-N 3.16Å; P668-K670 PolarHBondContact O-N 3.24Å
669	L	35.2	Very low	33.4	Very low	45 Å²	45	110.8 Å²	110.8	24%	0.236	65%	0.651	C	S	.	*			trans	-64.3	102.1	156.3	-62	173.4	0	0	0	103.8	I187 Y283 G296 S667 S671	I187-L669 HydrophobicContact CD1-CB 3.75Å; I187-L669 HydrophobicContact CD1-CD1 4.41Å; I187-L669 HydrophobicContact CD1-CG 4.48Å; Y283-L669 HydrophobicContact CE2-CD2 4.36Å; G296-L669 WeakPolarHBondContact O-CD2 3.38Å; S667-L669 PolarHBondContact O-N 2.97Å; L669-S671 PolarHBondContact O-N 2.91Å
670	K	36.9	Very low	34	Very low	159 Å²	159	115.2 Å²	115.2	69%	0.691	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-47.9	133.7	179.1	-105.7	-163.9	166.5	-149.7	0	108	P668 V672	P668-K670 PolarHBondContact O-N 3.24Å; K670-V672 PolarHBondContact O-N 3.36Å
671	S	38	Very low	34.4	Very low	48 Å²	48	118.3 Å²	118.3	34%	0.336	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-46.4	125.8	153.3	45.4	0	0	0	0	106.4	L669 D673	L669-S671 PolarHBondContact O-N 2.91Å; S671-D673 PolarHBondContact O-N 3.49Å
672	V	41.8	Very low	34.8	Very low	72 Å²	72	119.3 Å²	119.3	44%	0.436	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-73.1	119.9	168.3	-166.6	0	0	0	0	104.3	K670 E674	K670-V672 PolarHBondContact O-N 3.36Å; V672-E674 HydrophobicContact CB-CG 3.78Å; V672-E674 HydrophobicContact CG1-CG 3.34Å; V672-E674 PolarHBondContact O-N 3.26Å
673	D	38.8	Very low	35.2	Very low	103 Å²	103	121.4 Å²	121.4	55%	0.551	67%	0.673	S	S	*	*			trans	-70.3	82.3	160.2	-50.5	-58.7	0	0	0	104.3	S671	S671-D673 PolarHBondContact O-N 3.49Å
674	E	40.7	Very low	35.4	Very low	113 Å²	113	123.9 Å²	123.9	53%	0.528	68%	0.676	S	S	.	*			trans	-85	118.8	164.1	-62.6	-171.3	161.7	0	0	104.7	R298 V672 D676	R298-E674 IonicContact NH2-OE1 2.68Å; R298-E674 PolarHBondContact NH2-OE1 2.95Å; V672-E674 HydrophobicContact CB-CG 3.78Å; V672-E674 HydrophobicContact CG1-CG 3.34Å; V672-E674 PolarHBondContact O-N 3.26Å; E674-D676 VanDerWaalsContact C-N 3.28Å; E674-D676 PolarHBondContact O-N 3.27Å
675	D	36.9	Very low	35.7	Very low	147 Å²	147	124.7 Å²	124.7	79%	0.786	67%	0.674	S	S	*	*			trans	-74.4	81.1	-174.1	-61.2	-65.1	0	0	0	109.8	D677	D675-D677 PolarHBondContact O-N 3.39Å
676	D	42.5	Very low	36.1	Very low	148 Å²	148	125.1 Å²	125.1	79%	0.791	67%	0.672	S	S	*	*			trans	-67.5	75.3	165.5	-72.3	-33.9	0	0	0	109	E674 D678	E674-D676 VanDerWaalsContact C-N 3.28Å; E674-D676 PolarHBondContact O-N 3.27Å; D676-D678 PolarHBondContact O-N 3.17Å
677	D	41.2	Very low	36.1	Very low	139 Å²	139	126.5 Å²	126.5	74%	0.743	67%	0.672	S	S	*	*			trans	-71.2	113.9	166.3	-86.9	-36.8	0	0	0	109	D675 V679	D675-D677 PolarHBondContact O-N 3.39Å; D677-V679 PolarHBondContact O-N 3.3Å
678	D	39.5	Very low	36.3	Very low	159 Å²	159	129.1 Å²	129.1	85%	0.85	68%	0.679	S	S	*	*			trans	-66.2	94.7	175.7	-70.2	-59.2	0	0	0	110.3	D676 D680	D676-D678 PolarHBondContact O-N 3.17Å; D678-D680 PolarHBondContact O-N 2.62Å; D678-D680 VanDerWaalsContact O-N 3.13Å
679	V	36.5	Very low	36.3	Very low	123 Å²	123	129 Å²	129	75%	0.745	69%	0.685	S	S	*	*			trans	-77.9	94.9	176.8	-177.8	0	0	0	0	110.4	D677 E681	D677-V679 PolarHBondContact O-N 3.3Å; V679-E681 PolarHBondContact O-N 3.4Å
680	D	37.4	Very low	35.9	Very low	160 Å²	160	133.8 Å²	133.8	86%	0.856	71%	0.711	S	S	*	*			trans	-66.2	90.6	165.4	-92.6	-35.9	0	0	0	110.4	D678 N682	D678-D680 PolarHBondContact O-N 2.62Å; D678-D680 VanDerWaalsContact O-N 3.13Å; D680-N682 PolarHBondContact O-N 2.93Å
681	E	31.9	Very low	35.7	Very low	172 Å²	172	133.5 Å²	133.5	80%	0.804	71%	0.709	S	S	*	*			trans	-65.7	94	162.3	-75.1	-168.3	142.7	0	0	109.6	V679	V679-E681 PolarHBondContact O-N 3.4Å
682	N	35.1	Very low	35.3	Very low	148 Å²	148	139.2 Å²	139.2	79%	0.791	73%	0.731	S	S	*	*			trans	-176.7	95.5	152	-98.1	-61.6	0	0	0	111.6	D680	D680-N682 PolarHBondContact O-N 2.93Å
683	N	35.3	Very low	34.8	Very low	167 Å²	167	141.9 Å²	141.9	89%	0.893	75%	0.748	S	S	*	*			trans	169.1	116.6	130.6	-89.9	-59.3	0	0	0	111
684	E	31.3	Very low	34.2	Very low	170 Å²	170	144 Å²	144	79%	0.794	76%	0.759	S	S	*	*			trans	-82.7	138.6	177.5	-176.1	-169.8	-166.7	0	0	111.1
685	F	32.3	Very low	33.8	Very low	173 Å²	173	146 Å²	146	76%	0.759	77%	0.773	S	S	*	*			trans	176.6	128.1	130.7	-111.7	-127.8	0	0	0	115.8
686	V	35	Very low	33.3	Very low	105 Å²	105	143 Å²	143	64%	0.636	76%	0.764	S	S	*	*			trans	72.3	88.9	137.9	176.4	0	0	0	0	120.8
687	N	32.1	Very low	32.6	Very low	129 Å²	129	143.4 Å²	143.4	69%	0.69	77%	0.766	S	S	*	*				70	140	106.1	-72.5	35.3	0	0	0	126.7
688	D	30.7	Very low	32	Very low	140 Å²	140	142.7 Å²	142.7	75%	0.749	77%	0.767	S	S	*	*			trans	73	100.8	134.9	-64.4	-33.6	0	0	0	124.4
689	A	33.2	Very low	31.3	Very low	88 Å²	88	145.4 Å²	145.4	73%	0.727	77%	0.767	S	S	*	*				-171.5	120.9	119.8	0	0	0	0	0	109.8
690	L	27.8	Very low	30.8	Very low	147 Å²	147	146.6 Å²	146.6	77%	0.77	76%	0.764	S	S	*	*				55.2	124.4	78.7	-62.9	174.5	0	0	0	112.7
691	K	32.2	Very low	30.2	Very low	152 Å²	152	148.1 Å²	148.1	66%	0.661	76%	0.763	S	S	*	*			cis	-171.1	155.7	25.6	-110.9	160.2	-177.4	174.4	0	112.3
692	Q	29.3	Very low	30	Very low	168 Å²	168	147.9 Å²	147.9	79%	0.785	77%	0.766	S	S	*	*			trans	64.9	158.3	142.4	-68.7	163.4	-17.8	0	0	118.9
693	T	30.8	Very low	29.5	Very low	129 Å²	129	150.4 Å²	150.4	79%	0.791	77%	0.769	S	S	*	*			cis	-138	164.8	1.8	35.5	0	0	0	0	112.2
694	N	26.2	Very low	29.2	Very low	148 Å²	148	149.3 Å²	149.3	79%	0.791	77%	0.769	S	S	*	*			trans	-77.5	168.3	172.2	-60	-23.9	0	0	0	114.4
695	N	32	Very low	29.1	Very low	154 Å²	154	144.3 Å²	144.3	82%	0.824	76%	0.763	S	S	*	*			trans	139.1	145.9	146	-75.1	-1.4	0	0	0	111.2
696	S	27.8	Very low	28.9	Very low	85 Å²	85	142.4 Å²	142.4	59%	0.594	76%	0.761	S	S	*	*			cis	166.4	123.6	-25.2	49.2	0	0	0	0	106.1
697	D	28.1	Very low	28.7	Very low	155 Å²	155	150.1 Å²	150.1	83%	0.829	78%	0.778	S	S	*	*			trans	62.3	159.2	157.3	-56.9	-41.3	0	0	0	123.5
698	T	28.6	Very low	28.5	Very low	124 Å²	124	150.7 Å²	150.7	76%	0.761	78%	0.781	S	S	*	*			trans	100	87.3	154.7	-42.5	0	0	0	0	119.3
699	Y	23.8	Very low	28.4	Very low	217 Å²	217	147.5 Å²	147.5	85%	0.851	78%	0.781	S	S	*	*				52.3	158	129.2	-86.7	-93.2	0	0	0	124
700	Q	26.5	Very low	28.1	Very low	148 Å²	148	147.4 Å²	147.4	69%	0.692	78%	0.78	S	S	*	*			trans	78.2	103.3	167.1	-64	-67.1	4.3	0	0	120.1
701	K	23.4	Very low	28.1	Very low	192 Å²	192	148.6 Å²	148.6	84%	0.835	79%	0.787	S	S	*	*			trans	5.5	108.9	140.2	-64.5	169.7	176.5	169.7	0	117.8
702	I	27.6	Very low	27.9	Very low	167 Å²	167	145 Å²	145	86%	0.856	79%	0.794	S	S	*	*			trans	-123.7	148.6	144.9	-65.5	-175.9	0	0	0	108.6
703	K	24.9	Very low	27.8	Very low	200 Å²	200	144.6 Å²	144.6	87%	0.87	80%	0.795	S	S	*	*			trans	-137.6	98	-159.7	177.8	-167.6	173.7	-173.4	0	112
704	V	30.2	Very low	27.6	Very low	145 Å²	145	147.7 Å²	147.7	88%	0.879	80%	0.798	S	S	*	*			trans	-147.8	134.2	168.6	-169.9	0	0	0	0	107.4
705	G	28.4	Very low	27.6	Very low	65 Å²	65	145.2 Å²	145.2	67%	0.67	79%	0.792	S	S	*	*			cis	-164.3	162.5	-7.1	0	0	0	0	0	110.1
706	N	28.6	Very low	27.4	Very low	133 Å²	133	143.2 Å²	143.2	71%	0.711	78%	0.78	S	S	*	*			trans	-65.5	161.6	-175.3	-55	-37.2	0	0	0	112.1	L708	N706-L708 HydrophobicContact CB-CD1 3.85Å
707	W	31.1	Very low	27.4	Very low	266 Å²	266	149 Å²	149	100%	1.008	79%	0.789	S	S	*	*				-119.2	151.9	71.7	-94.8	54.7	0	0	0	115.5
708	L	27.5	Very low	27.5	Very low	141 Å²	141	148 Å²	148	74%	0.738	78%	0.783	S	S	*	*			trans	-83.6	166.5	-175.6	-69.9	101	0	0	0	112.2	N706	N706-L708 HydrophobicContact CB-CD1 3.85Å
709	G	27.5	Very low	27.5	Very low	74 Å²	74	147.1 Å²	147.1	76%	0.763	78%	0.778	S	S	*	*			cis	119.2	157.2	12.1	0	0	0	0	0	110.9
710	A	27.3	Very low	27.7	Very low	86 Å²	86	144.6 Å²	144.6	71%	0.711	77%	0.774	S	S	*	*			trans	-123	160.8	-160.9	0	0	0	0	0	115.5
711	N	28.5	Very low	27.9	Very low	171 Å²	171	144.4 Å²	144.4	91%	0.914	78%	0.778	S	S	*	*			trans	68.7	159.4	166.6	-52.5	-32.7	0	0	0	117
712	G	27.5	Very low	28.3	Very low	77 Å²	77	143.9 Å²	143.9	79%	0.794	78%	0.778	S	S	*	*			trans	146.1	119.3	169.5	0	0	0	0	0	114.6
713	I	27.8	Very low	28.9	Very low	160 Å²	160	140.5 Å²	140.5	82%	0.821	77%	0.767	S	S	*	*			trans	-99	131.6	178.3	-74.2	171.8	0	0	0	110.3
714	K	26.6	Very low	29.1	Very low	193 Å²	193	136.2 Å²	136.2	84%	0.839	76%	0.763	S	S	*	*			trans	34.9	126.4	153.6	-68.8	179.7	177.6	177.5	0	120.5
715	S	26.5	Very low	29.5	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	76%	0.756	S	S	*	*				97.6	115.9	116.1	-179.8	0	0	0	0	122.2
716	I	27.4	Very low	29.5	Very low	111 Å²	111	138.4 Å²	138.4	57%	0.569	76%	0.759	S	S	*	*			trans	97.4	126.2	137.9	-80.9	171.2	0	0	0	121
717	R	27.5	Very low	29.5	Very low	207 Å²	207	138.1 Å²	138.1	78%	0.781	76%	0.762	S	S	*	*			trans	87.4	135.2	154.7	-97.9	174.3	-71.8	-162.8	0.5	122.1
718	N	29.3	Very low	29.3	Very low	133 Å²	133	129.9 Å²	129.9	71%	0.711	75%	0.745	S	S	*	*			trans	-60.4	176.3	174.3	-37.9	4.8	0	0	0	111.7
719	T	29.4	Very low	29.5	Very low	106 Å²	106	130.2 Å²	130.2	65%	0.65	75%	0.746	S	S	*	*			cis	-149.7	135.3	29.2	32.3	0	0	0	0	109.9
720	E	29.2	Very low	29.6	Very low	164 Å²	164	132.3 Å²	132.3	77%	0.766	74%	0.74	S	S	*	*				83.4	155	96	-62.1	174.8	146.6	0	0	116
721	D	29.8	Very low	29.7	Very low	145 Å²	145	135.3 Å²	135.3	78%	0.775	74%	0.739	S	S	*	*			trans	71.3	90.9	163.2	-59.2	-10.8	0	0	0	123.6
722	E	30.7	Very low	29.9	Very low	180 Å²	180	135.5 Å²	135.5	84%	0.841	73%	0.732	S	S	*	*				69.2	159.6	117.3	-74.7	-72.1	98.4	0	0	123.3
723	P	40.4	Very low	30	Very low	96 Å²	96	136.8 Å²	136.8	62%	0.623	72%	0.724	S	S	*	*			trans	-123.7	-179.1	-162	45.8	-35.1	0	0	0	115.8
724	S	29.2	Very low	30.3	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	72%	0.718	S	S	*	*				-173.5	150.3	129.2	28.5	0	0	0	0	113.5
725	P	40.1	Very low	30.5	Very low	113 Å²	113	131.2 Å²	131.2	73%	0.734	71%	0.705	S	S	*	*			trans	-95.5	-174.1	164.4	39.1	-32.7	0	0	0	111.1
726	I	27	Very low	30.8	Very low	144 Å²	144	135.9 Å²	135.9	74%	0.738	71%	0.709	S	S	*	*			trans	162.4	138.2	139	-87.2	156.7	0	0	0	114.3
727	T	28.1	Very low	30.8	Very low	126 Å²	126	136.8 Å²	136.8	77%	0.773	72%	0.715	S	S	*	*			trans	61.7	162.5	160.9	51.7	0	0	0	0	122.3
728	S	27.5	Very low	30.7	Very low	93 Å²	93	132.2 Å²	132.2	65%	0.65	71%	0.707	S	S	*	*			cis	-177.9	-156.8	-35.1	65.9	0	0	0	0	109.6
729	I	32.2	Very low	30.6	Very low	148 Å²	148	131.8 Å²	131.8	76%	0.759	70%	0.704	S	S	*	*			trans	78	134.9	168.7	-48.1	-177.2	0	0	0	115.6
730	N	29.3	Very low	30.5	Very low	119 Å²	119	132.5 Å²	132.5	64%	0.636	70%	0.704	S	S	*	*			cis	-165.6	151	-36.9	-109.8	-29.7	0	0	0	110.7
731	Q	30.4	Very low	30.3	Very low	148 Å²	148	131 Å²	131	69%	0.692	70%	0.702	S	S	*	*			trans	27.1	129.5	140.2	-51.4	165.9	19.4	0	0	121.1
732	K	32.9	Very low	30.1	Very low	175 Å²	175	128.3 Å²	128.3	76%	0.761	69%	0.694	S	S	*	*				176.4	115.5	98.9	-93.5	-168.2	178.6	-174.5	0	111
733	T	27.7	Very low	29.9	Very low	105 Å²	105	128 Å²	128	64%	0.644	69%	0.693	S	S	*	*				83	160.7	81.1	60.6	0	0	0	0	114.8
734	D	35.5	Very low	29.3	Very low	129 Å²	129	128.7 Å²	128.7	69%	0.69	70%	0.695	S	S	*	*			trans	84.6	132.5	162.7	-55.4	-68	0	0	0	118.1
735	N	31.3	Very low	29.1	Very low	107 Å²	107	129.8 Å²	129.8	57%	0.572	69%	0.692	S	S	*	*			cis	-164.1	176.7	-21	-137.3	-40.4	0	0	0	113.5
736	Y	31.2	Very low	28.4	Very low	194 Å²	194	130.3 Å²	130.3	76%	0.761	69%	0.688	S	S	*	*			trans	32.7	116.8	162.6	-61.2	-64.9	0	0	0	120.3
737	N	27.2	Very low	28.4	Very low	130 Å²	130	129.6 Å²	129.6	70%	0.695	69%	0.686	S	S	*	*				83.4	150.2	50.3	-167.4	39.2	0	0	0	115.5
738	N	27	Very low	28.5	Very low	112 Å²	112	129.5 Å²	129.5	60%	0.599	69%	0.685	S	S	*	*			trans	75.6	109.9	161.9	-83.7	-2.7	0	0	0	121.2
739	N	26.5	Very low	28.5	Very low	123 Å²	123	129 Å²	129	66%	0.658	68%	0.682	S	S	*	*				89.5	144.2	113.2	-71.3	-7	0	0	0	123.6
740	N	27.4	Very low	28.4	Very low	122 Å²	122	128.1 Å²	128.1	65%	0.652	68%	0.678	S	S	*	*			trans	77.6	104	142.1	-69.3	-1.8	0	0	0	121
741	N	25.6	Very low	28.5	Very low	133 Å²	133	127.3 Å²	127.3	71%	0.711	67%	0.674	S	S	*	*				80.2	149.5	115.1	-60.9	-11.5	0	0	0	121.4
742	S	24.9	Very low	28.4	Very low	88 Å²	88	129 Å²	129	62%	0.615	67%	0.674	S	S	*	*			trans	60.8	125.2	139.6	56.6	0	0	0	0	119.8
743	E	26.9	Very low	28.3	Very low	174 Å²	174	127.1 Å²	127.1	81%	0.813	67%	0.671	S	S	*	*			trans	72.3	159	142.5	-69.6	161.1	-136	0	0	116.4
744	T	28.3	Very low	28.3	Very low	109 Å²	109	127.7 Å²	127.7	67%	0.669	67%	0.671	S	S	*	*			cis	-135.6	150.3	-0.2	-14	0	0	0	0	111.9
745	L	24.5	Very low	27.9	Very low	134 Å²	134	125.8 Å²	125.8	70%	0.702	66%	0.664	S	S	*	*			trans	11.6	146.3	139	-71.4	167.2	0	0	0	120.8
746	N	26.1	Very low	27.7	Very low	124 Å²	124	129.3 Å²	129.3	66%	0.663	67%	0.674	S	S	*	*			trans	74.8	154.8	141.3	-69.6	-4.3	0	0	0	116.8
747	N	27.2	Very low	27.5	Very low	129 Å²	129	127.7 Å²	127.7	69%	0.69	67%	0.673	S	S	*	*			cis	-158.1	166.6	2.4	-130.7	-11.1	0	0	0	111.3
748	V	29.5	Very low	27.3	Very low	124 Å²	124	130.6 Å²	130.6	75%	0.752	68%	0.68	S	S	*	*			trans	58.8	134.9	140.6	162.1	0	0	0	0	119.1
749	S	27.5	Very low	27.4	Very low	83 Å²	83	132.6 Å²	132.6	58%	0.58	69%	0.689	S	S	*	*			cis	-179.1	170.6	-13.6	-148.7	0	0	0	0	108.7
750	N	30.4	Very low	27.2	Very low	128 Å²	128	132 Å²	132	68%	0.684	69%	0.694	S	S	*	*			trans	65.6	153.4	153.5	-62.5	8.9	0	0	0	114.8
751	D	30.8	Very low	27.4	Very low	103 Å²	103	132.9 Å²	132.9	55%	0.551	70%	0.698	S	S	*	*			cis	173.6	162.9	-3.6	-100.8	-3.4	0	0	0	102.5
752	R	28.8	Very low	27.3	Very low	184 Å²	184	133.7 Å²	133.7	69%	0.694	70%	0.702	S	S	*	*			cis	-171.3	152.1	-4.6	-119.2	171.9	164.8	133.3	-14.9	107.3
753	L	29.6	Very low	27.5	Very low	134 Å²	134	135 Å²	135	70%	0.702	71%	0.712	S	S	*	*			trans	64.5	164.1	147.7	-57.5	166.5	0	0	0	115.8
754	N	28.9	Very low	27.5	Very low	118 Å²	118	134.6 Å²	134.6	63%	0.631	71%	0.71	S	S	*	*			cis	-140.8	146	-10.5	-131.1	-9	0	0	0	114.5
755	T	27	Very low	27.4	Very low	89 Å²	89	135.7 Å²	135.7	55%	0.546	71%	0.711	S	S	.	*			trans	-1.8	137.6	148.4	57.1	0	0	0	0	121.9
756	K	26.6	Very low	27.5	Very low	181 Å²	181	136.7 Å²	136.7	79%	0.787	72%	0.716	S	S	*	*				62.5	161	122.9	-56.1	175.4	-178.6	179.7	0	117.6
757	Q	26.9	Very low	27.6	Very low	159 Å²	159	136.7 Å²	136.7	74%	0.743	72%	0.72	S	S	*	*			cis	-151	162.2	16.2	-152.7	152.3	-48.9	0	0	112.8
758	F	23.8	Very low	27.7	Very low	191 Å²	191	138.4 Å²	138.4	84%	0.838	72%	0.721	S	S	*	*			trans	-29.8	148.8	164.8	-64.7	-110.8	0	0	0	116.6
759	I	27.9	Very low	27.7	Very low	155 Å²	155	137.3 Å²	137.3	80%	0.795	71%	0.711	S	S	*	*				-163.3	148.7	112.4	-96.6	151.7	0	0	0	109.3	I761	I759-I761 HydrophobicContact CG2-CD1 4.1Å; I759-I761 HydrophobicContact CG2-CG1 3.89Å
760	S	23.5	Very low	27.7	Very low	109 Å²	109	137.4 Å²	137.4	76%	0.762	71%	0.705	S	S	*	*			trans	-120.8	128.6	172.7	-171	0	0	0	0	108.6
761	I	29.9	Very low	27.5	Very low	141 Å²	141	135.3 Å²	135.3	72%	0.723	70%	0.701	S	S	*	*			trans	-143.2	119.6	172.7	-63.4	-178.6	0	0	0	108.1	I759	I759-I761 HydrophobicContact CG2-CD1 4.1Å; I759-I761 HydrophobicContact CG2-CG1 3.89Å
762	D	24.4	Very low	27.4	Very low	151 Å²	151	137.6 Å²	137.6	81%	0.807	70%	0.702	S	S	*	*			trans	-73.6	139.2	167.1	-48.3	-85.5	0	0	0	110.3
763	S	29.7	Very low	27.2	Very low	116 Å²	116	133.8 Å²	133.8	81%	0.811	70%	0.704	S	S	*	*			trans	-159.5	132.5	159.2	-79.4	0	0	0	0	110.8
764	E	25.5	Very low	27.5	Very low	165 Å²	165	133.2 Å²	133.2	77%	0.771	71%	0.708	S	S	*	*			trans	-86.2	174.8	178.5	-57	178.4	144.6	0	0	112.8
765	N	26.6	Very low	27.3	Very low	132 Å²	132	135.2 Å²	135.2	71%	0.706	72%	0.718	S	S	*	*			trans	80.2	160	150.3	-60.1	-49.9	0	0	0	119.3
766	I	27.7	Very low	27.2	Very low	155 Å²	155	135.4 Å²	135.4	80%	0.795	72%	0.723	S	S	*	*			trans	70.5	81.8	175.8	-43.8	180	0	0	0	113
767	V	27.5	Very low	27.1	Very low	124 Å²	124	132.6 Å²	132.6	75%	0.752	72%	0.72	S	S	*	*				74.3	135.7	64.2	-175.6	0	0	0	0	112.8
768	K	29.6	Very low	27.3	Very low	165 Å²	165	132.1 Å²	132.1	72%	0.717	72%	0.721	S	S	*	*			trans	88.1	147.7	177.5	-50.6	-160.3	172.2	-165	0	118.2
769	D	28.4	Very low	27.5	Very low	100 Å²	100	127.9 Å²	127.9	54%	0.535	72%	0.716	S	S	.	*			cis	-160.6	156.3	-30	-93.2	-30.3	0	0	0	107.9
770	D	28.1	Very low	27.8	Very low	86 Å²	86	126.3 Å²	126.3	46%	0.46	72%	0.716	S	S	.	*			trans	36.3	118.4	157.7	-67.4	-31.2	0	0	0	123.6	E580	E580-D770 PolarHBondContact N-OD2 3.02Å
771	S	25.2	Very low	28.1	Very low	84 Å²	84	129.2 Å²	129.2	59%	0.587	72%	0.719	S	S	*	*			trans	53.9	137.8	132.6	77.9	0	0	0	0	122.3
772	Y	29.4	Very low	28.2	Very low	150 Å²	150	129.1 Å²	129.1	59%	0.588	72%	0.72	S	S	*	*				-161.9	177.7	115	-127	-109.6	0	0	0	112.9	P581 K583	P581-Y772 VanDerWaalsContact O-CE2 3.22Å; P581-Y772 WeakPolarHBondContact O-CE2 3.43Å; K583-Y772 VanDerWaalsContact C-OH 3.29Å; K583-Y772 PolarHBondContact N-OH 2.99Å; K583-Y772 WeakPolarHBondContact O-CE1 3.06Å; K583-Y772 VanDerWaalsContact O-CZ 3.24Å; K583-Y772 PolarHBondContact O-OH 3.14Å
773	S	24.8	Very low	28.7	Very low	104 Å²	104	126.5 Å²	126.5	73%	0.727	71%	0.711	S	S	*	*			trans	-106.1	175.3	-161.7	-56.1	0	0	0	0	113.6
774	P	36.3	Very low	28.8	Very low	122 Å²	122	130.4 Å²	130.4	79%	0.792	71%	0.71	S	S	*	*			trans	-93.7	158.4	-157.8	37.4	-37.3	0	0	0	116.5
775	I	24.3	Very low	29	Very low	161 Å²	161	126.2 Å²	126.2	83%	0.826	70%	0.699	S	S	*	*			trans	-174.9	116.8	161.2	-101.6	150.2	0	0	0	104.5
776	S	24.9	Very low	29.2	Very low	93 Å²	93	126.2 Å²	126.2	65%	0.65	70%	0.699	S	S	*	*			cis	96.8	144.6	48.3	75	0	0	0	0	114.2
777	T	25.3	Very low	29.4	Very low	121 Å²	121	124 Å²	124	74%	0.742	69%	0.689	S	S	*	*			trans	94.3	152.5	158.3	-41	0	0	0	0	118.3
778	I	30.6	Very low	29.6	Very low	149 Å²	149	125.5 Å²	125.5	76%	0.764	69%	0.687	S	S	*	*			trans	77.2	99.1	175.5	-46	178.7	0	0	0	112.7
779	S	26.9	Very low	29.6	Very low	103 Å²	103	125.4 Å²	125.4	72%	0.72	69%	0.689	S	S	*	*			cis	71.9	151.9	36.2	-40	0	0	0	0	114.1
780	P	34.8	Very low	29.6	Very low	122 Å²	122	128.2 Å²	128.2	79%	0.792	70%	0.699	S	S	*	*			cis	-117.1	-160.5	-0.1	32.1	-8.3	0	0	0	110.6
781	M	29.7	Very low	29.7	Very low	170 Å²	170	130.5 Å²	130.5	84%	0.837	72%	0.716	S	S	*	*			cis	-142.8	155.7	16	-63.4	177.2	68.9	0	0	112.6
782	N	33	Very low	29.8	Very low	139 Å²	139	135.4 Å²	135.4	74%	0.743	73%	0.73	S	S	*	*			trans	-121.2	137.5	166.6	-179.7	24.9	0	0	0	108.9
783	P	35.3	Very low	29.7	Very low	95 Å²	95	134.6 Å²	134.6	62%	0.617	74%	0.741	S	S	*	*			trans	-136.3	145.5	143.5	32.5	-17.6	0	0	0	112.2
784	Y	31.1	Very low	29.8	Very low	199 Å²	199	138 Å²	138	78%	0.78	74%	0.742	S	S	*	*			cis	-160.7	140.6	-0.7	-117.4	-45.2	0	0	0	108.3
785	S	28.8	Very low	29.4	Very low	77 Å²	77	142.3 Å²	142.3	54%	0.538	75%	0.749	S	S	.	*				31.8	148.1	128.6	64.9	0	0	0	0	120.9
786	N	30.6	Very low	29.6	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	74%	0.739	S	S	*	*			cis	-174.5	173.8	6.2	-107.2	19.2	0	0	0	105.8
787	D	33.4	Very low	30	Very low	109 Å²	109	144 Å²	144	58%	0.583	75%	0.746	S	S	*	*			cis	-149.7	161.3	3	-110.5	-32.4	0	0	0	110.6
788	H	30.6	Very low	30	Very low	155 Å²	155	142.6 Å²	142.6	72%	0.718	74%	0.736	S	S	*	*			trans	17.1	158.4	142.2	-63	-55.7	0	0	0	122.3
789	E	29.9	Very low	30.2	Very low	163 Å²	163	142.8 Å²	142.8	76%	0.762	74%	0.738	S	S	*	*			cis	-153.3	151.6	28.8	-149.2	145	-121.1	0	0	115.1
790	E	29.4	Very low	30.3	Very low	158 Å²	158	146.4 Å²	146.4	74%	0.738	74%	0.74	S	S	*	*			trans	7.2	131.7	161	-57.8	-178.6	162.5	0	0	122.2
791	T	30.1	Very low	30.1	Very low	134 Å²	134	145.8 Å²	145.8	82%	0.822	74%	0.736	S	S	*	*				-177.8	150.7	94.8	27.8	0	0	0	0	112.7
792	E	25.7	Very low	29.8	Very low	188 Å²	188	142.5 Å²	142.5	88%	0.879	73%	0.73	S	S	*	*			trans	-74.4	137.6	177	-51.7	178.1	115.9	0	0	112.3
793	T	27.5	Very low	29.5	Very low	133 Å²	133	143 Å²	143	82%	0.816	73%	0.731	S	S	*	*			trans	-162.4	150.4	144.8	-0.1	0	0	0	0	115.5	F795	T793-F795 PolarHBondContact O-N 3.41Å
794	K	26.9	Very low	29.1	Very low	176 Å²	176	143.8 Å²	143.8	77%	0.765	74%	0.739	S	S	*	*			trans	-51.8	128	174.4	-59.2	154.2	-179.4	166.4	0	112.3	I796	K794-I796 HydrophobicContact CB-CD1 4.41Å; K794-I796 HydrophobicContact CB-CG1 4.14Å; K794-I796 HydrophobicContact CD-CD1 4.39Å; K794-I796 PolarHBondContact O-N 2.9Å
795	F	28.6	Very low	28.8	Very low	211 Å²	211	144.2 Å²	144.2	93%	0.925	74%	0.74	S	S	*	*			trans	-73.7	64	165.8	-95.7	-78.2	0	0	0	112.7	T793	T793-F795 PolarHBondContact O-N 3.41Å
796	I	28.9	Very low	28.8	Very low	119 Å²	119	145.3 Å²	145.3	61%	0.61	75%	0.748	S	S	*	*			trans	-86.4	115.1	158.7	-55.5	173	0	0	0	106.5	K794 T798	K794-I796 HydrophobicContact CB-CD1 4.41Å; K794-I796 HydrophobicContact CB-CG1 4.14Å; K794-I796 HydrophobicContact CD-CD1 4.39Å; K794-I796 PolarHBondContact O-N 2.9Å; I796-T798 VanDerWaalsContact CG2-OG1 3.3Å; I796-T798 WeakPolarHBondContact CG2-OG1 3.24Å; I796-T798 PolarHBondContact O-N 2.83Å; I796-T798 PolarHBondContact O-OG1 2.92Å
797	H	32.1	Very low	28.6	Very low	172 Å²	172	144.5 Å²	144.5	80%	0.796	75%	0.748	S	S	*	*			trans	-75.5	68.5	178.3	-142.7	-43.4	0	0	0	111.8	I799	H797-I799 PolarHBondContact O-N 2.71Å; H797-I799 VanDerWaalsContact O-N 3.11Å
798	T	26.7	Very low	28.5	Very low	90 Å²	90	144.6 Å²	144.6	55%	0.552	76%	0.757	S	S	*	*			trans	-75.8	96.1	-176.7	-54.5	0	0	0	0	110.6	I796 K800	I796-T798 VanDerWaalsContact CG2-OG1 3.3Å; I796-T798 WeakPolarHBondContact CG2-OG1 3.24Å; I796-T798 PolarHBondContact O-N 2.83Å; I796-T798 PolarHBondContact O-OG1 2.92Å; T798-K800 HydrophobicContact CG2-CG 3.93Å; T798-K800 PolarHBondContact O-N 2.76Å
799	I	34.9	Very low	28.3	Very low	154 Å²	154	146 Å²	146	79%	0.79	76%	0.764	S	S	*	*			trans	-79.7	100.9	160	-61	-177.6	0	0	0	107.3	H797	H797-I799 PolarHBondContact O-N 2.71Å; H797-I799 VanDerWaalsContact O-N 3.11Å
800	K	27.8	Very low	28.3	Very low	179 Å²	179	147 Å²	147	78%	0.778	77%	0.766	S	S	*	*			trans	-64.2	143.6	-176.2	-69.6	-179.9	177.1	175.8	0	112.3	T798	T798-K800 HydrophobicContact CG2-CG 3.93Å; T798-K800 PolarHBondContact O-N 2.76Å
801	P	31	Very low	28.2	Very low	109 Å²	109	146.1 Å²	146.1	71%	0.708	77%	0.765	S	S	*	*			trans	-87.3	-178.1	163.1	38	-35	0	0	0	111.8
802	S	24.2	Very low	28.2	Very low	100 Å²	100	148.1 Å²	148.1	70%	0.699	77%	0.765	S	S	*	*			trans	79.1	111.9	172.7	-47.2	0	0	0	0	114.5
803	I	26.1	Very low	28.5	Very low	151 Å²	151	145.3 Å²	145.3	77%	0.774	76%	0.761	S	S	*	*				80.1	109.2	73.3	-67.5	159.2	0	0	0	113.2
804	S	26.2	Very low	28.7	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	76%	0.759	S	S	*	*			trans	-164	150.1	141.9	58.5	0	0	0	0	112.7
805	Y	25.7	Very low	29.1	Very low	208 Å²	208	143.7 Å²	143.7	82%	0.816	76%	0.762	S	S	*	*			trans	-50.5	170.3	178.1	-52.6	-88.8	0	0	0	115.2
806	S	29.4	Very low	29.1	Very low	101 Å²	101	140.9 Å²	140.9	71%	0.706	76%	0.756	S	S	*	*			cis	-161.5	142.5	31.5	58.9	0	0	0	0	117.9
807	T	25.3	Very low	29.2	Very low	115 Å²	115	145 Å²	145	71%	0.706	77%	0.769	S	S	*	*				47.9	114.2	127	-46.2	0	0	0	0	122.8
808	S	31.1	Very low	29.2	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	76%	0.762	S	S	*	*				171.7	103.3	127.2	-77.4	0	0	0	0	111
809	Q	27.1	Very low	29.5	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	78%	0.78	S	S	*	*				65.4	90.6	92.3	-75.7	-159.3	-0.3	0	0	118
810	K	30.3	Very low	29.4	Very low	186 Å²	186	150 Å²	150	81%	0.809	78%	0.783	S	S	*	*				-169.7	128.3	128.7	-98.8	167.8	179.5	-179.2	0	106.5
811	I	27.5	Very low	29.7	Very low	138 Å²	138	150.6 Å²	150.6	71%	0.708	79%	0.786	S	S	*	*				59.2	114.1	74.5	-57.2	167	0	0	0	108.2
812	E	30	Very low	29.8	Very low	177 Å²	177	153.3 Å²	153.3	83%	0.827	79%	0.789	S	S	*	*			cis	-152.8	-177.9	49.4	-145.2	144.4	-126.9	0	0	116.3
813	T	31.3	Very low	30	Very low	128 Å²	128	156.2 Å²	156.2	79%	0.785	80%	0.796	S	S	*	*			trans	-65.4	161	-160.8	51.6	0	0	0	0	121.7
814	N	32.1	Very low	30.2	Very low	145 Å²	145	156.2 Å²	156.2	78%	0.775	80%	0.798	S	S	*	*			trans	-65.3	175.7	162.3	-61.5	-69.1	0	0	0	113.8
815	P	34.4	Very low	30.5	Very low	130 Å²	130	156 Å²	156	84%	0.844	80%	0.796	S	S	*	*				-141.7	159.9	113.5	38.6	-27.5	0	0	0	117
816	I	28.2	Very low	30.9	Very low	153 Å²	153	154 Å²	154	79%	0.785	80%	0.796	S	S	*	*			trans	-115.5	137.8	176.2	-61.9	166.2	0	0	0	110.4
817	K	32.7	Very low	31	Very low	204 Å²	204	158.7 Å²	158.7	89%	0.887	80%	0.804	S	S	*	*			trans	-141.5	116	153.8	-74.4	-177	179.9	172.1	0	108
818	S	31.7	Very low	31.4	Very low	93 Å²	93	156.7 Å²	156.7	65%	0.65	81%	0.806	S	S	*	*				76.2	124.9	75.4	-163.4	0	0	0	0	111.3
819	Q	33.1	Very low	31.5	Very low	199 Å²	199	157.4 Å²	157.4	93%	0.93	81%	0.806	S	S	*	*				-125.3	170.4	70.7	-63.4	-174.7	-10.3	0	0	116.1
820	R	33	Very low	31.6	Very low	229 Å²	229	155.6 Å²	155.6	86%	0.864	80%	0.801	S	S	*	*			trans	-118.4	156.4	-167.8	-72.5	171.9	161.1	169.7	-7	114
821	K	32.8	Very low	31.7	Very low	193 Å²	193	155.2 Å²	155.2	84%	0.839	80%	0.804	S	S	*	*			trans	162.1	137.6	138.4	-94.8	179.4	175.1	178.9	0	107.8
822	Q	34	Very low	31.7	Very low	165 Å²	165	156.3 Å²	156.3	77%	0.771	81%	0.811	S	S	*	*			cis	-152.1	163.1	-7.9	-51.7	-152.2	128.3	0	0	106.5
823	L	28.8	Very low	32.1	Very low	161 Å²	161	152.9 Å²	152.9	84%	0.843	81%	0.805	S	S	*	*			cis	-162.1	169.6	-19.4	174.4	58.3	0	0	0	106.8
824	N	30	Very low	32.2	Very low	151 Å²	151	154.3 Å²	154.3	81%	0.807	81%	0.806	S	S	*	*			trans	-96.7	142.6	-166.6	-70.6	-20.3	0	0	0	116.7
825	S	32.2	Very low	32	Very low	106 Å²	106	153.9 Å²	153.9	74%	0.741	80%	0.803	S	S	*	*			trans	-171.1	145.9	154.9	-84.6	0	0	0	0	110.1
826	M	34	Very low	32	Very low	165 Å²	165	153 Å²	153	81%	0.813	79%	0.792	S	S	*	*			cis	-144	162.2	-10.1	-88.9	-122.4	-158.1	0	0	112.2
827	K	31.3	Very low	31.9	Very low	200 Å²	200	152.3 Å²	152.3	87%	0.87	79%	0.79	S	S	*	*			trans	-22.1	142	167.3	-61.3	172.1	175.1	179.3	0	121.2
828	G	33.8	Very low	31.8	Very low	73 Å²	73	147.6 Å²	147.6	75%	0.753	78%	0.782	S	S	*	*			trans	114.5	145	140.7	0	0	0	0	0	117
829	T	33.7	Very low	31.6	Very low	127 Å²	127	148 Å²	148	78%	0.779	79%	0.785	S	S	*	*			cis	-157	114.3	-9.3	-72.6	0	0	0	0	111.5
830	I	29.1	Very low	31.5	Very low	145 Å²	145	144.1 Å²	144.1	74%	0.744	78%	0.775	S	S	*	*			trans	50	142.1	133.5	-50.2	176.3	0	0	0	122.3
831	M	31.9	Very low	31.3	Very low	178 Å²	178	138.5 Å²	138.5	88%	0.877	77%	0.766	S	S	*	*			trans	109.3	154.3	151.5	-110.9	170.2	-76.7	0	0	119.4
832	N	27.5	Very low	31	Very low	160 Å²	160	135.7 Å²	135.7	86%	0.856	76%	0.76	S	S	*	*			trans	-143.2	-177.3	-145.6	-132.4	20.9	0	0	0	111.7
833	P	39.3	Very low	30.7	Very low	105 Å²	105	133.2 Å²	133.2	68%	0.682	75%	0.752	S	S	*	*			trans	-101.4	174.1	-159.6	41.4	-40.2	0	0	0	116.6
834	I	32	Very low	30.8	Very low	158 Å²	158	132.9 Å²	132.9	81%	0.81	74%	0.744	S	S	*	*			trans	-157.1	130.9	154.8	-90.7	135.9	0	0	0	104.6
835	N	29.2	Very low	30.8	Very low	136 Å²	136	132.2 Å²	132.2	73%	0.727	74%	0.74	S	S	*	*			cis	93.1	160.5	49.8	-139.6	74.2	0	0	0	113.6
836	D	33.2	Very low	30.7	Very low	113 Å²	113	134.3 Å²	134.3	60%	0.604	74%	0.738	S	S	*	*			trans	86	90.7	167.5	-52.1	-33.2	0	0	0	121.5
837	N	27.6	Very low	30.5	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	73%	0.733	S	S	*	*				61.2	150.1	110.4	-60.7	-27	0	0	0	124.8
838	S	29.7	Very low	30.5	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	73%	0.728	S	S	*	*			trans	77.5	122.5	160.8	88.3	0	0	0	0	115.3
839	S	28.2	Very low	30.4	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	73%	0.731	S	S	*	*				72.8	137.8	79.7	85.6	0	0	0	0	112.8
840	T	29.9	Very low	30.2	Very low	119 Å²	119	132 Å²	132	73%	0.73	72%	0.717	S	S	*	*			cis	-157.2	156.7	31.4	38.6	0	0	0	0	113.9
841	V	28.7	Very low	30.2	Very low	110 Å²	110	128.9 Å²	128.9	67%	0.667	71%	0.708	S	S	*	*			trans	45.9	115.4	132	-175.8	0	0	0	0	121.2
842	D	27	Very low	30.1	Very low	135 Å²	135	123.3 Å²	123.3	72%	0.722	69%	0.687	S	S	*	*				35.3	145.4	129.1	-41.5	-23.6	0	0	0	123.4
843	L	27.8	Very low	30.1	Very low	113 Å²	113	123 Å²	123	59%	0.592	68%	0.682	S	S	*	*				174.3	158.4	105.8	-91.4	168.5	0	0	0	115.3
844	F	30.1	Very low	29.7	Very low	153 Å²	153	124 Å²	124	67%	0.671	68%	0.678	S	S	*	*			trans	71.3	111	160.6	-62.3	-57	0	0	0	122.7
845	D	30.9	Very low	29.4	Very low	138 Å²	138	123.2 Å²	123.2	74%	0.738	67%	0.674	S	S	*	*				50.6	153.1	104.4	-62.8	8	0	0	0	122.2
846	E	29.4	Very low	29.2	Very low	150 Å²	150	121.6 Å²	121.6	70%	0.701	67%	0.674	S	S	*	*			cis	-163.9	172.9	-31.9	-147.7	-164.9	-176.9	0	0	107.8
847	N	29.3	Very low	29	Very low	131 Å²	131	121.8 Å²	121.8	70%	0.701	68%	0.679	S	S	*	*			trans	47.3	104.8	157.4	-67.8	-37.7	0	0	0	120.8
848	A	32.5	Very low	29	Very low	93 Å²	93	122.5 Å²	122.5	77%	0.769	68%	0.681	S	S	*	*				175.9	125.3	99.8	0	0	0	0	0	115.1
849	K	31.8	Very low	29	Very low	188 Å²	188	123.2 Å²	123.2	82%	0.817	68%	0.677	S	S	*	*			trans	36.8	130.2	141.7	-66.6	179.7	-179.6	175.1	0	122.4
850	Q	29.4	Very low	29	Very low	103 Å²	103	129.9 Å²	129.9	48%	0.481	69%	0.687	S	S	.	*			trans	88.2	76.3	131.4	-76.6	176.8	-48.5	0	0	122.6	P885 T886 T887	Q850-P885 WeakPolarHBondContact O-CB 3.42Å; Q850-T886 VanDerWaalsContact CB-OG1 3.28Å; Q850-T886 WeakPolarHBondContact CB-OG1 3.32Å; Q850-T886 HydrophobicContact CG-CG2 4.09Å; Q850-T886 WeakPolarHBondContact CG-OG1 3.43Å; Q850-T887 PolarHBondContact NE2-OG1 2.76Å
851	S	29	Very low	29	Very low	80 Å²	80	128.8 Å²	128.8	56%	0.559	68%	0.684	S	S	*	*				39.8	107.7	128.8	-162.2	0	0	0	0	121.2	P884 T886	S851-P884 WeakPolarHBondContact O-CB 3.48Å; S851-T886 WeakPolarHBondContact CB-OG1 3.28Å
852	S	29.9	Very low	29.1	Very low	61 Å²	61	133 Å²	133	43%	0.427	69%	0.693	S	S	.	*				155.3	144.5	101.8	57.1	0	0	0	0	115.9	T883	S852-T883 VanDerWaalsContact O-CB 3.3Å; S852-T883 WeakPolarHBondContact O-CB 3.24Å; S852-T883 PolarHBondContact O-OG1 3.27Å
853	M	27.5	Very low	29.3	Very low	153 Å²	153	131.2 Å²	131.2	75%	0.754	69%	0.691	S	S	*	*			trans	62.6	131.3	160.6	-76.7	-164.9	176.6	0	0	122.8	T883	M853-T883 HydrophobicContact CB-CG2 3.71Å; M853-T883 PolarHBondContact O-OG1 3.07Å
854	H	29.9	Very low	29.4	Very low	128 Å²	128	131.8 Å²	131.8	59%	0.593	69%	0.694	S	S	*	*			trans	84.7	87.3	144.1	-103.2	-106.5	0	0	0	123	T881	H854-T881 HydrophobicContact CB-CG2 4.29Å
855	L	25.9	Very low	29.4	Very low	141 Å²	141	133.8 Å²	133.8	74%	0.738	70%	0.699	S	S	*	*				72	108.3	114.8	-161.9	86.9	0	0	0	119.5
856	S	26.7	Very low	29.3	Very low	102 Å²	102	134.9 Å²	134.9	71%	0.713	70%	0.697	S	S	*	*				169.9	143.1	101.5	52	0	0	0	0	115.8
857	T	27.2	Very low	29.2	Very low	117 Å²	117	134.5 Å²	134.5	72%	0.718	70%	0.7	S	S	*	*			trans	42.6	127.5	138.3	-47.2	0	0	0	0	122.2
858	I	29.4	Very low	29.2	Very low	153 Å²	153	135.2 Å²	135.2	79%	0.785	70%	0.699	S	S	*	*				-170	127.7	120.8	-98.9	157.1	0	0	0	113.8
859	N	27.9	Very low	29.2	Very low	120 Å²	120	137.3 Å²	137.3	64%	0.642	70%	0.697	S	S	*	*			trans	13.5	143.4	150.9	-44.5	-45.1	0	0	0	120.5
860	R	30.1	Very low	29.1	Very low	240 Å²	240	137.1 Å²	137.1	91%	0.906	70%	0.696	S	S	*	*			cis	-154.2	147.8	46	-73.9	173.5	166.7	125.6	-5.2	110.8
861	S	28.6	Very low	29.2	Very low	95 Å²	95	137.6 Å²	137.6	66%	0.664	71%	0.711	S	S	*	*			cis	103.8	103.8	26.3	-62.4	0	0	0	0	114.6
862	K	30.9	Very low	29.1	Very low	200 Å²	200	139.8 Å²	139.8	87%	0.87	72%	0.715	S	S	*	*			trans	179.4	107.3	150.2	-98.1	159.3	-175.6	-179	0	107.5
863	S	30.6	Very low	29.1	Very low	97 Å²	97	142 Å²	142	68%	0.678	73%	0.726	S	S	*	*			cis	77.9	150.9	45.3	86.2	0	0	0	0	113.8
864	L	30.4	Very low	29.1	Very low	124 Å²	124	139.9 Å²	139.9	65%	0.649	72%	0.722	S	S	*	*			cis	-101.6	-153.2	-0.4	-71.5	85.2	0	0	0	110
865	Y	29.7	Very low	29	Very low	196 Å²	196	141.7 Å²	141.7	77%	0.769	73%	0.733	S	S	*	*			cis	-146.6	150.2	11.8	-88	-95.6	0	0	0	112.5
866	F	29.6	Very low	29.2	Very low	160 Å²	160	140.1 Å²	140.1	70%	0.702	73%	0.729	S	S	*	*			trans	25.2	121.9	142.1	-70.1	-105.4	0	0	0	120.2
867	N	27.2	Very low	29.4	Very low	143 Å²	143	141 Å²	141	77%	0.765	73%	0.731	S	S	*	*			cis	71.8	138.6	25.7	-141.1	13.6	0	0	0	112.3
868	Q	29.9	Very low	29.5	Very low	146 Å²	146	140.5 Å²	140.5	68%	0.682	73%	0.727	S	S	*	*			cis	-134.9	169.2	19.7	-62.5	156	-33	0	0	110.5
869	N	30.9	Very low	29.6	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	72%	0.723	S	S	*	*				-158.6	167.7	64.9	-102.8	-20.7	0	0	0	113.7
870	K	31.3	Very low	29.8	Very low	184 Å²	184	137.4 Å²	137.4	80%	0.8	72%	0.72	S	S	*	*			trans	-134.9	156.9	-165.9	-114.8	-171.4	-179.3	-173.6	0	113.9
871	S	30	Very low	30.1	Very low	112 Å²	112	129.8 Å²	129.8	78%	0.783	70%	0.701	S	S	*	*			trans	-162.4	114.2	143.9	-75.2	0	0	0	0	107.2
872	I	27.8	Very low	30.2	Very low	127 Å²	127	127.5 Å²	127.5	65%	0.651	69%	0.687	S	S	*	*				76.7	129.1	58.7	-62.9	166.4	0	0	0	110.2
873	T	29.8	Very low	30.5	Very low	108 Å²	108	120.2 Å²	120.2	66%	0.663	66%	0.659	S	S	*	*			cis	-127.9	149.7	9.2	-58.5	0	0	0	0	110.1	M875	T873-M875 HydrophobicContact CG2-CG 4.48Å
874	T	27.8	Very low	30.8	Very low	108 Å²	108	117.9 Å²	117.9	66%	0.663	64%	0.642	S	S	*	*			cis	96.6	68	0.8	-36.7	0	0	0	0	119.3
875	M	28.5	Very low	31.1	Very low	165 Å²	165	115.7 Å²	115.7	81%	0.813	64%	0.636	S	S	*	*			trans	-139.5	134	153.4	-71.3	-62.2	163.8	0	0	108.4	T873	T873-M875 HydrophobicContact CG2-CG 4.48Å
876	T	29	Very low	31.3	Very low	108 Å²	108	109.4 Å²	109.4	66%	0.663	62%	0.617	S	S	*	*			cis	68.3	144.3	28.4	55.9	0	0	0	0	115.6
877	T	30.6	Very low	31.4	Very low	122 Å²	122	106.1 Å²	106.1	75%	0.748	61%	0.611	S	S	*	*			cis	-121.6	176.2	17	50	0	0	0	0	113
878	T	29.4	Very low	31.6	Very low	106 Å²	106	105 Å²	105	65%	0.65	61%	0.609	S	S	*	*			cis	88.2	139.7	7.9	69.4	0	0	0	0	117.4
879	T	31.9	Very low	31.7	Very low	112 Å²	112	108.3 Å²	108.3	69%	0.687	62%	0.615	S	S	*	*			cis	178.5	158.4	0.6	29.3	0	0	0	0	107.8
880	T	32.9	Very low	31.7	Very low	95 Å²	95	105.8 Å²	105.8	58%	0.583	61%	0.605	S	S	*	*			cis	-178.1	157.3	-1.8	26.3	0	0	0	0	113.4
881	T	35	Very low	31.7	Very low	81 Å²	81	101.9 Å²	101.9	50%	0.497	60%	0.597	S	S	.	*			trans	70.5	161	148	56.2	0	0	0	0	121.1	H854	H854-T881 HydrophobicContact CB-CG2 4.29Å
882	A	32	Very low	31.9	Very low	47 Å²	47	98.6 Å²	98.6	39%	0.388	58%	0.58	S	S	.	*			cis	-146.6	-151.6	14.5	0	0	0	0	0	117.8
883	T	36.4	Very low	31.8	Very low	46 Å²	46	98 Å²	98	28%	0.282	58%	0.578	S	S	.	*			trans	-122.4	-172.3	-157.9	55.2	0	0	0	0	112.2	Q560 S852 M853	Q560-T883 VanDerWaalsContact CA-O 3.3Å; Q560-T883 WeakPolarHBondContact CA-O 3.2Å; Q560-T883 VanDerWaalsContact CB-O 3.27Å; Q560-T883 WeakPolarHBondContact CB-O 3.28Å; Q560-T883 PolarHBondContact N-O 2.65Å; S852-T883 VanDerWaalsContact O-CB 3.3Å; S852-T883 WeakPolarHBondContact O-CB 3.24Å; S852-T883 PolarHBondContact O-OG1 3.27Å; M853-T883 HydrophobicContact CB-CG2 3.71Å; M853-T883 PolarHBondContact O-OG1 3.07Å
884	P	36.9	Very low	31.7	Very low	49 Å²	49	102.6 Å²	102.6	32%	0.318	59%	0.585	S	S	.	*			cis	-127.3	-139	1.3	37.6	-13.4	0	0	0	111.5	S851	S851-P884 WeakPolarHBondContact O-CB 3.48Å
885	P	36	Very low	31.8	Very low	78 Å²	78	100.9 Å²	100.9	51%	0.506	58%	0.577	S	S	.	*			cis	-140.9	155.4	-14.4	36.3	-14.1	0	0	0	120.5	Q850	Q850-P885 WeakPolarHBondContact O-CB 3.42Å
886	T	33.8	Very low	31.8	Very low	63 Å²	63	100.8 Å²	100.8	39%	0.387	58%	0.579	S	S	.	*			trans	40.4	138.1	145.9	-18.6	0	0	0	0	128.1	Q850 S851	Q850-T886 VanDerWaalsContact CB-OG1 3.28Å; Q850-T886 WeakPolarHBondContact CB-OG1 3.32Å; Q850-T886 HydrophobicContact CG-CG2 4.09Å; Q850-T886 WeakPolarHBondContact CG-OG1 3.43Å; S851-T886 WeakPolarHBondContact CB-OG1 3.28Å
887	T	32.2	Very low	32	Very low	92 Å²	92	100.3 Å²	100.3	56%	0.564	58%	0.578	S	S	*	*				122.4	110.8	125.1	-6.5	0	0	0	0	122.5	Q850	Q850-T887 PolarHBondContact NE2-OG1 2.76Å
888	T	31.5	Very low	31.8	Very low	119 Å²	119	103.2 Å²	103.2	73%	0.73	58%	0.58	S	S	*	*			trans	67.9	118.1	140.2	43	0	0	0	0	127.8
889	R	31.5	Very low	31.7	Very low	215 Å²	215	103.4 Å²	103.4	81%	0.811	59%	0.586	S	S	*	*				80.1	118.8	122.2	-81.1	-175.1	66.1	159.8	-1.3	125.9
890	T	31.5	Very low	31.5	Very low	84 Å²	84	103.8 Å²	103.8	52%	0.515	58%	0.58	S	S	.	*				81.9	146.1	129	51.1	0	0	0	0	125.7
891	T	31.5	Very low	31.1	Very low	103 Å²	103	101.3 Å²	101.3	63%	0.632	57%	0.566	S	S	*	*			trans	88.5	155	155	32.4	0	0	0	0	121.5	S1181 N1182	T891-S1181 CarbonylContact C-O 3.59Å; T891-S1181 VanDerWaalsContact C-O 3.22Å; T891-N1182 HydrophobicContact CG2-CB 3.81Å; T891-N1182 PolarHBondContact N-ND2 3.42Å; T891-N1182 PolarHBondContact N-OD1 3.26Å
892	G	33	Very low	30.7	Very low	42 Å²	42	101.5 Å²	101.5	43%	0.433	57%	0.571	S	S	.	*			trans	-170.9	-149	-156.1	0	0	0	0	0	119.5	S1180 S1181	G892-S1180 CarbonylContact C-O 3.22Å; G892-S1180 WeakPolarHBondContact CA-O 3.33Å; G892-S1181 VanDerWaalsContact CA-O 3.22Å; G892-S1181 WeakPolarHBondContact CA-O 3.48Å; G892-S1181 PolarHBondContact N-O 2.91Å; G892-S1181 VanDerWaalsContact N-O 3.15Å
893	L	27.7	Very low	30.5	Very low	116 Å²	116	104 Å²	104	61%	0.607	59%	0.586	S	S	*	*			trans	163.2	88.5	-164.8	-29.2	169	0	0	0	119.2	L1178 F1179 S1180	L893-L1178 VanDerWaalsContact O-O 3.12Å; L893-F1179 CarbonylContact C-O 3.49Å; L893-F1179 WeakPolarHBondContact CA-O 3.39Å; L893-F1179 PolarHBondContact N-O 3.35Å; L893-F1179 VanDerWaalsContact N-O 3.11Å; L893-F1179 CarbonylContact O-C 3.58Å; L893-S1180 VanDerWaalsContact N-C 3.3Å; L893-S1180 PolarHBondContact N-O 3.37Å; L893-S1180 VanDerWaalsContact N-O 3.12Å; L893-S1180 PolarHBondContact O-N 3.2Å
894	Y	26.9	Very low	30	Very low	203 Å²	203	112.2 Å²	112.2	80%	0.796	61%	0.613	S	S	*	*			trans	-42.5	141	176.8	-75.9	-102.3	0	0	0	117.7
895	S	28.7	Very low	29.6	Very low	72 Å²	72	116.6 Å²	116.6	50%	0.503	63%	0.634	S	S	.	*			trans	-160.6	168.3	146.1	60	0	0	0	0	113.1	L1178	S895-L1178 PolarHBondContact OG-N 2.91Å; S895-L1178 PolarHBondContact OG-O 2.79Å
896	L	28.6	Very low	29.2	Very low	163 Å²	163	120.1 Å²	120.1	85%	0.853	64%	0.643	S	S	*	*			trans	-127.7	-158.6	-158.5	-143.1	78.3	0	0	0	113.3
897	P	34.3	Very low	28.9	Very low	99 Å²	99	122.8 Å²	122.8	64%	0.643	65%	0.654	S	S	*	*				-126.3	-149.9	-122.7	46.2	-27.2	0	0	0	114.6
898	K	26.7	Very low	28.6	Very low	183 Å²	183	124.9 Å²	124.9	80%	0.796	66%	0.662	S	S	*	*			trans	93	100.7	175	-56.3	177.1	-176.6	175.5	0	113.5
899	S	26.6	Very low	28.4	Very low	109 Å²	109	123.9 Å²	123.9	76%	0.762	66%	0.659	S	S	*	*				74.8	119.2	59	77.9	0	0	0	0	114.6
900	Q	27.5	Very low	28.3	Very low	121 Å²	121	120.7 Å²	120.7	57%	0.565	66%	0.657	S	S	*	*			trans	-153.4	151.8	142.7	-99.6	-169.6	33.4	0	0	109.6	K1170	Q900-K1170 HydrophobicContact CG-CD 4.49Å; Q900-K1170 HydrophobicContact CG-CG 4.05Å
901	S	25.7	Very low	28.3	Very low	42 Å²	42	124 Å²	124	29%	0.294	67%	0.672	S	S	.	*			trans	-95.7	-170.6	-161.1	55.6	0	0	0	0	115.2	E1167 K1170	S901-E1167 VanDerWaalsContact CB-OE2 3.27Å; S901-E1167 WeakPolarHBondContact CB-OE2 3.35Å; S901-E1167 PolarHBondContact OG-OE2 3.08Å; S901-K1170 PolarHBondContact O-NZ 2.88Å; S901-K1170 VanDerWaalsContact OG-CE 3.25Å; S901-K1170 WeakPolarHBondContact OG-CE 3.29Å
902	S	26.2	Very low	28.1	Very low	86 Å²	86	125.6 Å²	125.6	60%	0.601	68%	0.681	S	S	*	*			trans	66.2	133.5	153.2	82.4	0	0	0	0	118.5	K1170	S902-K1170 PolarHBondContact OG-NZ 3.41Å
903	S	27.1	Very low	27.9	Very low	100 Å²	100	129.2 Å²	129.2	70%	0.699	70%	0.7	S	S	*	*			cis	-157.8	140	25.4	-60.8	0	0	0	0	114.8
904	Y	25.2	Very low	27.8	Very low	217 Å²	217	133.5 Å²	133.5	85%	0.851	71%	0.713	S	S	*	*			trans	44	156.6	137.4	-84.4	-89.2	0	0	0	125.3
905	N	29.1	Very low	27.8	Very low	141 Å²	141	129.3 Å²	129.3	75%	0.754	71%	0.714	S	S	*	*			trans	87.8	135	167.5	-59.3	-20.7	0	0	0	116.8
906	H	28.7	Very low	27.8	Very low	152 Å²	152	132.1 Å²	132.1	70%	0.704	73%	0.728	S	S	*	*			cis	-162.6	145.1	-15.3	-152.1	-118.5	0	0	0	111.9
907	I	26.3	Very low	27.8	Very low	120 Å²	120	131.4 Å²	131.4	62%	0.615	72%	0.724	S	S	*	*			trans	67.2	129	149.6	-96.8	-175.5	0	0	0	123.1
908	D	26	Very low	27.4	Very low	136 Å²	136	136.3 Å²	136.3	73%	0.727	73%	0.731	S	S	*	*			trans	47.4	149	140.1	-53.4	-15.6	0	0	0	123.8
909	S	27.2	Very low	27.4	Very low	97 Å²	97	135.4 Å²	135.4	68%	0.678	72%	0.724	S	S	*	*			cis	-169.1	169.7	-18	57.2	0	0	0	0	109.6
910	I	31	Very low	27.7	Very low	149 Å²	149	135.7 Å²	135.7	76%	0.764	72%	0.723	S	S	*	*			trans	167.6	125.9	134.7	-89	161.3	0	0	0	113.8
911	N	30.3	Very low	27.7	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	74%	0.736	S	S	*	*			trans	59.3	158.2	156.9	-76.9	-36.4	0	0	0	123
912	T	27.2	Very low	27.6	Very low	136 Å²	136	142.9 Å²	142.9	83%	0.834	76%	0.761	S	S	*	*			trans	-142.4	151.1	-158.2	59.9	0	0	0	0	113.7
913	S	29.9	Very low	27.7	Very low	117 Å²	117	145.2 Å²	145.2	82%	0.818	78%	0.776	S	S	*	*			trans	-145.9	74	171	62.6	0	0	0	0	113.4
914	K	25.4	Very low	27.6	Very low	206 Å²	206	146.9 Å²	146.9	90%	0.896	78%	0.781	S	S	*	*			trans	37.3	90	156	-64.7	179.5	179.9	174.6	0	118.3
915	S	27	Very low	27.6	Very low	116 Å²	116	144.2 Å²	144.2	81%	0.811	78%	0.78	S	S	*	*			trans	-134.5	103.9	151	61.3	0	0	0	0	110.2
916	T	29	Very low	27.6	Very low	130 Å²	130	143.7 Å²	143.7	80%	0.798	78%	0.782	S	S	*	*			trans	-105.9	92	-176.5	-47.2	0	0	0	0	110.8
917	I	27	Very low	27.4	Very low	149 Å²	149	142.4 Å²	142.4	76%	0.764	79%	0.785	S	S	*	*			trans	-95.5	128.8	158.2	-62.9	174.1	0	0	0	106.1	Y919	I917-Y919 HydrophobicContact CG2-CD2 4.38Å; I917-Y919 HydrophobicContact CG2-CE2 4.49Å
918	Y	27.2	Very low	27.4	Very low	202 Å²	202	143.5 Å²	143.5	79%	0.792	79%	0.791	S	S	*	*			trans	-143.1	123.1	177.1	-146.4	-88.5	0	0	0	110.5
919	Y	26.2	Very low	27.6	Very low	164 Å²	164	144.7 Å²	144.7	64%	0.643	79%	0.792	S	S	*	*			trans	-120.8	143.4	170	-80.9	-81.6	0	0	0	108.5	I917	I917-Y919 HydrophobicContact CG2-CD2 4.38Å; I917-Y919 HydrophobicContact CG2-CE2 4.49Å
920	P	32.1	Very low	27.5	Very low	114 Å²	114	145.8 Å²	145.8	74%	0.74	79%	0.79	S	S	*	*			trans	-124.7	133.4	140.6	33.8	-24.8	0	0	0	111.2
921	Y	27.4	Very low	27.3	Very low	217 Å²	217	145 Å²	145	85%	0.851	79%	0.792	S	S	*	*			trans	-81	126.8	171.7	-85.3	-100.9	0	0	0	110.7
922	A	24.4	Very low	27.2	Very low	98 Å²	98	143.6 Å²	143.6	81%	0.81	79%	0.789	S	S	*	*			trans	-158.5	98.7	156.6	0	0	0	0	0	111.2
923	C	27.6	Very low	27.2	Very low	135 Å²	135	143.9 Å²	143.9	91%	0.912	79%	0.791	S	S	*	*			trans	-145.9	133.8	159.7	-108.4	0	0	0	0	108.7
924	T	26.6	Very low	27.1	Very low	134 Å²	134	143.8 Å²	143.8	82%	0.822	79%	0.786	S	S	*	*			trans	-82.6	149	-175.3	43	0	0	0	0	112.5
925	I	24.8	Very low	27.1	Very low	162 Å²	162	139.8 Å²	139.8	83%	0.831	78%	0.779	S	S	*	*			trans	-81.4	121.4	171.9	-59.7	169.4	0	0	0	108.8
926	T	28.2	Very low	27.1	Very low	130 Å²	130	139.5 Å²	139.5	80%	0.798	77%	0.773	S	S	*	*			trans	-154.7	113.7	157.6	11.5	0	0	0	0	111.5
927	T	25.8	Very low	27	Very low	124 Å²	124	139.1 Å²	139.1	76%	0.761	77%	0.77	S	S	*	*			trans	-122.1	140.7	162.5	-29.1	0	0	0	0	103.1
928	I	26.2	Very low	27	Very low	144 Å²	144	137.4 Å²	137.4	74%	0.738	77%	0.767	S	S	*	*				-161.2	158	60.4	-76	169.7	0	0	0	109.9
929	H	28.7	Very low	27.1	Very low	160 Å²	160	133.8 Å²	133.8	74%	0.741	76%	0.761	S	S	*	*			trans	-27	149.7	164.6	-63.5	-113.6	0	0	0	118.4
930	N	26.7	Very low	27.2	Very low	121 Å²	121	131.8 Å²	131.8	65%	0.647	76%	0.762	S	S	*	*				-173.3	177.1	99	-98.6	-63.7	0	0	0	115.2
931	T	26.1	Very low	27.2	Very low	131 Å²	131	132.8 Å²	132.8	80%	0.804	76%	0.761	S	S	*	*			trans	-84.7	166.9	-168.3	46.8	0	0	0	0	116.3
932	T	27.1	Very low	27.3	Very low	125 Å²	125	126.6 Å²	126.6	77%	0.767	75%	0.749	S	S	*	*			trans	-68.2	140.6	-172.6	-37.3	0	0	0	0	117.2
933	T	28.5	Very low	27.5	Very low	143 Å²	143	128.8 Å²	128.8	88%	0.877	75%	0.747	S	S	*	*			trans	-153.7	163.8	139.7	3	0	0	0	0	111.5
934	T	26.4	Very low	27.6	Very low	114 Å²	114	127.3 Å²	127.3	70%	0.699	73%	0.734	S	S	*	*			trans	-131.6	-174.3	-169.1	49.7	0	0	0	0	113.1
935	T	27.3	Very low	27.6	Very low	123 Å²	123	129.5 Å²	129.5	76%	0.755	73%	0.733	S	S	*	*			trans	84.8	144.9	178	73	0	0	0	0	115.3
936	T	26.4	Very low	27.7	Very low	110 Å²	110	126.6 Å²	126.6	68%	0.675	73%	0.726	S	S	*	*			cis	-151.1	171.1	11.8	-23.5	0	0	0	0	112.8
937	T	26.3	Very low	28	Very low	121 Å²	121	125.5 Å²	125.5	74%	0.742	72%	0.722	S	S	*	*			trans	67.9	141.8	156	51.7	0	0	0	0	118.6
938	T	26.9	Very low	27.9	Very low	113 Å²	113	124.2 Å²	124.2	69%	0.693	72%	0.718	S	S	*	*			cis	-155.8	160.3	1.5	-0.4	0	0	0	0	113.4
939	N	28.7	Very low	27.8	Very low	127 Å²	127	124.1 Å²	124.1	68%	0.679	72%	0.718	S	S	*	*			trans	71.8	107.4	145	-71.2	6.2	0	0	0	123
940	N	30.4	Very low	27.6	Very low	122 Å²	122	126.2 Å²	126.2	65%	0.652	72%	0.721	S	S	*	*				104.3	116	112.5	-69	2.6	0	0	0	121.7
941	N	30.7	Very low	27.4	Very low	134 Å²	134	125.8 Å²	125.8	72%	0.717	73%	0.727	S	S	*	*			trans	87.5	87.7	130.2	-63.2	3.4	0	0	0	121
942	S	29.5	Very low	27.3	Very low	88 Å²	88	124.5 Å²	124.5	62%	0.615	72%	0.723	S	S	*	*				91.8	135.9	102.8	74	0	0	0	0	120.8
943	N	29.9	Very low	27.3	Very low	143 Å²	143	124.9 Å²	124.9	77%	0.765	73%	0.726	S	S	*	*			trans	73.2	141.1	145	-62.1	-4	0	0	0	118.3
944	T	28	Very low	27.2	Very low	104 Å²	104	125 Å²	125	64%	0.638	72%	0.721	S	S	*	*			cis	-165.4	147.1	-12.9	20.3	0	0	0	0	110.8
945	F	28.1	Very low	27.2	Very low	181 Å²	181	129.1 Å²	129.1	79%	0.794	73%	0.725	S	S	*	*			trans	55.6	115.6	146.7	-77.8	-117.9	0	0	0	121.2
946	S	26.5	Very low	27.2	Very low	100 Å²	100	130.5 Å²	130.5	70%	0.699	72%	0.723	S	S	*	*				43.9	157.8	100.3	-47	0	0	0	0	121.6
947	P	33.4	Very low	27.1	Very low	108 Å²	108	131.8 Å²	131.8	70%	0.701	72%	0.721	S	S	*	*			cis	-145.4	-177	-43.2	41.3	-24.1	0	0	0	114.5
948	S	24.7	Very low	27.1	Very low	97 Å²	97	131.8 Å²	131.8	68%	0.678	72%	0.716	S	S	*	*			trans	88.3	136.8	136.5	83.5	0	0	0	0	123.1
949	L	23.3	Very low	27.3	Very low	141 Å²	141	132.2 Å²	132.2	74%	0.738	72%	0.721	S	S	*	*			trans	84.7	130.3	141.4	-70.8	165	0	0	0	123.8
950	Y	24.3	Very low	27.2	Very low	205 Å²	205	132.5 Å²	132.5	80%	0.804	72%	0.722	S	S	*	*			trans	74.4	125.2	146.9	-80.8	-57.1	0	0	0	123.9
951	S	23.7	Very low	27	Very low	112 Å²	112	134.6 Å²	134.6	78%	0.783	73%	0.727	S	S	*	*			trans	105.4	140.7	132	77.4	0	0	0	0	119.5
952	S	23.2	Very low	26.7	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	72%	0.723	S	S	*	*			trans	-64	152.7	177.9	51	0	0	0	0	114.6
953	T	28.1	Very low	26.8	Very low	134 Å²	134	137.4 Å²	137.4	82%	0.822	73%	0.734	S	S	*	*				-165.2	161.3	120.7	10.1	0	0	0	0	112.3
954	N	25.6	Very low	26.5	Very low	145 Å²	145	139.1 Å²	139.1	78%	0.775	73%	0.734	S	S	*	*			trans	-70.6	167.4	160.8	-67.1	-56.5	0	0	0	110.3
955	Y	26.2	Very low	26.4	Very low	201 Å²	201	139.3 Å²	139.3	79%	0.788	74%	0.74	S	S	*	*			trans	158.5	104.4	144.9	-87	-68.2	0	0	0	106.7
956	H	26.6	Very low	26.3	Very low	152 Å²	152	138.7 Å²	138.7	70%	0.704	74%	0.741	S	S	*	*				64	136.2	98.3	-81.1	-92.7	0	0	0	114
957	Q	25	Very low	26.2	Very low	136 Å²	136	141.8 Å²	141.8	64%	0.636	74%	0.742	S	S	*	*			cis	159.7	150.5	-8	156.9	176.3	10.9	0	0	105.9
958	L	26.4	Very low	25.8	Very low	122 Å²	122	142.8 Å²	142.8	64%	0.639	74%	0.738	S	S	*	*			trans	70.4	164.6	164.8	-79.6	168.5	0	0	0	117.1	L960	L958-L960 HydrophobicContact CD2-CD1 3.31Å
959	P	30.1	Very low	26	Very low	121 Å²	121	146.1 Å²	146.1	79%	0.786	74%	0.736	S	S	*	*			cis	-119.2	158.2	9.9	36.7	-21	0	0	0	118.6
960	L	26.7	Very low	26.1	Very low	134 Å²	134	144.1 Å²	144.1	70%	0.702	73%	0.731	S	S	*	*			trans	-69.8	156.4	160.8	-73.9	67.7	0	0	0	110.2	L958	L958-L960 HydrophobicContact CD2-CD1 3.31Å
961	H	27.4	Very low	26.2	Very low	165 Å²	165	142.8 Å²	142.8	76%	0.764	73%	0.731	S	S	*	*				-168.7	158.1	114.7	-115.3	-90.5	0	0	0	112.9
962	N	24.4	Very low	26.7	Very low	117 Å²	117	143.2 Å²	143.2	63%	0.626	73%	0.725	S	S	*	*			trans	13.8	137	155.9	-63.4	-22.3	0	0	0	119.2
963	I	31.6	Very low	27.1	Very low	165 Å²	165	144.8 Å²	144.8	85%	0.846	73%	0.732	S	S	*	*				-139.5	146	69.6	-83.9	158.1	0	0	0	113.3
964	K	24.1	Very low	27.1	Very low	178 Å²	178	147.5 Å²	147.5	77%	0.774	73%	0.727	S	S	*	*			trans	-97.5	164.1	171.9	-67.4	176.6	178.8	174	0	111
965	S	25.2	Very low	27.3	Very low	109 Å²	109	150.7 Å²	150.7	76%	0.762	73%	0.734	S	S	*	*			trans	72.2	151.3	174.7	81	0	0	0	0	114.7
966	M	25.4	Very low	27.4	Very low	167 Å²	167	145.2 Å²	145.2	82%	0.823	72%	0.722	S	S	*	*			cis	-121.3	130.4	5.5	-75.1	171.3	61.6	0	0	109.7
967	K	25.9	Very low	27.6	Very low	166 Å²	166	144.3 Å²	144.3	72%	0.722	73%	0.727	S	S	*	*				68.8	110.7	81.3	-88.7	-172.9	165.3	-167.6	0	116.3
968	Q	24.9	Very low	27.7	Very low	128 Å²	128	143.6 Å²	143.6	60%	0.598	72%	0.724	S	S	*	*			trans	66.6	146.7	144.8	-55.7	165.2	-98.5	0	0	116.1
969	Y	27.1	Very low	27.8	Very low	167 Å²	167	145.5 Å²	145.5	66%	0.655	73%	0.733	S	S	*	*			cis	-137.3	134.8	25.8	-88.3	-90.2	0	0	0	110.9
970	T	26.7	Very low	27.7	Very low	100 Å²	100	148.2 Å²	148.2	61%	0.613	73%	0.729	S	S	*	*				54.8	142	97.6	76.8	0	0	0	0	116
971	E	25.6	Very low	28.2	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.822	73%	0.728	S	S	*	*			cis	-160.3	170.1	-3.2	-124.7	165.3	-142.4	0	0	111.9
972	L	35.7	Very low	28.2	Very low	122 Å²	122	147.9 Å²	147.9	64%	0.639	73%	0.73	S	S	*	*			trans	-87.5	-178.6	160.9	-74.8	82.9	0	0	0	109.4	R974	L972-R974 HydrophobicContact CD2-CG 3.87Å
973	P	30.4	Very low	28.3	Very low	136 Å²	136	149.5 Å²	149.5	88%	0.883	74%	0.738	S	S	*	*				-127.9	133.3	110.3	34.2	-30.3	0	0	0	114
974	R	28.2	Very low	28.3	Very low	191 Å²	191	146 Å²	146	72%	0.721	73%	0.728	S	S	*	*			trans	-101.2	156.7	156.6	-65.3	173.7	172.2	169.3	-3.9	108.9	L972 T976	L972-R974 HydrophobicContact CD2-CG 3.87Å; R974-T976 HydrophobicContact CB-CG2 3.84Å
975	K	29	Very low	28.4	Very low	211 Å²	211	146.1 Å²	146.1	92%	0.917	73%	0.731	S	S	*	*			trans	-135.1	120	139.9	-67.9	-172.6	177.1	-179.1	0	105.7
976	T	29	Very low	28.6	Very low	87 Å²	87	148.5 Å²	148.5	53%	0.534	73%	0.733	S	S	.	*			cis	75.6	105.6	19.4	67.7	0	0	0	0	118.9	R974	R974-T976 HydrophobicContact CB-CG2 3.84Å
977	T	30.4	Very low	28.5	Very low	132 Å²	132	147.3 Å²	147.3	81%	0.81	73%	0.73	S	S	*	*			trans	-150.7	121.5	133.6	29.8	0	0	0	0	105.9
978	H	28.2	Very low	28.7	Very low	121 Å²	121	149.5 Å²	149.5	56%	0.56	74%	0.736	S	S	*	*				62.7	137.2	69.7	-62.1	-70.4	0	0	0	111.4	Y980	H978-Y980 AromaticContact CE1-CE2 3.95Å; H978-Y980 AromaticContact CE1-CZ 3.68Å; H978-Y980 PolarHBondContact CE1-OH 2.74Å; H978-Y980 VanDerWaalsContact CE1-OH 3.24Å; H978-Y980 AromaticContact ND1-CE2 3.33Å; H978-Y980 VanDerWaalsContact ND1-CE2 3.33Å; H978-Y980 WeakPolarHBondContact ND1-CE2 3.25Å; H978-Y980 AromaticContact ND1-CZ 3.35Å; H978-Y980 PolarHBondContact ND1-OH 2.78Å
979	I	28.7	Very low	28.6	Very low	162 Å²	162	148.6 Å²	148.6	83%	0.831	74%	0.739	S	S	*	*			cis	-154.4	157.4	40.1	-73.6	174.9	0	0	0	108.1
980	Y	27.3	Very low	28.4	Very low	179 Å²	179	147.9 Å²	147.9	70%	0.702	75%	0.746	S	S	*	*			cis	-171.3	-168.2	-33.5	-114	-36	0	0	0	108.7	H978	H978-Y980 AromaticContact CE1-CE2 3.95Å; H978-Y980 AromaticContact CE1-CZ 3.68Å; H978-Y980 PolarHBondContact CE1-OH 2.74Å; H978-Y980 VanDerWaalsContact CE1-OH 3.24Å; H978-Y980 AromaticContact ND1-CE2 3.33Å; H978-Y980 VanDerWaalsContact ND1-CE2 3.33Å; H978-Y980 WeakPolarHBondContact ND1-CE2 3.25Å; H978-Y980 AromaticContact ND1-CZ 3.35Å; H978-Y980 PolarHBondContact ND1-OH 2.78Å
981	P	36.7	Very low	28.3	Very low	105 Å²	105	148.8 Å²	148.8	68%	0.682	75%	0.751	S	S	*	*			trans	-126.9	-173.8	-149.2	46.6	-32.7	0	0	0	117.6
982	K	28.6	Very low	28.2	Very low	187 Å²	187	146.9 Å²	146.9	81%	0.813	75%	0.747	S	S	*	*			trans	-167.7	126.7	136.8	-104.8	168	-178.4	-175.1	0	110.5
983	L	26.1	Very low	27.8	Very low	151 Å²	151	149 Å²	149	79%	0.791	75%	0.754	S	S	*	*				66.4	140.2	101.1	-92.8	68.2	0	0	0	114.7
984	S	30.1	Very low	27.5	Very low	92 Å²	92	148.5 Å²	148.5	64%	0.643	74%	0.743	S	S	*	*			cis	-163.2	160.7	5.3	43.7	0	0	0	0	111.9
985	H	27.1	Very low	27.4	Very low	179 Å²	179	145.9 Å²	145.9	83%	0.829	74%	0.743	S	S	*	*			trans	18.6	142	155.9	-56.9	-71.5	0	0	0	120.1
986	I	29.9	Very low	27.2	Very low	159 Å²	159	142.5 Å²	142.5	82%	0.815	74%	0.735	S	S	*	*				-150.4	142	55.4	-72.5	156.9	0	0	0	111.5
987	D	23	Very low	26.9	Very low	142 Å²	142	145.4 Å²	145.4	76%	0.759	75%	0.746	S	S	*	*			trans	-107.3	150.3	158.6	-74.2	-64.2	0	0	0	109.4
988	Y	29.3	Very low	26.6	Very low	213 Å²	213	146.2 Å²	146.2	84%	0.835	75%	0.745	S	S	*	*			trans	167.3	94.7	147.1	-90.7	-59.1	0	0	0	108.9
989	T	23.9	Very low	26.3	Very low	108 Å²	108	144.9 Å²	144.9	66%	0.663	75%	0.749	S	S	*	*				80.3	109	97.6	56.2	0	0	0	0	118.1
990	L	22.8	Very low	26.1	Very low	152 Å²	152	142.5 Å²	142.5	80%	0.796	75%	0.747	S	S	*	*				64.3	146.2	127.8	-99.1	70.7	0	0	0	123.8
991	T	24.3	Very low	26	Very low	119 Å²	119	138.2 Å²	138.2	73%	0.73	74%	0.743	S	S	*	*			trans	79.6	96.6	144.3	43.4	0	0	0	0	122.6
992	N	24.5	Very low	25.4	Very low	136 Å²	136	143.6 Å²	143.6	73%	0.727	75%	0.75	S	S	*	*				91.5	156.1	105.1	-153.6	19.3	0	0	0	119.3
993	Q	26.8	Very low	25.2	Very low	168 Å²	168	141.3 Å²	141.3	79%	0.785	75%	0.747	S	S	*	*			trans	66.1	154.9	176.1	-65.5	178.7	-9.5	0	0	116.2
994	N	24.3	Very low	25.5	Very low	125 Å²	125	140.7 Å²	140.7	67%	0.668	74%	0.744	S	S	*	*			cis	-170.9	161.3	-43	-124.1	37.8	0	0	0	107.6
995	D	24.8	Very low	25.2	Very low	135 Å²	135	142.2 Å²	142.2	72%	0.722	74%	0.744	S	S	*	*			trans	69.2	152.4	149.8	-72.8	-52.7	0	0	0	123
996	L	25.4	Very low	25.3	Very low	141 Å²	141	142.5 Å²	142.5	74%	0.738	74%	0.74	S	S	*	*			trans	68	83.3	153.6	-68	164.6	0	0	0	122
997	L	23.1	Very low	25.1	Very low	148 Å²	148	141.3 Å²	141.3	78%	0.775	74%	0.735	S	S	*	*				59.1	165.8	109.9	-67.7	-175.6	0	0	0	123.3
998	L	23.7	Very low	25.4	Very low	148 Å²	148	141.6 Å²	141.6	78%	0.775	74%	0.741	S	S	*	*			trans	85.3	72.4	151.7	-75.8	149.4	0	0	0	121.2
999	S	22.2	Very low	25.3	Very low	93 Å²	93	138 Å²	138	65%	0.65	73%	0.732	S	S	*	*				79.6	161.8	116.3	82.9	0	0	0	0	121.5
1000	S	23.6	Very low	25.4	Very low	113 Å²	113	141.4 Å²	141.4	79%	0.79	73%	0.734	S	S	*	*			trans	73.6	142.5	151.3	-58.9	0	0	0	0	117.9
1001	S	25	Very low	25.5	Very low	89 Å²	89	141.3 Å²	141.3	62%	0.622	73%	0.73	S	S	*	*			cis	-165.8	149.4	-14.2	-169.9	0	0	0	0	111
1002	R	25.5	Very low	25.5	Very low	217 Å²	217	140.8 Å²	140.8	82%	0.819	73%	0.731	S	S	*	*			trans	49.3	121	152.6	-72.6	168.6	-174.4	164.3	1.7	122
1003	N	24.8	Very low	25.6	Very low	139 Å²	139	146 Å²	146	74%	0.743	74%	0.74	S	S	*	*				53.2	160.3	115.7	-53.5	7.3	0	0	0	123.5
1004	D	30.8	Very low	25.4	Very low	139 Å²	139	148.5 Å²	148.5	74%	0.743	74%	0.743	S	S	*	*			trans	98.3	140.4	156.8	-59.4	-10.9	0	0	0	118.4
1005	L	25	Very low	25.5	Very low	123 Å²	123	150.6 Å²	150.6	64%	0.644	75%	0.748	S	S	*	*			cis	-169.9	173.3	-34.8	-122.7	169.9	0	0	0	111.4
1006	Y	27.7	Very low	25.4	Very low	186 Å²	186	148.8 Å²	148.8	73%	0.729	75%	0.746	S	S	*	*			trans	73.7	99.2	158.6	-72.7	-62.6	0	0	0	124.6
1007	N	26	Very low	25.4	Very low	134 Å²	134	147.4 Å²	147.4	72%	0.717	75%	0.748	S	S	*	*				22.7	128.8	118.8	-51.7	-14.8	0	0	0	122.6
1008	V	30.7	Very low	25.5	Very low	148 Å²	148	148.9 Å²	148.9	90%	0.897	76%	0.756	S	S	*	*			trans	-150.6	159.2	141	-167.1	0	0	0	0	109.7
1009	Q	26.1	Very low	25.6	Very low	137 Å²	137	145.7 Å²	145.7	64%	0.64	76%	0.759	S	S	*	*				-156.4	126	-79	179.5	59.8	-28.7	0	0	113.7
1010	Y	25.9	Very low	25.8	Very low	180 Å²	180	153.1 Å²	153.1	71%	0.706	77%	0.773	S	S	*	*			trans	68.3	137.2	153.8	-88.5	-154.5	0	0	0	126.6
1011	Q	25.8	Very low	25.8	Very low	150 Å²	150	154 Å²	154	70%	0.701	77%	0.774	S	S	*	*			trans	84.5	104	132.5	-75.2	-176.1	12.3	0	0	125.4
1012	S	23.5	Very low	25.8	Very low	108 Å²	108	159 Å²	159	76%	0.755	78%	0.784	S	S	*	*				48.9	122.8	106.5	-55.1	0	0	0	0	122.9
1013	R	26	Very low	25.7	Very low	246 Å²	246	154.2 Å²	154.2	93%	0.928	78%	0.784	S	S	*	*				-165.4	164.1	104	-160.5	157.7	-76.1	-136.1	1	112.6
1014	R	24	Very low	25.8	Very low	220 Å²	220	154.2 Å²	154.2	83%	0.83	78%	0.782	S	S	*	*			trans	-66.9	162.2	170.4	-52.6	172.3	179.3	174.1	-2.7	109.8
1015	Q	24.9	Very low	25.4	Very low	168 Å²	168	154.9 Å²	154.9	79%	0.785	78%	0.778	S	S	*	*				177.5	161.5	56.1	-153.5	160.5	-5.8	0	0	112.6
1016	S	24.3	Very low	25.4	Very low	98 Å²	98	154.8 Å²	154.8	69%	0.685	78%	0.779	S	S	*	*			trans	57.5	110.3	150.7	54	0	0	0	0	123.9
1017	S	24.9	Very low	25.2	Very low	111 Å²	111	154.3 Å²	154.3	78%	0.776	79%	0.788	S	S	*	*				113.7	131.3	111.6	73.2	0	0	0	0	122
1018	L	24.2	Very low	25.7	Very low	180 Å²	180	152.5 Å²	152.5	94%	0.942	79%	0.786	S	S	*	*			trans	35.2	113.7	153.4	-94.4	60.8	0	0	0	121.7
1019	G	27.4	Very low	25.7	Very low	81 Å²	81	151.5 Å²	151.5	84%	0.835	78%	0.783	S	S	*	*			trans	-163.3	118.5	156.2	0	0	0	0	0	112.1
1020	R	24.9	Very low	25.9	Very low	248 Å²	248	153.6 Å²	153.6	94%	0.936	79%	0.792	S	S	*	*			trans	-85.3	124	173.1	-82.6	175.9	164	168	-5.7	110
1021	T	23.4	Very low	26.5	Very low	132 Å²	132	149.6 Å²	149.6	81%	0.81	79%	0.788	S	S	*	*			trans	-179.1	137.7	131.8	20.8	0	0	0	0	115
1022	K	25.6	Very low	26.6	Very low	195 Å²	195	153 Å²	153	85%	0.848	80%	0.795	S	S	*	*			trans	28	124.5	144	-61.1	178.7	178.8	178.8	0	122
1023	S	24.8	Very low	26.9	Very low	115 Å²	115	152.5 Å²	152.5	80%	0.804	78%	0.784	S	S	*	*			trans	90.2	163.8	135.7	-146.3	0	0	0	0	120.7
1024	I	25.4	Very low	26.9	Very low	140 Å²	140	150 Å²	150	72%	0.718	78%	0.775	S	S	*	*			trans	83.7	103.2	160.3	-66	176.2	0	0	0	119.8
1025	K	23.8	Very low	27	Very low	152 Å²	152	147 Å²	147	66%	0.661	77%	0.77	S	S	*	*				66.9	143.2	125.8	-69.5	-173.2	169.9	-161.9	0	126.1
1026	D	24.2	Very low	27	Very low	122 Å²	122	143.8 Å²	143.8	65%	0.652	75%	0.754	S	S	*	*			trans	74.7	131.5	130.2	-64	-5	0	0	0	126
1027	L	23.9	Very low	27.1	Very low	175 Å²	175	144.7 Å²	144.7	92%	0.916	75%	0.75	S	S	*	*			trans	83.9	163.9	139.7	-71.1	165.7	0	0	0	123.4
1028	S	35.3	Very low	27	Very low	97 Å²	97	143 Å²	143	68%	0.678	73%	0.733	S	S	*	*			trans	-109.7	162.8	-165.1	175.6	0	0	0	0	112.7
1029	P	32.1	Very low	27	Very low	127 Å²	127	136.1 Å²	136.1	83%	0.825	70%	0.7	S	S	*	*				-148.4	-163.7	115.1	37.3	-18.4	0	0	0	115.5
1030	Q	30.4	Very low	26.8	Very low	180 Å²	180	138.8 Å²	138.8	84%	0.841	70%	0.695	S	S	*	*			trans	-110.9	-130.4	-166.3	-65.2	-170.1	12.5	0	0	117.4
1031	P	37	Very low	26.8	Very low	97 Å²	97	134.3 Å²	134.3	63%	0.63	69%	0.688	S	S	*	*				-133.8	177.2	-114.9	43.1	-24.3	0	0	0	118.8
1032	R	27.9	Very low	27	Very low	221 Å²	221	134.2 Å²	134.2	83%	0.834	68%	0.681	S	S	*	*			trans	69.4	159.2	164.8	-64.4	-162.1	-145.7	-152.7	3.8	117.1
1033	D	29.4	Very low	26.9	Very low	98 Å²	98	130.3 Å²	130.3	52%	0.524	67%	0.669	S	S	.	*			cis	-157.3	160.1	-10.9	-108.1	-18.8	0	0	0	112.3
1034	W	27.5	Very low	27	Very low	194 Å²	194	130.2 Å²	130.2	74%	0.735	66%	0.66	S	S	*	*			trans	37.2	129.8	152.2	-68.6	56.2	0	0	0	124
1035	H	26.6	Very low	27.1	Very low	157 Å²	157	130.2 Å²	130.2	73%	0.727	66%	0.661	S	S	*	*				170.2	177.5	125.2	-93	-65.3	0	0	0	112	S54	S54-H1035 PolarHBondContact OG-O 3.15Å
1036	E	24.6	Very low	27.2	Very low	99 Å²	99	128.9 Å²	128.9	46%	0.463	66%	0.661	S	S	.	*			trans	-130	-128.9	172.5	-63.9	-158.5	144.8	0	0	112.5	P51 L52 S53	P51-E1036 WeakPolarHBondContact CA-OE2 3.46Å; P51-E1036 WeakPolarHBondContact CB-OE2 3.13Å; L52-E1036 VanDerWaalsContact C-CD 3.43Å; L52-E1036 VanDerWaalsContact N-CD 3.32Å; L52-E1036 PolarHBondContact N-OE2 2.88Å; L52-E1036 WeakPolarHBondContact O-CB 3.35Å; S53-E1036 VanDerWaalsContact N-CD 3.25Å; S53-E1036 PolarHBondContact N-OE1 2.85Å
1037	I	24.7	Very low	27.4	Very low	117 Å²	117	129.3 Å²	129.3	60%	0.6	66%	0.662	S	S	*	*			cis	-161.8	103.7	12.2	-141.3	155.4	0	0	0	111	S50	S50-I1037 CarbonylContact O-C 3.28Å; S50-I1037 VanDerWaalsContact O-C 3.28Å; S50-I1037 VanDerWaalsContact O-CG1 3.29Å; S50-I1037 WeakPolarHBondContact O-CG1 3.35Å
1038	N	23	Very low	27.4	Very low	77 Å²	77	127.4 Å²	127.4	41%	0.412	65%	0.653	S	S	.	*			trans	165.9	104.5	150.4	-102.2	-77.4	0	0	0	119	T49 S50 P51	T49-N1038 PolarHBondContact O-ND2 2.91Å; T49-N1038 PolarHBondContact O-OD1 2.85Å; S50-N1038 WeakPolarHBondContact CB-OD1 3.3Å; S50-N1038 VanDerWaalsContact O-CA 3.25Å; S50-N1038 WeakPolarHBondContact O-CA 3.18Å; S50-N1038 VanDerWaalsContact O-CG 3.29Å; S50-N1038 PolarHBondContact O-N 3.49Å; S50-N1038 PolarHBondContact O-ND2 3.45Å; P51-N1038 VanDerWaalsContact C-N 3.33Å; P51-N1038 CarbonylContact O-C 3.46Å
1039	S	24.4	Very low	27	Very low	35 Å²	35	126.2 Å²	126.2	25%	0.245	64%	0.638	C	S	.	*				56.1	140.1	103.6	102.6	0	0	0	0	125.2	P51	P51-S1039 PolarHBondContact O-N 3.31Å
1040	N	24.9	Very low	26.8	Very low	137 Å²	137	124.9 Å²	124.9	73%	0.733	62%	0.624	S	S	*	*			trans	66.6	179.7	149.1	-68.5	-33.4	0	0	0	118.9
1041	I	24.8	Very low	27	Very low	153 Å²	153	118.8 Å²	118.8	79%	0.785	60%	0.6	S	S	*	*			trans	79	118.2	166.7	-60.4	178.3	0	0	0	115.5
1042	I	25.8	Very low	26.4	Very low	131 Å²	131	119 Å²	119	67%	0.672	60%	0.596	S	S	*	*			cis	-163.6	156.5	-11.6	-139.5	168.5	0	0	0	113.9
1043	N	25.2	Very low	26.2	Very low	113 Å²	113	113.8 Å²	113.8	60%	0.604	58%	0.584	S	S	*	*			trans	63.5	119.3	153.3	-69.5	-16.3	0	0	0	124
1044	N	25.2	Very low	26	Very low	113 Å²	113	115.6 Å²	115.6	60%	0.604	59%	0.593	S	S	*	*				67	120.7	120.7	-51.3	-15.2	0	0	0	119
1045	N	28.4	Very low	26	Very low	139 Å²	139	112.7 Å²	112.7	74%	0.743	59%	0.592	S	S	*	*				-149	119.8	60.7	-95.5	-64.8	0	0	0	116
1046	N	25.8	Very low	25.9	Very low	124 Å²	124	112.9 Å²	112.9	66%	0.663	60%	0.595	S	S	*	*				62.1	144.1	123.1	-81.6	-44.4	0	0	0	123.4
1047	I	28.1	Very low	26.2	Very low	131 Å²	131	113.9 Å²	113.9	67%	0.672	60%	0.603	S	S	*	*			trans	68.5	86.5	163.7	-55.8	148.5	0	0	0	113.8	M1	M1-I1047 HydrophobicContact CE-CG2 4.3Å
1048	N	25.3	Very low	26.2	Very low	135 Å²	135	116.7 Å²	116.7	72%	0.722	62%	0.618	S	S	*	*			cis	75.8	162.2	37.5	-152.5	-4	0	0	0	114.2
1049	I	25.8	Very low	26.6	Very low	73 Å²	73	119 Å²	119	37%	0.374	63%	0.63	S	S	.	*			trans	79.5	110.9	-177	-49.1	167	0	0	0	111.6	M1 S2	M1-I1049 WeakPolarHBondContact CA-O 3.36Å; M1-I1049 VanDerWaalsContact CG-O 3.3Å; M1-I1049 WeakPolarHBondContact CG-O 3.22Å; M1-I1049 PolarHBondContact N-O 2.61Å; S2-I1049 WeakPolarHBondContact OG-CG2 3.47Å
1050	N	27.2	Very low	27.2	Very low	99 Å²	99	123 Å²	123	53%	0.529	66%	0.655	S	S	.	*			cis	81.6	141.1	17.6	-143.8	38.7	0	0	0	115.2	R3	R3-N1050 WeakPolarHBondContact CD-O 3.27Å; R3-N1050 PolarHBondContact N-O 3.47Å
1051	P	34.8	Very low	27.1	Very low	51 Å²	51	123.7 Å²	123.7	33%	0.331	66%	0.657	S	S	.	*			cis	-129.2	-127.8	-47.2	32.2	-9.3	0	0	0	110.9	S2 R3	S2-P1051 CarbonylContact C-O 3.55Å; S2-P1051 VanDerWaalsContact C-O 3.25Å; R3-P1051 VanDerWaalsContact CA-O 3.24Å; R3-P1051 WeakPolarHBondContact CA-O 3.4Å; R3-P1051 PolarHBondContact N-O 3.28Å
1052	D	24.4	Very low	27.1	Very low	103 Å²	103	125.7 Å²	125.7	55%	0.551	66%	0.663	S	S	*	*			trans	70.2	158.3	168.8	-49.8	-25.4	0	0	0	116.4	S4	S4-D1052 WeakPolarHBondContact CB-OD2 3.19Å
1053	I	25.5	Very low	27	Very low	111 Å²	111	124.9 Å²	124.9	57%	0.569	67%	0.665	S	S	*	*			cis	-131	153.7	15.6	-63.9	166.2	0	0	0	111.2
1054	N	24.6	Very low	26.8	Very low	136 Å²	136	125.2 Å²	125.2	73%	0.727	67%	0.671	S	S	*	*			trans	-92.9	148.8	170.4	-61.9	-82.5	0	0	0	112.5
1055	N	27.7	Very low	26.7	Very low	133 Å²	133	127.4 Å²	127.4	71%	0.711	68%	0.682	S	S	*	*			trans	58.4	112.8	153.6	-58.9	-3.8	0	0	0	120.5
1056	M	24.8	Very low	26.5	Very low	160 Å²	160	125.4 Å²	125.4	79%	0.788	68%	0.679	S	S	*	*			trans	-166.4	109.8	138.7	-99.4	169.2	-176.5	0	0	104.3
1057	I	29.2	Very low	26.4	Very low	121 Å²	121	128.3 Å²	128.3	62%	0.621	69%	0.685	S	S	*	*			cis	63.4	103.6	44.9	-50.6	-178.7	0	0	0	112.3
1058	L	24.9	Very low	26.2	Very low	175 Å²	175	129.2 Å²	129.2	92%	0.916	69%	0.692	S	S	*	*			trans	-138.4	85.8	154.9	-86.1	176.9	0	0	0	108.3
1059	D	31.3	Very low	26.5	Very low	126 Å²	126	132.8 Å²	132.8	67%	0.674	70%	0.701	S	S	*	*			trans	-76.9	-168.9	151.8	-61.1	-58.5	0	0	0	108.6
1060	P	37.3	Very low	26.5	Very low	119 Å²	119	137.9 Å²	137.9	77%	0.773	72%	0.72	S	S	*	*				-124.9	130.5	-70.1	34	-20.2	0	0	0	110.6
1061	I	22.8	Very low	26.5	Very low	151 Å²	151	140.8 Å²	140.8	77%	0.774	73%	0.734	S	S	*	*			trans	-133.4	112.8	-179.7	-63.5	-176.4	0	0	0	111.9	T1063	I1061-T1063 WeakPolarHBondContact CG2-OG1 3.01Å
1062	E	25	Very low	26.1	Very low	195 Å²	195	144 Å²	144	91%	0.911	75%	0.749	S	S	*	*			trans	-68.6	122.1	151.5	-60.4	179.6	118.3	0	0	108.8
1063	T	23	Very low	26.3	Very low	115 Å²	115	150.6 Å²	150.6	71%	0.706	77%	0.767	S	S	*	*			trans	-162.3	98.1	147.5	1.9	0	0	0	0	112	I1061	I1061-T1063 WeakPolarHBondContact CG2-OG1 3.01Å
1064	T	21.9	Very low	26.2	Very low	119 Å²	119	152.1 Å²	152.1	73%	0.73	78%	0.775	S	S	*	*			trans	-2.5	121.2	135.2	56.3	0	0	0	0	117
1065	L	22.4	Very low	26.3	Very low	160 Å²	160	152.6 Å²	152.6	84%	0.838	78%	0.778	S	S	*	*				-170.2	158.8	113.2	-122.8	74.5	0	0	0	114
1066	S	24.1	Very low	26.2	Very low	96 Å²	96	156.1 Å²	156.1	67%	0.671	78%	0.783	S	S	*	*			trans	55.9	84.8	157.8	54.6	0	0	0	0	121.7
1067	K	24.7	Very low	26.2	Very low	185 Å²	185	155.6 Å²	155.6	80%	0.804	78%	0.782	S	S	*	*				59.7	122.6	111.9	-69.1	174.6	179.3	177.5	0	121.6
1068	N	24	Very low	26	Very low	150 Å²	150	156.5 Å²	156.5	80%	0.802	79%	0.787	S	S	*	*			trans	71.9	123.4	141.5	-51.9	-12.3	0	0	0	117.6
1069	K	32	Very low	26.1	Very low	210 Å²	210	153.6 Å²	153.6	91%	0.913	78%	0.777	S	S	*	*			cis	-134.8	142.6	33.7	-69.9	173.2	175.1	174.2	0	113.6
1070	K	24.5	Very low	25.9	Very low	180 Å²	180	156.6 Å²	156.6	78%	0.783	78%	0.784	S	S	*	*			trans	-93	162.9	163	-70.9	-174.4	174.8	-173.6	0	110.8
1071	I	28.5	Very low	25.3	Very low	160 Å²	160	160 Å²	160	82%	0.821	78%	0.783	S	S	*	*			trans	173.4	96.7	133.4	-88	151.1	0	0	0	104.8
1072	N	25.3	Very low	25.6	Very low	119 Å²	119	158.6 Å²	158.6	64%	0.636	78%	0.777	S	S	*	*				79	108.6	72.5	-75.4	20.2	0	0	0	113.6
1073	Y	27.7	Very low	25.7	Very low	241 Å²	241	153.4 Å²	153.4	95%	0.945	76%	0.755	S	S	*	*				-153.5	101.2	129.9	-116.4	-73.4	0	0	0	109.8
1074	I	25.1	Very low	26	Very low	144 Å²	144	151.1 Å²	151.1	74%	0.738	74%	0.738	S	S	*	*			trans	-143.7	149.4	174.4	-84.1	179.9	0	0	0	105.7
1075	D	26	Very low	26.3	Very low	146 Å²	146	149.6 Å²	149.6	78%	0.781	73%	0.725	S	S	*	*			trans	62.7	100.3	174.2	-57.4	-22.9	0	0	0	119
1076	Y	25.3	Very low	26.7	Very low	207 Å²	207	144.9 Å²	144.9	81%	0.812	70%	0.7	S	S	*	*				-169.8	139.8	129.2	-119.8	-125.6	0	0	0	106.1
1077	I	26.1	Very low	27.1	Very low	149 Å²	149	144.4 Å²	144.4	76%	0.764	69%	0.69	S	S	*	*			cis	-137.3	130.8	26.1	-62.1	154.3	0	0	0	110.5
1078	D	25	Very low	27.4	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	68%	0.683	S	S	*	*			trans	-154.4	159.2	136.9	-158.2	3.3	0	0	0	111.3
1079	T	26.3	Very low	27.6	Very low	115 Å²	115	140.2 Å²	140.2	71%	0.706	68%	0.677	S	S	*	*			trans	62.5	97	170.6	68	0	0	0	0	117.7
1080	K	27.8	Very low	27.6	Very low	189 Å²	189	136.8 Å²	136.8	82%	0.822	67%	0.669	S	S	*	*			trans	-155.9	95.7	141.2	-125.5	154.9	-167.1	149.5	0	116
1081	Y	24.9	Very low	27.9	Very low	190 Å²	190	136.4 Å²	136.4	75%	0.745	67%	0.67	S	S	*	*			trans	-100.8	163.3	156.7	-113.6	-97.8	0	0	0	110.9
1082	N	27.2	Very low	28.1	Very low	121 Å²	121	132.7 Å²	132.7	65%	0.647	66%	0.656	S	S	*	*			trans	79.8	117	160.5	-70.5	-27.1	0	0	0	122
1083	I	28.6	Very low	28.3	Very low	87 Å²	87	136.1 Å²	136.1	45%	0.446	67%	0.665	S	S	.	*			trans	69.9	94.3	140.9	-50.1	160.7	0	0	0	116.5
1084	I	28.4	Very low	28.3	Very low	67 Å²	67	129 Å²	129	34%	0.344	65%	0.65	S	S	.	*				81.1	140.8	55.8	-57	161.1	0	0	0	113.1	I1111 L1114	I1084-I1111 HydrophobicContact CG1-CG2 4.11Å; I1084-L1114 HydrophobicContact CG2-CB 3.77Å; I1084-L1114 HydrophobicContact CG2-CD1 4.11Å; I1084-L1114 HydrophobicContact CG2-CD2 4.3Å; I1084-L1114 HydrophobicContact CG2-CG 4.29Å
1085	N	29.3	Very low	28.4	Very low	86 Å²	86	129.7 Å²	129.7	46%	0.46	65%	0.654	S	S	.	*			trans	102.7	138.1	167.5	-141.3	36	0	0	0	116.3	L1114 P1115	N1085-L1114 WeakPolarHBondContact OD1-CB 3.45Å; N1085-P1115 VanDerWaalsContact OD1-CB 3.26Å; N1085-P1115 WeakPolarHBondContact OD1-CB 3.3Å; N1085-P1115 WeakPolarHBondContact OD1-CG 2.96Å
1086	N	30.7	Very low	28.4	Very low	61 Å²	61	126.7 Å²	126.7	33%	0.326	65%	0.645	S	S	.	*			cis	-157.7	157.9	-3.7	-153	27.8	0	0	0	115.3	Q1113 L1114 P1115	N1086-Q1113 PolarHBondContact O-OE1 2.91Å; N1086-L1114 PolarHBondContact OD1-O 3.25Å; N1086-P1115 WeakPolarHBondContact ND2-CD 3.47Å; N1086-P1115 VanDerWaalsContact ND2-CG 3.32Å; N1086-P1115 WeakPolarHBondContact ND2-CG 3.43Å; N1086-P1115 WeakPolarHBondContact OD1-CD 3.43Å
1087	N	31.9	Very low	28.5	Very low	86 Å²	86	123.3 Å²	123.3	46%	0.46	64%	0.64	S	S	.	*			trans	30.5	151.2	144.4	-70.1	8.5	0	0	0	122.7	Q1113	N1087-Q1113 VanDerWaalsContact N-OE1 3.11Å
1088	N	30.3	Very low	28.6	Very low	122 Å²	122	121.8 Å²	121.8	65%	0.652	63%	0.634	S	S	*	*			cis	-164.1	171.3	8.6	-125.8	4.1	0	0	0	114.9
1089	N	29	Very low	28.6	Very low	125 Å²	125	121.8 Å²	121.8	67%	0.668	63%	0.633	S	S	*	*			trans	85.5	134	144.5	-73.3	9.1	0	0	0	123.5
1090	N	31.1	Very low	28.6	Very low	139 Å²	139	122 Å²	122	74%	0.743	63%	0.629	S	S	*	*			trans	74.4	113.5	157.8	-53.1	-5.9	0	0	0	118.1
1091	E	30.8	Very low	28.4	Very low	172 Å²	172	122.5 Å²	122.5	80%	0.804	63%	0.628	S	S	*	*			cis	87.9	151.1	40	-77.1	-131.6	122.3	0	0	115.1
1092	P	32.9	Very low	28.6	Very low	81 Å²	81	119 Å²	119	53%	0.526	62%	0.622	S	S	.	*			cis	-142.9	-164.4	-31.3	37.2	-17.5	0	0	0	114
1093	K	29.6	Very low	28.7	Very low	192 Å²	192	120.2 Å²	120.2	84%	0.835	63%	0.628	S	S	*	*			trans	84.1	142.5	158.8	-68.5	163.3	-175.8	175.6	0	118.3
1094	S	27.5	Very low	28.6	Very low	90 Å²	90	118.9 Å²	118.9	63%	0.629	64%	0.636	S	S	*	*			cis	-171.6	156.9	-9.1	47.5	0	0	0	0	114
1095	I	27	Very low	28.4	Very low	159 Å²	159	124.8 Å²	124.8	82%	0.815	66%	0.655	S	S	*	*			trans	71.9	130.7	148.8	-74.6	158.7	0	0	0	116.4
1096	S	27.2	Very low	28.2	Very low	84 Å²	84	128.3 Å²	128.3	59%	0.587	66%	0.663	S	S	*	*			cis	-167.9	151.1	-10.1	56.1	0	0	0	0	111.7
1097	N	26	Very low	27.9	Very low	135 Å²	135	131.3 Å²	131.3	72%	0.722	69%	0.689	S	S	*	*			trans	53.1	136.9	130.3	-67.3	45.3	0	0	0	120.2
1098	D	28.2	Very low	27.4	Very low	117 Å²	117	135.7 Å²	135.7	63%	0.626	70%	0.7	S	S	*	*			cis	-160.5	147.8	29.7	-103.7	-26.6	0	0	0	113.1
1099	L	26.2	Very low	27.2	Very low	140 Å²	140	136 Å²	136	73%	0.733	70%	0.701	S	S	*	*			trans	59.1	153.5	132.8	-55	172.7	0	0	0	120.9
1100	L	25.2	Very low	27	Very low	120 Å²	120	135.6 Å²	135.6	63%	0.628	70%	0.699	S	S	*	*			cis	-155.5	114.6	-2.5	-142	146.5	0	0	0	110.7
1101	Y	25.4	Very low	26.8	Very low	199 Å²	199	132.2 Å²	132.2	78%	0.78	68%	0.681	S	S	*	*			trans	61.5	156.2	158	-69.7	-140.5	0	0	0	116.6
1102	N	27.9	Very low	26.6	Very low	117 Å²	117	132 Å²	132	63%	0.626	68%	0.677	S	S	*	*			cis	-147.9	148.3	12	-126.2	-23.3	0	0	0	110.3
1103	N	30	Very low	26.3	Very low	145 Å²	145	133 Å²	133	78%	0.775	68%	0.675	S	S	*	*			trans	15.5	131.9	154.1	-43.6	-35.3	0	0	0	119.6
1104	G	25.9	Very low	26.1	Very low	59 Å²	59	127.4 Å²	127.4	61%	0.608	65%	0.654	S	S	*	*			cis	161.3	133.9	4.4	0	0	0	0	0	108.8
1105	Y	24.8	Very low	26.3	Very low	191 Å²	191	125 Å²	125	75%	0.749	64%	0.636	S	S	*	*				71.5	129.9	83.9	-73.8	-39.3	0	0	0	114
1106	Y	25.4	Very low	26.3	Very low	161 Å²	161	121.2 Å²	121.2	63%	0.631	62%	0.624	S	S	*	*			cis	-144.5	149.3	6.8	-89.3	-69.9	0	0	0	112	Y1108	Y1106-Y1108 AromaticContact CD1-CD2 3.76Å; Y1106-Y1108 HydrophobicContact CD1-CD2 3.76Å; Y1106-Y1108 HydrophobicContact CD1-CG 4.29Å; Y1106-Y1108 HydrophobicContact CE1-CD2 4.13Å
1107	S	22.7	Very low	26.3	Very low	123 Å²	123	121.2 Å²	121.2	86%	0.86	62%	0.617	S	S	*	*			trans	-108.7	95.4	143.5	-173.3	0	0	0	0	108.3
1108	Y	23.4	Very low	26.5	Very low	179 Å²	179	123.1 Å²	123.1	70%	0.702	62%	0.619	S	S	*	*			trans	-164.5	151.8	178.7	-99.4	-83.9	0	0	0	104.1	Y1106	Y1106-Y1108 AromaticContact CD1-CD2 3.76Å; Y1106-Y1108 HydrophobicContact CD1-CD2 3.76Å; Y1106-Y1108 HydrophobicContact CD1-CG 4.29Å; Y1106-Y1108 HydrophobicContact CE1-CD2 4.13Å
1109	N	25.4	Very low	26.5	Very low	127 Å²	127	123.6 Å²	123.6	68%	0.679	62%	0.62	S	S	*	*			cis	-159.4	150.8	33.6	-133.6	-47.9	0	0	0	110.1
1110	N	24.9	Very low	26.5	Very low	117 Å²	117	125.8 Å²	125.8	63%	0.626	62%	0.624	S	S	*	*			trans	179.6	133.1	157	-94.9	-22.8	0	0	0	108.3
1111	I	25.8	Very low	26.7	Very low	69 Å²	69	125.4 Å²	125.4	35%	0.354	62%	0.622	S	S	.	*			cis	-156.2	135.9	4.6	-92.1	149	0	0	0	108.4	I1084	I1084-I1111 HydrophobicContact CG1-CG2 4.11Å
1112	K	26.7	Very low	26.8	Very low	167 Å²	167	123.4 Å²	123.4	73%	0.726	62%	0.62	S	S	*	*				171.7	139.2	125.9	-108.5	131.5	-169.6	173.5	0	116.9
1113	Q	26.5	Very low	26.9	Very low	103 Å²	103	122.6 Å²	122.6	48%	0.481	62%	0.624	S	S	.	*			trans	89.2	156.1	161.7	-59.1	171.5	76.3	0	0	118.2	N1086 N1087	N1086-Q1113 PolarHBondContact O-OE1 2.91Å; N1087-Q1113 VanDerWaalsContact N-OE1 3.11Å
1114	L	26.6	Very low	26.9	Very low	74 Å²	74	122.9 Å²	122.9	39%	0.387	63%	0.625	S	S	.	*			trans	-152.1	-132.6	-156.5	-143.3	73.6	0	0	0	111.8	I1084 N1085 N1086 N1215 P1216	I1084-L1114 HydrophobicContact CG2-CB 3.77Å; I1084-L1114 HydrophobicContact CG2-CD1 4.11Å; I1084-L1114 HydrophobicContact CG2-CD2 4.3Å; I1084-L1114 HydrophobicContact CG2-CG 4.29Å; N1085-L1114 WeakPolarHBondContact OD1-CB 3.45Å; N1086-L1114 PolarHBondContact OD1-O 3.25Å; L1114-N1215 HydrophobicContact CD2-CB 4.31Å; L1114-P1216 HydrophobicContact CD2-CB 4.22Å
1115	P	32.1	Very low	27	Very low	40 Å²	40	125.5 Å²	125.5	26%	0.26	63%	0.629	S	S	.	*			cis	-136.6	-163	-13	41.2	-19.5	0	0	0	116.3	N1085 N1086 P1216	N1085-P1115 VanDerWaalsContact OD1-CB 3.26Å; N1085-P1115 WeakPolarHBondContact OD1-CB 3.3Å; N1085-P1115 WeakPolarHBondContact OD1-CG 2.96Å; N1086-P1115 WeakPolarHBondContact ND2-CD 3.47Å; N1086-P1115 VanDerWaalsContact ND2-CG 3.32Å; N1086-P1115 WeakPolarHBondContact ND2-CG 3.43Å; N1086-P1115 WeakPolarHBondContact OD1-CD 3.43Å; P1115-P1216 HydrophobicContact CB-CG 4.24Å
1116	S	26.7	Very low	27.3	Very low	79 Å²	79	122.3 Å²	122.3	55%	0.552	63%	0.63	S	S	*	*			trans	76.2	138.9	147.4	-72.1	0	0	0	0	119.8
1117	N	27	Very low	27.3	Very low	84 Å²	84	120.1 Å²	120.1	45%	0.449	63%	0.633	S	S	.	*			cis	-170.5	169.7	-18.4	-151.5	-31.3	0	0	0	110.1
1118	K	30.4	Very low	27.4	Very low	174 Å²	174	121.4 Å²	121.4	76%	0.757	63%	0.63	S	S	*	*			trans	82.6	149.8	165.3	-59.4	-175.9	175.9	-178.3	0	119.6
1119	I	28	Very low	27.8	Very low	128 Å²	128	120.6 Å²	120.6	66%	0.656	64%	0.636	S	S	*	*			cis	-166.3	135.3	-20.9	-108.7	166.2	0	0	0	109.4
1120	F	26.2	Very low	27.7	Very low	185 Å²	185	123 Å²	123	81%	0.811	64%	0.643	S	S	*	*			trans	53.7	160.3	153.2	-72.8	-115.5	0	0	0	120.1
1121	N	28.8	Very low	27.7	Very low	112 Å²	112	121.8 Å²	121.8	60%	0.599	64%	0.639	S	S	*	*			cis	-153.1	144.2	25.3	-163.1	20.6	0	0	0	116.8
1122	Q	27.9	Very low	27.6	Very low	157 Å²	157	126 Å²	126	73%	0.734	66%	0.663	S	S	*	*			trans	58.5	126.8	147.9	-90.2	161.2	-6.2	0	0	126.1
1123	S	30.3	Very low	27.5	Very low	100 Å²	100	122 Å²	122	70%	0.699	66%	0.656	S	S	*	*			trans	85.9	138.2	136	81.1	0	0	0	0	119.6
1124	N	28.8	Very low	27.5	Very low	151 Å²	151	123.3 Å²	123.3	81%	0.807	68%	0.676	S	S	*	*			cis	-163.2	164	-13.9	-120.8	-5.7	0	0	0	113.8
1125	V	29.4	Very low	27.4	Very low	115 Å²	115	128.7 Å²	128.7	70%	0.697	69%	0.693	S	S	*	*			trans	75	96	153.8	173	0	0	0	0	119.4
1126	T	29.7	Very low	27.1	Very low	124 Å²	124	136 Å²	136	76%	0.761	72%	0.716	S	S	*	*				70.9	142.8	116.4	-53.3	0	0	0	0	122.1
1127	T	26.4	Very low	27	Very low	114 Å²	114	139.4 Å²	139.4	70%	0.699	73%	0.729	S	S	*	*			cis	-164.7	174.8	-40.9	-38.9	0	0	0	0	107.3
1128	L	25.3	Very low	27.1	Very low	151 Å²	151	143.1 Å²	143.1	79%	0.791	75%	0.747	S	S	*	*			trans	74.6	74.8	154	-76.6	159.2	0	0	0	119	H1130	L1128-H1130 PolarHBondContact O-N 2.97Å
1129	I	30.2	Very low	26.8	Very low	161 Å²	161	138.4 Å²	138.4	83%	0.826	74%	0.736	S	S	*	*				4.1	111.7	129.5	-51.1	171	0	0	0	115.5
1130	H	24	Very low	26.6	Very low	179 Å²	179	140.7 Å²	140.7	83%	0.829	75%	0.749	S	S	*	*			trans	-156.8	164	144.5	-126	-91.7	0	0	0	110.4	L1128 N1132	L1128-H1130 PolarHBondContact O-N 2.97Å; H1130-N1132 PolarHBondContact O-N 3.4Å
1131	T	25	Very low	26.6	Very low	90 Å²	90	136.7 Å²	136.7	55%	0.552	74%	0.744	S	S	*	*			trans	-65.1	128.6	177.6	56.7	0	0	0	0	111.9
1132	N	23.1	Very low	26.5	Very low	157 Å²	157	140 Å²	140	84%	0.84	76%	0.758	S	S	*	*			trans	-163.7	165.9	141.4	-109.1	-22.9	0	0	0	116.3	H1130	H1130-N1132 PolarHBondContact O-N 3.4Å
1133	S	24.9	Very low	26.3	Very low	85 Å²	85	141.2 Å²	141.2	59%	0.594	77%	0.766	S	S	*	*			trans	-40.8	139.1	179.2	52.3	0	0	0	0	118.9
1134	S	26.6	Very low	26	Very low	129 Å²	129	141.1 Å²	141.1	90%	0.902	77%	0.771	S	S	*	*			trans	-88.4	88.1	140.2	-55.7	0	0	0	0	109.1
1135	Y	25	Very low	25.8	Very low	187 Å²	187	142.5 Å²	142.5	73%	0.733	77%	0.773	S	S	*	*			trans	-145.3	145.8	173.4	-127.2	-84.5	0	0	0	108.9
1136	Y	25.7	Very low	25.5	Very low	193 Å²	193	142.4 Å²	142.4	76%	0.757	77%	0.773	S	S	*	*			trans	61.3	103.8	-177.8	-66.5	-77.9	0	0	0	117.6
1137	N	25	Very low	25.2	Very low	152 Å²	152	141.3 Å²	141.3	81%	0.813	77%	0.77	S	S	*	*				-164.1	64.1	126.9	-107.5	-22.2	0	0	0	114.3
1138	I	28.2	Very low	25	Very low	162 Å²	162	141 Å²	141	83%	0.831	77%	0.773	S	S	*	*	S	Bend	trans	-128.8	73.7	136.8	-59.3	-178	0	0	0	104.4
1139	S	23.6	Very low	24.9	Very low	74 Å²	74	138.9 Å²	138.9	52%	0.517	77%	0.769	S	S	.	*				67.7	99.4	86.2	74.4	0	0	0	0	112.6	S1141	S1139-S1141 PolarHBondContact O-N 3.08Å
1140	N	24.6	Very low	24.6	Very low	177 Å²	177	136.7 Å²	136.7	95%	0.947	76%	0.764	S	S	*	*			trans	-61.9	117.5	166.6	-72.9	-40	0	0	0	109.5
1141	S	25.7	Very low	24.6	Very low	101 Å²	101	134 Å²	134	71%	0.706	76%	0.76	S	S	*	*			trans	-150.1	146	168	-171.9	0	0	0	0	108.2	S1139	S1139-S1141 PolarHBondContact O-N 3.08Å
1142	M	26.8	Very low	24.7	Very low	180 Å²	180	134.9 Å²	134.9	89%	0.887	77%	0.77	S	S	*	*			trans	53.9	71.8	-164	-59.1	-177.3	173.8	0	0	111.4
1143	M	24.8	Very low	24.8	Very low	183 Å²	183	133.4 Å²	133.4	90%	0.901	77%	0.767	S	S	*	*			cis	57.3	124.7	42.5	-148.7	179.5	-159.4	0	0	111.9	Q1145	M1143-Q1145 PolarHBondContact O-N 3.35Å
1144	A	24	Very low	25	Very low	98 Å²	98	134.9 Å²	134.9	81%	0.81	78%	0.777	S	S	*	*			trans	-72.2	121.9	-167.6	0	0	0	0	0	113.2
1145	Q	24	Very low	25	Very low	180 Å²	180	134.1 Å²	134.1	84%	0.841	77%	0.772	S	S	*	*			trans	-127.5	96.4	157.8	-74.7	-168.6	2.3	0	0	106.9	M1143	M1143-Q1145 PolarHBondContact O-N 3.35Å
1146	T	23.2	Very low	25.4	Very low	113 Å²	113	130.8 Å²	130.8	69%	0.693	77%	0.773	S	S	*	*				76.5	109.8	91.9	54.9	0	0	0	0	113.8
1147	S	23.5	Very low	25.6	Very low	101 Å²	101	127.2 Å²	127.2	71%	0.706	78%	0.776	S	S	*	*			trans	55.3	123.3	141.5	61.9	0	0	0	0	121.5
1148	S	22.9	Very low	25.8	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	77%	0.771	S	S	*	*			trans	76.4	171.2	130.8	79.5	0	0	0	0	120.3
1149	C	22.8	Very low	25.8	Very low	106 Å²	106	127.2 Å²	127.2	72%	0.716	77%	0.771	S	S	*	*			trans	61.5	93.6	179.2	-58.5	0	0	0	0	116.5
1150	T	24	Very low	25.8	Very low	116 Å²	116	130.4 Å²	130.4	71%	0.712	78%	0.778	S	S	*	*				79.1	118.4	58.9	70.1	0	0	0	0	116.3
1151	T	24.1	Very low	25.9	Very low	123 Å²	123	127.9 Å²	127.9	76%	0.755	77%	0.765	S	S	*	*			trans	48.4	112.5	139.6	60.8	0	0	0	0	121.1
1152	S	26.6	Very low	26	Very low	108 Å²	108	129.5 Å²	129.5	76%	0.755	77%	0.77	S	S	*	*				-175	102.1	123.1	24.7	0	0	0	0	109
1153	T	25.5	Very low	26	Very low	126 Å²	126	126.2 Å²	126.2	77%	0.773	76%	0.764	S	S	*	*				83.7	148.2	75.2	54	0	0	0	0	115.1
1154	S	29.2	Very low	26.2	Very low	116 Å²	116	122.8 Å²	122.8	81%	0.811	76%	0.758	S	S	*	*			trans	78.3	141.6	176.5	76.2	0	0	0	0	117.7
1155	S	26	Very low	26.3	Very low	112 Å²	112	126.5 Å²	126.5	78%	0.783	76%	0.764	S	S	*	*				-173.8	-159.1	-57.6	52.6	0	0	0	0	109.2
1156	P	32.5	Very low	26.4	Very low	118 Å²	118	121.7 Å²	121.7	77%	0.766	76%	0.755	S	S	*	*				-136.2	143.1	-106.7	40	-19.9	0	0	0	117.7
1157	S	30.5	Very low	26.7	Very low	117 Å²	117	123.2 Å²	123.2	82%	0.818	75%	0.754	S	S	*	*			trans	-178.8	147.3	156.4	49.8	0	0	0	0	110.7
1158	S	30.1	Very low	27	Very low	100 Å²	100	122.9 Å²	122.9	70%	0.699	76%	0.758	S	S	*	*			cis	-166.6	145.9	-17	47.3	0	0	0	0	109.8
1159	Y	27	Very low	27.4	Very low	214 Å²	214	124.1 Å²	124.1	84%	0.839	76%	0.761	S	S	*	*			trans	3.4	149.4	155	-61	-91.4	0	0	0	121.6
1160	Q	25	Very low	27.6	Very low	142 Å²	142	123.5 Å²	123.5	66%	0.664	75%	0.746	S	S	*	*			cis	-177.4	148.4	-22.7	-149.9	-179.6	27.6	0	0	108.9
1161	N	25.9	Very low	27.7	Very low	124 Å²	124	122.4 Å²	122.4	66%	0.663	74%	0.743	S	S	*	*			trans	67.5	158.7	176.9	-40	-62.3	0	0	0	113.5
1162	V	28.3	Very low	28	Very low	134 Å²	134	124.3 Å²	124.3	81%	0.812	75%	0.747	S	S	*	*			cis	-131.4	156.6	14	-177.9	0	0	0	0	111.2	S1164	V1162-S1164 PolarHBondContact O-N 3.16Å
1163	S	26.3	Very low	28	Very low	111 Å²	111	125.7 Å²	125.7	78%	0.776	75%	0.746	S	S	*	*			trans	-50.2	121.7	177.9	-40.2	0	0	0	0	116.4
1164	S	28.5	Very low	28.3	Very low	111 Å²	111	126.4 Å²	126.4	78%	0.776	75%	0.745	S	S	*	*			trans	175	157.3	137.9	49.6	0	0	0	0	111.5	V1162	V1162-S1164 PolarHBondContact O-N 3.16Å
1165	L	26.1	Very low	28.3	Very low	176 Å²	176	126.7 Å²	126.7	92%	0.921	74%	0.737	S	S	*	*			trans	-143.6	77.6	152.9	-168.6	67.5	0	0	0	109.8
1166	A	27.3	Very low	28.5	Very low	79 Å²	79	129.4 Å²	129.4	65%	0.653	74%	0.735	S	S	*	*			trans	-110.8	158	153.1	0	0	0	0	0	107.8
1167	E	27.8	Very low	28.3	Very low	146 Å²	146	130 Å²	130	68%	0.682	73%	0.731	S	S	*	*			trans	55.6	95.1	172.7	-60.4	-164.6	169.3	0	0	118.4	S901	S901-E1167 VanDerWaalsContact CB-OE2 3.27Å; S901-E1167 WeakPolarHBondContact CB-OE2 3.35Å; S901-E1167 PolarHBondContact OG-OE2 3.08Å
1168	A	29.8	Very low	28.1	Very low	94 Å²	94	129.6 Å²	129.6	78%	0.777	72%	0.72	S	S	*	*			trans	-132.1	140.8	134.5	0	0	0	0	0	107.1
1169	T	32.2	Very low	27.9	Very low	134 Å²	134	132.2 Å²	132.2	82%	0.822	72%	0.719	S	S	*	*			cis	-128.1	154.4	13	42	0	0	0	0	113.5
1170	K	26.5	Very low	27.9	Very low	93 Å²	93	125.2 Å²	125.2	40%	0.404	70%	0.701	S	S	.	*			trans	-110.2	119.8	166	-78.4	-179.3	144.7	-179.3	0	110.8	Q900 S901 S902	Q900-K1170 HydrophobicContact CG-CD 4.49Å; Q900-K1170 HydrophobicContact CG-CG 4.05Å; S901-K1170 PolarHBondContact O-NZ 2.88Å; S901-K1170 VanDerWaalsContact OG-CE 3.25Å; S901-K1170 WeakPolarHBondContact OG-CE 3.29Å; S902-K1170 PolarHBondContact OG-NZ 3.41Å
1171	S	27.2	Very low	28	Very low	93 Å²	93	121.7 Å²	121.7	65%	0.65	69%	0.692	S	S	*	*			trans	-174.8	155.4	154.3	45.2	0	0	0	0	109.2
1172	L	29.9	Very low	28.1	Very low	162 Å²	162	119.4 Å²	119.4	85%	0.848	68%	0.68	S	S	*	*			trans	57.2	89.6	-177.6	-55.3	171.5	0	0	0	113
1173	N	26.9	Very low	28	Very low	137 Å²	137	117 Å²	117	73%	0.733	67%	0.669	S	S	*	*			cis	63.7	94.3	39.8	-166	13.5	0	0	0	114.3
1174	L	30.3	Very low	27.9	Very low	142 Å²	142	117 Å²	117	74%	0.743	67%	0.669	S	S	*	*			trans	170.1	122.4	138.1	-91.6	160.2	0	0	0	111.5
1175	N	29.1	Very low	27.9	Very low	122 Å²	122	116.3 Å²	116.3	65%	0.652	66%	0.664	S	S	*	*			trans	35.5	150.4	147.9	-61.1	-40.9	0	0	0	122.8
1176	K	31.8	Very low	27.8	Very low	169 Å²	169	116.2 Å²	116.2	74%	0.735	66%	0.659	S	S	*	*			cis	-171.1	156.4	-14.5	-109	167.5	-175.4	172.9	0	108.4
1177	N	27.3	Very low	27.8	Very low	129 Å²	129	117.9 Å²	117.9	69%	0.69	66%	0.661	S	S	*	*			trans	-1	149.9	158.3	-48	-14.3	0	0	0	120.1
1178	L	26.3	Very low	27.6	Very low	109 Å²	109	117.1 Å²	117.1	57%	0.571	66%	0.66	S	S	*	*				-171.5	144.7	68.1	-96.9	103.8	0	0	0	115.2	L893 S895	L893-L1178 VanDerWaalsContact O-O 3.12Å; S895-L1178 PolarHBondContact OG-N 2.91Å; S895-L1178 PolarHBondContact OG-O 2.79Å
1179	F	27.4	Very low	27.5	Very low	155 Å²	155	120 Å²	120	68%	0.68	66%	0.662	S	S	*	*			trans	50.5	79.2	133.9	-72.6	-96.9	0	0	0	128.2	L893	L893-F1179 CarbonylContact C-O 3.49Å; L893-F1179 WeakPolarHBondContact CA-O 3.39Å; L893-F1179 PolarHBondContact N-O 3.35Å; L893-F1179 VanDerWaalsContact N-O 3.11Å; L893-F1179 CarbonylContact O-C 3.58Å
1180	S	27.1	Very low	27.1	Very low	68 Å²	68	123.4 Å²	123.4	48%	0.476	66%	0.659	S	S	.	*				34.9	132.7	126	60.9	0	0	0	0	124.5	G892 L893	G892-S1180 CarbonylContact C-O 3.22Å; G892-S1180 WeakPolarHBondContact CA-O 3.33Å; L893-S1180 VanDerWaalsContact N-C 3.3Å; L893-S1180 PolarHBondContact N-O 3.37Å; L893-S1180 VanDerWaalsContact N-O 3.12Å; L893-S1180 PolarHBondContact O-N 3.2Å
1181	S	26	Very low	27.1	Very low	67 Å²	67	124.9 Å²	124.9	47%	0.469	68%	0.676	S	S	.	*			trans	80	102.4	135.8	68.5	0	0	0	0	126.1	T891 G892	T891-S1181 CarbonylContact C-O 3.59Å; T891-S1181 VanDerWaalsContact C-O 3.22Å; G892-S1181 VanDerWaalsContact CA-O 3.22Å; G892-S1181 WeakPolarHBondContact CA-O 3.48Å; G892-S1181 PolarHBondContact N-O 2.91Å; G892-S1181 VanDerWaalsContact N-O 3.15Å
1182	N	27	Very low	27.1	Very low	77 Å²	77	128.8 Å²	128.8	41%	0.412	68%	0.684	S	S	.	*			trans	-178.4	147.3	130.4	-117.8	43.1	0	0	0	119.9	T891	T891-N1182 HydrophobicContact CG2-CB 3.81Å; T891-N1182 PolarHBondContact N-ND2 3.42Å; T891-N1182 PolarHBondContact N-OD1 3.26Å
1183	S	27.1	Very low	27.2	Very low	82 Å²	82	126 Å²	126	57%	0.573	68%	0.677	S	S	*	*			trans	31.7	123.4	137.5	69.6	0	0	0	0	126.1
1184	S	24.3	Very low	27.3	Very low	112 Å²	112	125.5 Å²	125.5	78%	0.783	68%	0.683	S	S	*	*				76.2	147.5	125.3	-57.1	0	0	0	0	123.1
1185	S	27.6	Very low	27	Very low	97 Å²	97	125 Å²	125	68%	0.678	69%	0.687	S	S	*	*			trans	68.1	126.8	168.8	-71.6	0	0	0	0	115.6
1186	E	25.3	Very low	27	Very low	173 Å²	173	127.5 Å²	127.5	81%	0.808	70%	0.698	S	S	*	*				71	140.3	68.7	-74.3	175.4	137.4	0	0	113.5
1187	V	26	Very low	26.7	Very low	115 Å²	115	127.2 Å²	127.2	70%	0.697	70%	0.699	S	S	*	*			cis	-165.3	148.1	-21	90.6	0	0	0	0	109.2
1188	I	25.4	Very low	26.8	Very low	129 Å²	129	127.3 Å²	127.3	66%	0.662	70%	0.7	S	S	*	*			trans	49.1	130.7	161.2	-41	166.7	0	0	0	120.5
1189	L	26.8	Very low	26.8	Very low	155 Å²	155	129.7 Å²	129.7	81%	0.812	71%	0.708	S	S	*	*			trans	138.1	146.6	134.6	-74.5	174.1	0	0	0	110.5
1190	R	24.6	Very low	26.8	Very low	205 Å²	205	127.4 Å²	127.4	77%	0.774	71%	0.711	S	S	*	*			cis	166.8	144	-34.8	-113.6	-166.2	178	-165.8	2	104.1
1191	T	25.7	Very low	27	Very low	124 Å²	124	131.7 Å²	131.7	76%	0.761	73%	0.728	S	S	*	*			trans	63	150.1	161.9	54	0	0	0	0	118.3
1192	Q	26.9	Very low	27.1	Very low	175 Å²	175	132.2 Å²	132.2	82%	0.818	73%	0.731	S	S	*	*			cis	-153.6	176.5	-13	-102.9	-97.3	-32.3	0	0	108
1193	P	32.9	Very low	27.3	Very low	105 Å²	105	135.6 Å²	135.6	68%	0.682	75%	0.75	S	S	*	*			trans	-106	171.6	-158	41.2	-36.3	0	0	0	116
1194	S	28.5	Very low	27.6	Very low	125 Å²	125	136.4 Å²	136.4	87%	0.874	76%	0.755	S	S	*	*			trans	-153.2	163.2	152	61.6	0	0	0	0	112
1195	T	24.9	Very low	27.9	Very low	133 Å²	133	137.8 Å²	137.8	82%	0.816	75%	0.753	S	S	*	*			trans	-114.5	141	-168.7	-52	0	0	0	0	111.3
1196	I	29.1	Very low	28	Very low	173 Å²	173	136.9 Å²	136.9	89%	0.887	75%	0.751	S	S	*	*			trans	-144.4	156.6	160.6	-104.6	153.3	0	0	0	110.8
1197	Q	24.9	Very low	28.3	Very low	163 Å²	163	138 Å²	138	76%	0.762	75%	0.75	S	S	*	*			trans	-96.9	165	-160.8	-57.7	167	-43.6	0	0	114.4
1198	N	29.1	Very low	28.4	Very low	132 Å²	132	138.9 Å²	138.9	71%	0.706	75%	0.75	S	S	*	*			trans	139.6	146.4	137.3	-74.2	-36.1	0	0	0	113.6
1199	Q	26.6	Very low	28.5	Very low	159 Å²	159	137.4 Å²	137.4	74%	0.743	75%	0.747	S	S	*	*			cis	-169.7	157.3	-27.2	-126.7	-176.4	57	0	0	109.1
1200	S	28.1	Very low	28.4	Very low	106 Å²	106	138 Å²	138	74%	0.741	75%	0.745	S	S	*	*			trans	67.6	154.1	166.6	86.5	0	0	0	0	116.1
1201	L	31.3	Very low	28.4	Very low	159 Å²	159	132.4 Å²	132.4	83%	0.832	74%	0.738	S	S	*	*			cis	-144.5	172.9	1.2	-73.8	170.6	0	0	0	108.5
1202	S	28.1	Very low	28.4	Very low	77 Å²	77	131.2 Å²	131.2	54%	0.538	73%	0.734	S	S	.	*				-179.3	145.2	-52.8	58.9	0	0	0	0	110.4
1203	N	31.1	Very low	28.3	Very low	149 Å²	149	130.5 Å²	130.5	80%	0.797	74%	0.736	S	S	*	*			trans	69.7	159	159.8	-51.1	-27.1	0	0	0	117.7
1204	S	32	Very low	28	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	74%	0.736	S	S	*	*			cis	-172.6	170.3	-24.8	-85.9	0	0	0	0	106.6
1205	L	31.7	Very low	28	Very low	140 Å²	140	128.4 Å²	128.4	73%	0.733	72%	0.721	S	S	*	*			cis	-121.8	169.9	5.7	-79.5	85.3	0	0	0	109.3	Y1207	L1205-Y1207 HydrophobicContact CD2-CD2 4.12Å; L1205-Y1207 HydrophobicContact CD2-CE2 4.1Å
1206	A	29.5	Very low	28.3	Very low	78 Å²	78	124 Å²	124	65%	0.645	70%	0.695	S	S	*	*			cis	97	146	15.2	0	0	0	0	0	117.3
1207	Y	32	Very low	28.5	Very low	197 Å²	197	122.4 Å²	122.4	77%	0.773	68%	0.681	S	S	*	*			trans	80.3	136.1	175.6	-59.2	-38.5	0	0	0	118.5	L1205	L1205-Y1207 HydrophobicContact CD2-CD2 4.12Å; L1205-Y1207 HydrophobicContact CD2-CE2 4.1Å
1208	L	28.2	Very low	28.6	Very low	134 Å²	134	120.6 Å²	120.6	70%	0.702	68%	0.684	S	S	*	*			cis	-150.3	134.5	-12.7	-96.7	170.3	0	0	0	107.4
1209	T	26	Very low	28.5	Very low	97 Å²	97	118.9 Å²	118.9	60%	0.595	69%	0.688	S	S	*	*				36	143.5	105.5	70.3	0	0	0	0	116.2
1210	Q	25.9	Very low	28.6	Very low	168 Å²	168	117 Å²	117	79%	0.785	69%	0.692	S	S	*	*			cis	-171.9	171.8	20.8	-116.3	148.9	16.7	0	0	105.4
1211	S	25.1	Very low	28.5	Very low	87 Å²	87	119.3 Å²	119.3	61%	0.608	70%	0.696	S	S	*	*			cis	-179.3	160.3	-23.1	48.9	0	0	0	0	108.1
1212	S	25.7	Very low	28.3	Very low	99 Å²	99	117.4 Å²	117.4	69%	0.692	70%	0.695	S	S	*	*			trans	60.2	152	152.3	62.6	0	0	0	0	120
1213	N	24.7	Very low	28.2	Very low	160 Å²	160	120.1 Å²	120.1	86%	0.856	70%	0.703	S	S	*	*			cis	-166.1	178.2	-15.7	-108.7	-22.5	0	0	0	110.1
1214	A	26.5	Very low	28	Very low	82 Å²	82	119 Å²	119	68%	0.678	70%	0.695	S	S	*	*			trans	74.5	92	153.3	0	0	0	0	0	122.1
1215	N	27.2	Very low	27.8	Very low	105 Å²	105	120.9 Å²	120.9	56%	0.561	70%	0.698	S	S	*	*				13.8	163	110.6	-89.8	-46.2	0	0	0	122	L1114	L1114-N1215 HydrophobicContact CD2-CB 4.31Å
1216	P	32.1	Very low	27.6	Very low	41 Å²	41	118.9 Å²	118.9	27%	0.266	70%	0.696	S	S	.	*			cis	-142.5	-156.9	-16.5	42.1	-21.8	0	0	0	115.1	L1114 P1115	L1114-P1216 HydrophobicContact CD2-CB 4.22Å; P1115-P1216 HydrophobicContact CB-CG 4.24Å
1217	K	32	Very low	27.5	Very low	138 Å²	138	119.8 Å²	119.8	60%	0.6	70%	0.697	S	S	*	*			trans	-53.9	162	177.7	-56.2	-178	173.5	-176.8	0	117
1218	P	28.7	Very low	27.3	Very low	125 Å²	125	115.9 Å²	115.9	81%	0.812	69%	0.694	S	S	*	*				-131.5	-161.1	98.2	40.5	-32.3	0	0	0	114.2
1219	A	25.8	Very low	27.1	Very low	97 Å²	97	118.8 Å²	118.8	80%	0.802	70%	0.697	S	S	*	*			trans	-138.7	169.9	-171.8	0	0	0	0	0	113.6
1220	S	30	Very low	27.1	Very low	119 Å²	119	122.3 Å²	122.3	83%	0.832	70%	0.704	S	S	*	*			trans	-157.3	144.5	177.6	54.1	0	0	0	0	113
1221	N	25	Very low	27.2	Very low	154 Å²	154	119.7 Å²	119.7	82%	0.824	70%	0.696	S	S	*	*			trans	-121	154	-175.5	-62.8	-21.5	0	0	0	113.2
1222	C	26.9	Very low	27.4	Very low	120 Å²	120	121.9 Å²	121.9	81%	0.811	70%	0.696	S	S	*	*			trans	-167.3	141.9	145.9	-102	0	0	0	0	108.3
1223	L	25.8	Very low	27.5	Very low	133 Å²	133	121.6 Å²	121.6	70%	0.696	68%	0.684	S	S	*	*			cis	79.1	136.2	29	-53.3	178.2	0	0	0	112.9
1224	I	27.4	Very low	27.7	Very low	125 Å²	125	117.1 Å²	117.1	64%	0.641	66%	0.66	S	S	*	*			cis	-163.5	-172.2	-4.6	-130	172.1	0	0	0	111.7
1225	D	27.2	Very low	27.7	Very low	140 Å²	140	115.5 Å²	115.5	75%	0.749	64%	0.64	S	S	*	*			trans	88.1	149.7	161.2	-76.5	-33.7	0	0	0	121.7
1226	S	27.3	Very low	27.7	Very low	98 Å²	98	119.9 Å²	119.9	69%	0.685	65%	0.649	S	S	*	*			cis	-169.2	156.5	-34	-106.5	0	0	0	0	113.8
1227	S	29	Very low	27.8	Very low	96 Å²	96	127.7 Å²	127.7	67%	0.671	68%	0.679	S	S	*	*			trans	-30.2	156	173.3	55.7	0	0	0	0	121
1228	T	26.9	Very low	27.7	Very low	116 Å²	116	126.9 Å²	126.9	71%	0.712	69%	0.687	S	S	*	*				174.2	167.3	78.1	29.3	0	0	0	0	116.9
1229	Y	24.9	Very low	27.6	Very low	194 Å²	194	126.9 Å²	126.9	76%	0.761	69%	0.685	S	S	*	*			trans	69.8	105.2	144	-83.4	-69.8	0	0	0	125.6
1230	F	25.8	Very low	27.6	Very low	171 Å²	171	129.3 Å²	129.3	75%	0.75	68%	0.683	S	S	*	*				72	112.1	122.9	-91.3	-131.4	0	0	0	126.6
1231	N	27.8	Very low	27.5	Very low	114 Å²	114	129.5 Å²	129.5	61%	0.61	69%	0.685	S	S	*	*				87	149.9	108.9	-134.5	6.9	0	0	0	125.4
1232	H	28.3	Very low	27.7	Very low	133 Å²	133	129.3 Å²	129.3	62%	0.616	68%	0.676	S	S	*	*			trans	75	119.3	163.1	-73.6	-38.5	0	0	0	121.6
1233	Q	28	Very low	27.7	Very low	93 Å²	93	131.9 Å²	131.9	44%	0.435	68%	0.681	S	S	.	*				73.5	141.1	84.3	-79.4	-167.3	4	0	0	116	T12 K14	T12-Q1233 WeakPolarHBondContact O-CG 3.21Å; T12-Q1233 PolarHBondContact O-NE2 2.89Å; T12-Q1233 VanDerWaalsContact O-NE2 3.11Å; K14-Q1233 CarbonylContact O-C 3.6Å; K14-Q1233 WeakPolarHBondContact O-CA 3.32Å; K14-Q1233 PolarHBondContact O-N 2.83Å
1234	N	28.6	Very low	27.8	Very low	65 Å²	65	130.4 Å²	130.4	35%	0.348	67%	0.674	S	S	.	*			cis	-159.3	141.3	19.4	-110.2	-26.8	0	0	0	117.6	T12 T13	T12-N1234 WeakPolarHBondContact CB-OD1 3.45Å; T12-N1234 PolarHBondContact O-OD1 2.96Å; T12-N1234 PolarHBondContact OG1-OD1 3.24Å; T13-N1234 VanDerWaalsContact O-CA 3.25Å; T13-N1234 WeakPolarHBondContact O-CA 3.4Å; T13-N1234 PolarHBondContact O-OD1 2.68Å
1235	N	27.9	Very low	27.8	Very low	49 Å²	49	134.6 Å²	134.6	26%	0.262	68%	0.683	S	S	.	*			trans	74.8	151.9	133.2	-144.3	-7.9	0	0	0	125.4	T12 T13 K14	T12-N1235 HydrophobicContact CG2-CB 4.03Å; T12-N1235 WeakPolarHBondContact CG2-ND2 3.22Å; T13-N1235 WeakPolarHBondContact OG1-CA 3.49Å; T13-N1235 PolarHBondContact OG1-N 2.87Å; K14-N1235 WeakPolarHBondContact CD-O 3.22Å; K14-N1235 VanDerWaalsContact CE-C 3.43Å; K14-N1235 WeakPolarHBondContact CE-O 3.48Å; K14-N1235 PolarHBondContact NZ-O 2.82Å
1236	R	25.3	Very low	27.8	Very low	196 Å²	196	132.9 Å²	132.9	74%	0.74	67%	0.674	S	S	*	*			trans	93.6	123.8	154.4	-56.9	-173.7	178.1	169.1	-0.1	121.8	K14	K14-R1236 WeakPolarHBondContact CE-O 3.29Å; K14-R1236 PolarHBondContact NZ-O 2.98Å
1237	K	34.3	Very low	27.8	Very low	206 Å²	206	134.4 Å²	134.4	90%	0.896	68%	0.675	S	S	*	*			trans	-101.2	156	151.8	-78.2	-176.6	175.1	178.3	0	109
1238	P	30.6	Very low	27.7	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	68%	0.68	S	S	*	*				-146.5	177.2	124.7	37	-21.6	0	0	0	113.6
1239	T	26.3	Very low	27.7	Very low	125 Å²	125	138.8 Å²	138.8	77%	0.767	69%	0.686	S	S	*	*			cis	-158.2	140.5	-39.5	-82.1	0	0	0	0	109.8
1240	I	27.3	Very low	28	Very low	149 Å²	149	136.5 Å²	136.5	76%	0.764	69%	0.687	S	S	*	*			trans	-9.6	135.1	161.1	-56.9	163	0	0	0	118.7
1241	S	27.7	Very low	28.1	Very low	123 Å²	123	136.4 Å²	136.4	86%	0.86	69%	0.694	S	S	*	*				-135.9	144.8	129.6	65.8	0	0	0	0	110.3
1242	K	28.1	Very low	28.1	Very low	149 Å²	149	142.5 Å²	142.5	65%	0.648	71%	0.709	S	S	*	*			trans	-111.4	156.4	-177.9	-96.8	-170.2	159.7	-128.3	0	110.3	D1244	K1242-D1244 IonicContact NZ-OD1 2.87Å; K1242-D1244 PolarHBondContact NZ-OD1 3.4Å; K1242-D1244 IonicContact NZ-OD2 2.93Å; K1242-D1244 PolarHBondContact NZ-OD2 2.9Å; K1242-D1244 VanDerWaalsContact NZ-OD2 3.12Å
1243	L	27	Very low	28.5	Very low	174 Å²	174	140.2 Å²	140.2	91%	0.911	71%	0.705	S	S	*	*			trans	-156.6	133.5	130.8	-109.7	154.2	0	0	0	110.3
1244	D	28	Very low	28.8	Very low	103 Å²	103	139.9 Å²	139.9	55%	0.551	72%	0.718	S	S	*	*			trans	-91.2	164.4	-177.3	-48.4	-87.4	0	0	0	111.1	K1242	K1242-D1244 IonicContact NZ-OD1 2.87Å; K1242-D1244 PolarHBondContact NZ-OD1 3.4Å; K1242-D1244 IonicContact NZ-OD2 2.93Å; K1242-D1244 PolarHBondContact NZ-OD2 2.9Å; K1242-D1244 VanDerWaalsContact NZ-OD2 3.12Å
1245	Y	26.6	Very low	29.1	Very low	212 Å²	212	139.5 Å²	139.5	83%	0.831	73%	0.729	S	S	*	*				-175	109.2	120.6	-116.6	-112.1	0	0	0	115.4
1246	N	27.6	Very low	29.5	Very low	104 Å²	104	140.5 Å²	140.5	56%	0.556	74%	0.74	S	S	*	*			trans	50.8	110.4	131.7	-72.1	-34.3	0	0	0	124.2
1247	N	28.3	Very low	30.1	Very low	131 Å²	131	135 Å²	135	70%	0.701	73%	0.728	S	S	*	*				92.4	142.1	109.7	-74.8	-13.5	0	0	0	124.4
1248	N	26	Very low	30.2	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	71%	0.71	S	S	*	*			trans	70.4	76.5	146.1	-65.8	-7.3	0	0	0	119.9
1249	D	28.1	Very low	30.8	Very low	158 Å²	158	125.4 Å²	125.4	85%	0.845	70%	0.697	S	S	*	*				-156.9	109	126	-129.5	-20.3	0	0	0	111
1250	N	29.6	Very low	31.4	Very low	146 Å²	146	127.5 Å²	127.5	78%	0.781	69%	0.692	S	S	*	*			trans	-175.1	76	168.3	-107	-44.5	0	0	0	112.7
1251	N	28.5	Very low	32.2	Very low	169 Å²	169	123.7 Å²	123.7	90%	0.904	67%	0.673	S	S	*	*			trans	-144.5	51.3	171.8	-124.9	-24.9	0	0	0	111.5
1252	R	29.1	Very low	33.1	Very low	241 Å²	241	121.8 Å²	121.8	91%	0.909	67%	0.665	S	S	*	*			trans	-148.7	20.2	-169.3	-132.7	173.4	-173.7	178.8	0.5	117.1
1253	T	35.7	Very low	33.9	Very low	86 Å²	86	118.7 Å²	118.7	53%	0.528	67%	0.667	S	S	.	*			trans	-121.1	-10.4	-170.2	29.9	0	0	0	0	116.1	G1255 S1256 T1257	T1253-G1255 PolarHBondContact O-N 3.43Å; T1253-S1256 PolarHBondContact O-OG 3.35Å; T1253-S1256 VanDerWaalsContact O-OG 3.08Å; T1253-T1257 PolarHBondContact O-OG1 2.86Å
1254	A	33.8	Very low	34.7	Very low	86 Å²	86	113.3 Å²	113.3	71%	0.711	64%	0.641	S	S	*	*	H	α-helix	trans	-67.8	-36.2	-179.8	0	0	0	0	0	113.6	A1258	A1254-A1258 PolarHBondContact O-N 2.89Å
1255	G	34.8	Very low	35.1	Very low	57 Å²	57	110.3 Å²	110.3	59%	0.588	63%	0.634	S	S	*	*	H	α-helix	trans	-73.3	-34.4	-175.9	0	0	0	0	0	114.5	T1253 A1259	T1253-G1255 PolarHBondContact O-N 3.43Å; G1255-A1259 WeakPolarHBondContact O-CB 3.4Å; G1255-A1259 PolarHBondContact O-N 3.37Å; G1255-A1259 VanDerWaalsContact O-N 3.14Å
1256	S	37.8	Very low	35.8	Very low	70 Å²	70	101.6 Å²	101.6	49%	0.49	60%	0.603	S	S	.	*	H	α-helix	trans	-70	-44	178.3	45.1	0	0	0	0	111.7	T1253 A1259 Y1260	T1253-S1256 PolarHBondContact O-OG 3.35Å; T1253-S1256 VanDerWaalsContact O-OG 3.08Å; S1256-A1259 PolarHBondContact O-N 2.97Å; S1256-Y1260 WeakPolarHBondContact O-CB 3.32Å; S1256-Y1260 PolarHBondContact O-N 2.97Å
1257	T	36.3	Very low	36.5	Very low	81 Å²	81	97.6 Å²	97.6	50%	0.497	59%	0.587	S	S	.	*	H	α-helix	trans	-64.6	-41.8	179.3	-50.3	0	0	0	0	111.7	T1253 Y1260 L1261	T1253-T1257 PolarHBondContact O-OG1 2.86Å; T1257-Y1260 PolarHBondContact O-N 3.31Å; T1257-L1261 HydrophobicContact CG2-CD1 4.14Å; T1257-L1261 WeakPolarHBondContact O-CB 3.33Å; T1257-L1261 WeakPolarHBondContact O-CG 3.31Å; T1257-L1261 PolarHBondContact O-N 3.46Å
1258	A	37.3	Very low	37.3	Very low	62 Å²	62	94.3 Å²	94.3	51%	0.512	58%	0.577	S	S	.	*	H	α-helix	trans	-63.9	-40.5	175	0	0	0	0	0	112.6	A1254 A1262	A1254-A1258 PolarHBondContact O-N 2.89Å; A1258-A1262 WeakPolarHBondContact O-CB 3.31Å; A1258-A1262 PolarHBondContact O-N 3.23Å
1259	A	43.9	Very low	38	Very low	61 Å²	61	93.8 Å²	93.8	50%	0.504	57%	0.566	S	S	.	*	H	α-helix	trans	-66.9	-36.2	174.8	0	0	0	0	0	112.5	G1255 S1256 A1263	G1255-A1259 WeakPolarHBondContact O-CB 3.4Å; G1255-A1259 PolarHBondContact O-N 3.37Å; G1255-A1259 VanDerWaalsContact O-N 3.14Å; S1256-A1259 PolarHBondContact O-N 2.97Å; A1259-A1263 WeakPolarHBondContact O-CB 3.43Å; A1259-A1263 PolarHBondContact O-N 3.47Å
1260	Y	38.5	Very low	38.6	Very low	170 Å²	170	93.4 Å²	93.4	67%	0.667	56%	0.556	S	S	*	*	H	α-helix	trans	-68.3	-46.7	177.1	-167.1	-100.1	0	0	0	111.7	S1256 T1257 A1262 A1263 T1264	S1256-Y1260 WeakPolarHBondContact O-CB 3.32Å; S1256-Y1260 PolarHBondContact O-N 2.97Å; T1257-Y1260 PolarHBondContact O-N 3.31Å; Y1260-A1262 VanDerWaalsContact C-N 3.33Å; Y1260-A1262 PolarHBondContact O-N 2.98Å; Y1260-A1263 CarbonylContact O-C 3.53Å; Y1260-A1263 WeakPolarHBondContact O-CA 3.4Å; Y1260-A1263 WeakPolarHBondContact O-CB 3.47Å; Y1260-A1263 PolarHBondContact O-N 2.89Å; Y1260-T1264 HydrophobicContact CD1-CG2 4.23Å; Y1260-T1264 HydrophobicContact CE1-CG2 4Å; Y1260-T1264 PolarHBondContact O-N 3.02Å; Y1260-T1264 PolarHBondContact O-OG1 3.4Å
1261	L	43.6	Very low	38.7	Very low	69 Å²	69	92.9 Å²	92.9	36%	0.361	55%	0.553	S	S	.	*	H	α-helix	trans	-61.3	-39.2	175.4	-70.9	168	0	0	0	112.5	T1257 A1263 T1264 G1265 V1266	T1257-L1261 HydrophobicContact CG2-CD1 4.14Å; T1257-L1261 WeakPolarHBondContact O-CB 3.33Å; T1257-L1261 WeakPolarHBondContact O-CG 3.31Å; T1257-L1261 PolarHBondContact O-N 3.46Å; L1261-A1263 VanDerWaalsContact C-N 3.27Å; L1261-A1263 PolarHBondContact O-N 2.93Å; L1261-T1264 WeakPolarHBondContact CA-OG1 3.33Å; L1261-T1264 PolarHBondContact O-N 2.91Å; L1261-T1264 PolarHBondContact O-OG1 3.35Å; L1261-G1265 PolarHBondContact O-N 3.32Å; L1261-V1266 HydrophobicContact CD2-CB 4.2Å; L1261-V1266 HydrophobicContact CD2-CG1 4.4Å; L1261-V1266 HydrophobicContact CD2-CG2 4.06Å; L1261-V1266 PolarHBondContact O-N 3.46Å; L1261-V1266 VanDerWaalsContact O-N 3.15Å
1262	A	46.8	Very low	40	Very low	83 Å²	83	91.7 Å²	91.7	69%	0.686	55%	0.546	S	S	*	.	H	α-helix	trans	-69.1	-22.8	173.6	0	0	0	0	0	113.4	A1258 Y1260	A1258-A1262 WeakPolarHBondContact O-CB 3.31Å; A1258-A1262 PolarHBondContact O-N 3.23Å; Y1260-A1262 VanDerWaalsContact C-N 3.33Å; Y1260-A1262 PolarHBondContact O-N 2.98Å
1263	A	43.7	Very low	40.8	Very low	83 Å²	83	87.4 Å²	87.4	69%	0.686	54%	0.542	S	S	*	.	H	α-helix	trans	-86.5	-27.9	175.2	0	0	0	0	0	113.1	A1259 Y1260 L1261 G1265	A1259-A1263 WeakPolarHBondContact O-CB 3.43Å; A1259-A1263 PolarHBondContact O-N 3.47Å; Y1260-A1263 CarbonylContact O-C 3.53Å; Y1260-A1263 WeakPolarHBondContact O-CA 3.4Å; Y1260-A1263 WeakPolarHBondContact O-CB 3.47Å; Y1260-A1263 PolarHBondContact O-N 2.89Å; L1261-A1263 VanDerWaalsContact C-N 3.27Å; L1261-A1263 PolarHBondContact O-N 2.93Å; A1263-G1265 VanDerWaalsContact C-N 3.33Å
1264	T	44.8	Very low	40.4	Very low	62 Å²	62	87.3 Å²	87.3	38%	0.38	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	4.7	177	55.1	0	0	0	0	114.2	Y1260 L1261 T1280	Y1260-T1264 HydrophobicContact CD1-CG2 4.23Å; Y1260-T1264 HydrophobicContact CE1-CG2 4Å; Y1260-T1264 PolarHBondContact O-N 3.02Å; Y1260-T1264 PolarHBondContact O-OG1 3.4Å; L1261-T1264 WeakPolarHBondContact CA-OG1 3.33Å; L1261-T1264 PolarHBondContact O-N 2.91Å; L1261-T1264 PolarHBondContact O-OG1 3.35Å; T1264-T1280 PolarHBondContact O-OG1 3.26Å
1265	G	35.5	Very low	40.4	Very low	39 Å²	39	89.2 Å²	89.2	40%	0.402	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	15	174.9	0	0	0	0	0	115	L1261 A1263 G1267	L1261-G1265 PolarHBondContact O-N 3.32Å; A1263-G1265 VanDerWaalsContact C-N 3.33Å; G1265-G1267 PolarHBondContact O-N 3.2Å
1266	V	42.3	Very low	40.5	Very low	29 Å²	29	89 Å²	89	18%	0.176	53%	0.534	C	S	.	.			trans	-76.7	112.7	-177.9	-176.7	0	0	0	0	110.4	L1261 L1277 L1278 T1279	L1261-V1266 HydrophobicContact CD2-CB 4.2Å; L1261-V1266 HydrophobicContact CD2-CG1 4.4Å; L1261-V1266 HydrophobicContact CD2-CG2 4.06Å; L1261-V1266 PolarHBondContact O-N 3.46Å; L1261-V1266 VanDerWaalsContact O-N 3.15Å; V1266-L1277 HydrophobicContact CG1-CB 4.33Å; V1266-L1277 HydrophobicContact CG1-CD2 3.92Å; V1266-L1278 WeakPolarHBondContact CA-O 3.27Å; V1266-T1279 HydrophobicContact CG1-CG2 4.33Å; V1266-T1279 HydrophobicContact CG2-CG2 4.17Å
1267	G	41.9	Very low	40.4	Very low	21 Å²	21	90.9 Å²	90.9	22%	0.216	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	145.1	170.4	0	0	0	0	0	111.2	G1265 L1277 L1278	G1265-G1267 PolarHBondContact O-N 3.2Å; G1267-L1277 WeakPolarHBondContact O-CA 3.31Å; G1267-L1278 PolarHBondContact N-O 3.19Å; G1267-L1278 PolarHBondContact O-N 2.91Å
1268	A	45.4	Very low	40.3	Very low	61 Å²	61	92 Å²	92	50%	0.504	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	131.9	172.2	0	0	0	0	0	109.9	L1275 A1276 L1277	A1268-L1275 HydrophobicContact CB-CD1 4.36Å; A1268-A1276 WeakPolarHBondContact CA-O 3.4Å; A1268-L1277 HydrophobicContact CB-CD2 3.82Å
1269	Y	41.4	Very low	40.5	Very low	136 Å²	136	93.1 Å²	93.1	53%	0.533	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.6	-179	-44.3	-66	0	0	0	109.7	A1276 L1278	Y1269-A1276 PolarHBondContact N-O 3.43Å; Y1269-A1276 PolarHBondContact O-N 3.24Å; Y1269-L1278 HydrophobicContact CD2-CB 4.48Å; Y1269-L1278 HydrophobicContact CE2-CB 3.73Å; Y1269-L1278 HydrophobicContact CE2-CD2 4.19Å; Y1269-L1278 HydrophobicContact CE2-CG 4.47Å
1270	K	39.6	Very low	40	Very low	149 Å²	149	95.6 Å²	95.6	65%	0.648	55%	0.55	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.7	122.8	171.7	-179.4	170.2	178.3	173.2	0	108.7	N1272 D1273 S1274	K1270-N1272 WeakPolarHBondContact CE-O 3.13Å; K1270-N1272 WeakPolarHBondContact CG-O 3.5Å; K1270-D1273 IonicContact NZ-OD1 3.02Å; K1270-D1273 PolarHBondContact NZ-OD1 2.97Å; K1270-D1273 VanDerWaalsContact NZ-OD1 3.07Å; K1270-S1274 WeakPolarHBondContact CA-O 3.28Å
1271	L	32.6	Very low	39.5	Very low	136 Å²	136	98 Å²	98	71%	0.712	56%	0.558	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.9	108.9	174.9	-158.8	83.5	0	0	0	108.1	D1273 S1274	L1271-D1273 PolarHBondContact O-N 2.85Å; L1271-S1274 PolarHBondContact N-O 3.48Å; L1271-S1274 PolarHBondContact O-N 3.18Å
1272	N	55.4	Low	38.8	Very low	143 Å²	143	100.3 Å²	100.3	77%	0.765	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	44.1	-133.7	-162.4	-61.6	-14.2	0	0	0	109.5	K1270 S1274	K1270-N1272 WeakPolarHBondContact CE-O 3.13Å; K1270-N1272 WeakPolarHBondContact CG-O 3.5Å; N1272-S1274 VanDerWaalsContact C-N 3.28Å; N1272-S1274 PolarHBondContact O-N 3.01Å
1273	D	46	Very low	37.7	Very low	151 Å²	151	100.9 Å²	100.9	81%	0.807	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	10.6	-179.3	-67.1	-49.1	0	0	0	115.7	K1270 L1271	K1270-D1273 IonicContact NZ-OD1 3.02Å; K1270-D1273 PolarHBondContact NZ-OD1 2.97Å; K1270-D1273 VanDerWaalsContact NZ-OD1 3.07Å; L1271-D1273 PolarHBondContact O-N 2.85Å
1274	S	27.8	Very low	36.8	Very low	85 Å²	85	106.5 Å²	106.5	59%	0.594	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.1	143.5	174.5	-60.9	0	0	0	0	112.6	K1270 L1271 N1272	K1270-S1274 WeakPolarHBondContact CA-O 3.28Å; L1271-S1274 PolarHBondContact N-O 3.48Å; L1271-S1274 PolarHBondContact O-N 3.18Å; N1272-S1274 VanDerWaalsContact C-N 3.28Å; N1272-S1274 PolarHBondContact O-N 3.01Å
1275	L	33.5	Very low	35.9	Very low	126 Å²	126	112 Å²	112	66%	0.66	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.7	112	174.1	-176.5	72.1	0	0	0	109.3	A1268	A1268-L1275 HydrophobicContact CB-CD1 4.36Å
1276	A	37.4	Very low	35.4	Very low	51 Å²	51	116.8 Å²	116.8	42%	0.421	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.3	135.1	175.4	0	0	0	0	0	110.8	A1268 Y1269	A1268-A1276 WeakPolarHBondContact CA-O 3.4Å; Y1269-A1276 PolarHBondContact N-O 3.43Å; Y1269-A1276 PolarHBondContact O-N 3.24Å
1277	L	34.6	Very low	34.7	Very low	110 Å²	110	123 Å²	123	58%	0.576	64%	0.64	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.8	126.8	172.3	-71.8	167.6	0	0	0	109.3	V1266 G1267 A1268	V1266-L1277 HydrophobicContact CG1-CB 4.33Å; V1266-L1277 HydrophobicContact CG1-CD2 3.92Å; G1267-L1277 WeakPolarHBondContact O-CA 3.31Å; A1268-L1277 HydrophobicContact CB-CD2 3.82Å
1278	L	35.4	Very low	33.8	Very low	106 Å²	106	126.8 Å²	126.8	56%	0.555	66%	0.663	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.6	111.8	178.7	-157.7	89.2	0	0	0	109.1	V1266 G1267 Y1269	V1266-L1278 WeakPolarHBondContact CA-O 3.27Å; G1267-L1278 PolarHBondContact N-O 3.19Å; G1267-L1278 PolarHBondContact O-N 2.91Å; Y1269-L1278 HydrophobicContact CD2-CB 4.48Å; Y1269-L1278 HydrophobicContact CE2-CB 3.73Å; Y1269-L1278 HydrophobicContact CE2-CD2 4.19Å; Y1269-L1278 HydrophobicContact CE2-CG 4.47Å
1279	T	40.6	Very low	33	Very low	85 Å²	85	129.6 Å²	129.6	52%	0.521	67%	0.67	S	S	.	*			trans	-97.4	138	-178.6	96.6	0	0	0	0	111.1	V1266 R1281	V1266-T1279 HydrophobicContact CG1-CG2 4.33Å; V1266-T1279 HydrophobicContact CG2-CG2 4.17Å; T1279-R1281 PolarHBondContact O-N 2.96Å
1280	T	33.3	Very low	32.3	Very low	112 Å²	112	130.2 Å²	130.2	69%	0.687	68%	0.681	S	S	*	*	S	Bend	trans	-85	58.8	173.4	54.3	0	0	0	0	111.3	T1264	T1264-T1280 PolarHBondContact O-OG1 3.26Å
1281	R	28.7	Very low	31.6	Very low	220 Å²	220	129.4 Å²	129.4	83%	0.83	68%	0.684	S	S	*	*			trans	-148	127.4	168.3	-160.2	169.3	-171.5	153.2	1.4	108.7	T1279	T1279-R1281 PolarHBondContact O-N 2.96Å
1282	T	27.2	Very low	31.4	Very low	119 Å²	119	130.5 Å²	130.5	73%	0.73	69%	0.69	S	S	*	*			trans	-74.3	161.3	175.8	46.5	0	0	0	0	111.4
1283	D	25	Very low	30	Very low	94 Å²	94	130.9 Å²	130.9	50%	0.503	69%	0.692	S	S	.	*			trans	81.3	143	176.1	-52.2	-44.4	0	0	0	116.6	K428	K428-D1283 IonicContact NZ-OD1 3.21Å; K428-D1283 PolarHBondContact NZ-OD1 3.04Å; K428-D1283 IonicContact NZ-OD2 2.62Å
1284	Y	25	Very low	29.1	Very low	201 Å²	201	129.7 Å²	129.7	79%	0.788	69%	0.69	S	S	*	*			trans	70	74.7	-178.6	-48.9	-74.3	0	0	0	117.8	I1286	Y1284-I1286 HydrophobicContact CD1-CD1 4.31Å; Y1284-I1286 HydrophobicContact CD1-CG1 4.31Å
1285	L	25.9	Very low	29	Very low	178 Å²	178	130.7 Å²	130.7	93%	0.932	69%	0.693	S	S	*	*				-95	114.3	128	-82.4	173	0	0	0	107.3
1286	I	25.3	Very low	28.7	Very low	140 Å²	140	130.9 Å²	130.9	72%	0.718	70%	0.695	S	S	*	*			trans	-94.5	112	166.2	-64.6	173.9	0	0	0	105.7	Y1284 S1288	Y1284-I1286 HydrophobicContact CD1-CD1 4.31Å; Y1284-I1286 HydrophobicContact CD1-CG1 4.31Å; I1286-S1288 PolarHBondContact O-N 3.45Å; I1286-S1288 VanDerWaalsContact O-N 3.15Å
1287	E	26	Very low	28.2	Very low	160 Å²	160	135 Å²	135	75%	0.748	71%	0.71	S	S	*	*			trans	-68	109.8	166.4	-70.2	-169.4	151.6	0	0	108.6	N1289	E1287-N1289 PolarHBondContact O-N 3.1Å
1288	S	24.8	Very low	27.9	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	71%	0.713	S	S	*	*			trans	-73.1	74.4	169.4	58.8	0	0	0	0	109.4	I1286 I1290	I1286-S1288 PolarHBondContact O-N 3.45Å; I1286-S1288 VanDerWaalsContact O-N 3.15Å; S1288-I1290 PolarHBondContact O-N 3.23Å
1289	N	26.7	Very low	27.5	Very low	119 Å²	119	134.6 Å²	134.6	64%	0.636	72%	0.717	S	S	*	*			trans	-65.6	96	170.6	-90.7	-54.9	0	0	0	109	E1287 N1291	E1287-N1289 PolarHBondContact O-N 3.1Å; N1289-N1291 PolarHBondContact O-N 3.45Å
1290	I	27	Very low	27	Very low	150 Å²	150	135.7 Å²	135.7	77%	0.769	72%	0.723	S	S	*	*			trans	-74.5	75.8	171.6	-55.1	175.9	0	0	0	107.9	S1288	S1288-I1290 PolarHBondContact O-N 3.23Å
1291	N	26.6	Very low	26.8	Very low	132 Å²	132	136.7 Å²	136.7	71%	0.706	72%	0.724	S	S	*	*			trans	-119.6	84.5	165.2	-79.4	-32.7	0	0	0	107.4	N1289 D1293	N1289-N1291 PolarHBondContact O-N 3.45Å; N1291-D1293 PolarHBondContact O-N 3.12Å
1292	N	27.6	Very low	26.8	Very low	159 Å²	159	131.6 Å²	131.6	85%	0.85	71%	0.714	S	S	*	*			trans	-75.5	116.1	160.6	-90.8	1.3	0	0	0	107.4	T1294	N1292-T1294 PolarHBondContact O-N 3.24Å
1293	D	26.1	Very low	26.9	Very low	151 Å²	151	131.5 Å²	131.5	81%	0.807	71%	0.709	S	S	*	*			trans	-57.9	131.8	173.5	-67.4	-69.1	0	0	0	111.8	N1291	N1291-D1293 PolarHBondContact O-N 3.12Å
1294	T	26.8	Very low	27.1	Very low	125 Å²	125	133.6 Å²	133.6	77%	0.767	72%	0.72	S	S	*	*			trans	-155.2	80.3	144	-7.4	0	0	0	0	112.5	N1292	N1292-T1294 PolarHBondContact O-N 3.24Å
1295	T	26	Very low	27.3	Very low	106 Å²	106	129.9 Å²	129.9	65%	0.65	72%	0.718	S	S	*	*			trans	50.6	128.7	133	61.7	0	0	0	0	121.8
1296	N	26.8	Very low	27.4	Very low	130 Å²	130	128 Å²	128	70%	0.695	70%	0.702	S	S	*	*			trans	87.1	112	140.3	-59.4	-14.7	0	0	0	121
1297	N	26.9	Very low	27.5	Very low	137 Å²	137	130 Å²	130	73%	0.733	70%	0.702	S	S	*	*				72.2	143.4	126.5	-61	-13.9	0	0	0	118.8
1298	T	27.4	Very low	27.6	Very low	106 Å²	106	130.9 Å²	130.9	65%	0.65	70%	0.703	S	S	*	*			cis	-155.4	158.1	9.7	-7.6	0	0	0	0	112.4
1299	T	29	Very low	27.9	Very low	102 Å²	102	135 Å²	135	63%	0.626	71%	0.711	S	S	*	*			trans	6.1	146.9	142.4	57.6	0	0	0	0	120
1300	T	29.4	Very low	27.9	Very low	108 Å²	108	136.9 Å²	136.9	66%	0.663	72%	0.722	S	S	*	*			cis	-175.7	172	17.6	9.4	0	0	0	0	113.2
1301	N	28.8	Very low	28.3	Very low	133 Å²	133	135 Å²	135	71%	0.711	72%	0.72	S	S	*	*			trans	67.7	136.3	146.9	-67.8	6.5	0	0	0	118.7
1302	N	28.8	Very low	28.3	Very low	113 Å²	113	138.6 Å²	138.6	60%	0.604	73%	0.729	S	S	*	*			cis	-169.6	155.8	16.6	-116.3	25.1	0	0	0	112.2
1303	D	30.3	Very low	28	Very low	118 Å²	118	136 Å²	136	63%	0.631	72%	0.723	S	S	*	*			trans	67.1	110.2	134.8	-62.5	-10.7	0	0	0	124.8
1304	N	27.3	Very low	27.9	Very low	137 Å²	137	134.2 Å²	134.2	73%	0.733	72%	0.717	S	S	*	*				117	136	105.1	-95.6	-38.2	0	0	0	121.6
1305	V	29.3	Very low	27.7	Very low	123 Å²	123	134 Å²	134	75%	0.745	72%	0.716	S	S	*	*			trans	72.6	142.2	146.3	163	0	0	0	0	119.4
1306	K	27.8	Very low	27.7	Very low	140 Å²	140	138.7 Å²	138.7	61%	0.609	73%	0.728	S	S	*	*			cis	-173.3	165.8	-25.9	-163	168.7	171.5	-161.7	0	109.4
1307	Y	29.2	Very low	27.6	Very low	181 Å²	181	139.1 Å²	139.1	71%	0.71	73%	0.73	S	S	*	*			trans	73.9	135.4	172.2	-45.6	-72.6	0	0	0	116.1
1308	K	27.5	Very low	27.5	Very low	178 Å²	178	140 Å²	140	77%	0.774	73%	0.73	S	S	*	*			cis	101.1	100.2	9.9	-170.8	-147.5	179.1	-160.2	0	115.3
1309	E	30.8	Very low	27.4	Very low	186 Å²	186	141.7 Å²	141.7	87%	0.869	74%	0.735	S	S	*	*			trans	-164.5	-176.4	133.1	-117.1	161.2	-143.9	0	0	114.5
1310	N	27	Very low	27.4	Very low	159 Å²	159	144 Å²	144	85%	0.85	74%	0.744	S	S	*	*			trans	-108.1	162.9	-153.2	-113.5	0.8	0	0	0	115
1311	P	36	Very low	27.1	Very low	112 Å²	112	146.2 Å²	146.2	73%	0.727	75%	0.751	S	S	*	*			trans	-88.2	155.1	-171.9	35.5	-36.3	0	0	0	114.7
1312	K	24.6	Very low	26.9	Very low	207 Å²	207	146.8 Å²	146.8	90%	0.9	75%	0.752	S	S	*	*			trans	-158	169.1	157	-113.3	169.8	-174.2	-179.4	0	111.6
1313	S	22.5	Very low	26.7	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	76%	0.755	S	S	*	*			trans	-46.7	178.4	178.4	50.1	0	0	0	0	118.2
1314	V	23.1	Very low	26.6	Very low	113 Å²	113	148.5 Å²	148.5	69%	0.685	76%	0.763	S	S	*	*			trans	96.8	97.5	174.4	-174.3	0	0	0	0	112
1315	T	22.9	Very low	26.4	Very low	122 Å²	122	149.3 Å²	149.3	75%	0.748	76%	0.763	S	S	*	*				66.6	117.3	86.4	-48.5	0	0	0	0	113
1316	F	25.6	Very low	26.3	Very low	203 Å²	203	150.5 Å²	150.5	89%	0.89	77%	0.765	S	S	*	*			trans	-130.1	113.7	167.1	-93.5	-82.1	0	0	0	111.6
1317	N	25.3	Very low	26.3	Very low	140 Å²	140	149.9 Å²	149.9	75%	0.749	77%	0.769	S	S	*	*			trans	-87.6	179.3	167	-164.1	3.5	0	0	0	109.6
1318	Q	25.5	Very low	26.3	Very low	155 Å²	155	148.6 Å²	148.6	72%	0.724	77%	0.769	S	S	*	*	S	Bend	trans	-60.8	164.9	-179.9	-63	168.3	-27.4	0	0	113.9
1319	N	24.7	Very low	26.4	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	76%	0.762	S	S	*	*			trans	69.7	109.3	167.6	-52.7	-31	0	0	0	116.7
1320	N	29	Very low	26.3	Very low	152 Å²	152	142.5 Å²	142.5	81%	0.813	75%	0.751	S	S	*	*				-161.9	129.2	108.2	-97.1	-31.6	0	0	0	112.7
1321	L	22.6	Very low	26.5	Very low	154 Å²	154	143.1 Å²	143.1	81%	0.806	75%	0.746	S	S	*	*			trans	-70.8	140.4	154.9	-132.5	79.1	0	0	0	107.6
1322	I	26	Very low	26	Very low	144 Å²	144	145.9 Å²	145.9	74%	0.738	75%	0.746	S	S	*	*			trans	-147.8	120.4	152.3	-98.8	141.4	0	0	0	108	I1324	I1322-I1324 HydrophobicContact CG2-CG1 4.48Å
1323	T	23.4	Very low	26.1	Very low	109 Å²	109	143.1 Å²	143.1	67%	0.669	74%	0.741	S	S	*	*			trans	-79.7	144.4	172.2	-49.4	0	0	0	0	109.1	E1325	T1323-E1325 HydrophobicContact CG2-CG 4.06Å
1324	I	27.9	Very low	26.2	Very low	158 Å²	158	146 Å²	146	81%	0.81	74%	0.743	S	S	*	*			trans	-119.5	91	161.4	-56.9	179.8	0	0	0	107.6	I1322	I1322-I1324 HydrophobicContact CG2-CG1 4.48Å
1325	E	24.8	Very low	26.2	Very low	155 Å²	155	145.3 Å²	145.3	72%	0.724	74%	0.743	S	S	*	*			trans	-74.4	150.1	153	-64.6	-172.7	119.7	0	0	108.7	T1323	T1323-E1325 HydrophobicContact CG2-CG 4.06Å
1326	N	26.6	Very low	26.3	Very low	148 Å²	148	147.8 Å²	147.8	79%	0.791	75%	0.746	S	S	*	*			trans	171.6	99.2	134.6	-90.7	-15.5	0	0	0	111
1327	N	28.5	Very low	26.1	Very low	127 Å²	127	143.6 Å²	143.6	68%	0.679	74%	0.737	S	S	*	*				157.5	106.2	123.1	-81.1	6.3	0	0	0	108.4
1328	E	27.5	Very low	25.9	Very low	154 Å²	154	145.9 Å²	145.9	72%	0.72	74%	0.74	S	S	*	*				58.9	114.9	89	-65.7	-167.6	166.4	0	0	111.4
1329	N	29.2	Very low	25.8	Very low	119 Å²	119	144.1 Å²	144.1	64%	0.636	74%	0.74	S	S	*	*				-177.9	145.8	71.6	-110.3	-66.5	0	0	0	111.6
1330	N	30.6	Very low	25.9	Very low	116 Å²	116	142.8 Å²	142.8	62%	0.62	74%	0.739	S	S	*	*			trans	63.5	152	162.4	-56.6	-57.8	0	0	0	118.1
1331	K	30.1	Very low	25.5	Very low	172 Å²	172	139.5 Å²	139.5	75%	0.748	73%	0.728	S	S	*	*			cis	-164.8	127.8	-25.3	-111.4	161.8	-173.6	138.2	0	105.4
1332	K	25.2	Very low	25.5	Very low	170 Å²	170	141.6 Å²	141.6	74%	0.739	73%	0.727	S	S	*	*				56.7	92.5	103.5	-168.5	-172.3	178.6	178.5	0	116.3
1333	L	26.3	Very low	25.5	Very low	149 Å²	149	144.8 Å²	144.8	78%	0.78	73%	0.731	S	S	*	*			trans	-173.5	132.6	139.7	-121.2	64.9	0	0	0	105.4
1334	E	24.5	Very low	25.6	Very low	166 Å²	166	143.8 Å²	143.8	78%	0.776	73%	0.728	S	S	*	*			cis	67.9	74.9	29.9	-67.4	-167.2	123.2	0	0	115.9
1335	S	24.9	Very low	25.4	Very low	97 Å²	97	142.9 Å²	142.9	68%	0.678	72%	0.724	S	S	*	*			trans	-169.5	117.9	146.5	12.7	0	0	0	0	107.7
1336	Q	23.4	Very low	25.4	Very low	175 Å²	175	143.2 Å²	143.2	82%	0.818	72%	0.723	S	S	*	*				71.1	115.1	75.9	-74	-168.4	9.3	0	0	115
1337	T	21.8	Very low	25.3	Very low	114 Å²	114	142.9 Å²	142.9	70%	0.699	72%	0.717	S	S	*	*			trans	71.5	141.5	149	67.1	0	0	0	0	121.2
1338	K	21.9	Very low	25.2	Very low	188 Å²	188	140.1 Å²	140.1	82%	0.817	71%	0.705	S	S	*	*			trans	74	125.6	149	-70.5	157.3	-177	174.1	0	119.8
1339	T	23.8	Very low	25.1	Very low	119 Å²	119	137.9 Å²	137.9	73%	0.73	71%	0.706	S	S	*	*			trans	-41	147	149	50.9	0	0	0	0	113.1
1340	P	24.8	Very low	25	Very low	112 Å²	112	136.8 Å²	136.8	73%	0.727	71%	0.707	S	S	*	*				-120.3	152.4	86.2	35.9	-33.5	0	0	0	112.6
1341	S	21.4	Very low	24.8	Very low	84 Å²	84	141.2 Å²	141.2	59%	0.587	72%	0.717	S	S	*	*			cis	76.4	85.7	25.2	87.3	0	0	0	0	116.1
1342	Y	23.5	Very low	24.6	Very low	198 Å²	198	138.1 Å²	138.1	78%	0.776	72%	0.717	S	S	*	*			trans	65.1	161.3	168.8	-62.5	-109.5	0	0	0	114.9
1343	Y	26	Very low	24.9	Very low	210 Å²	210	135.8 Å²	135.8	82%	0.824	72%	0.719	S	S	*	*			cis	-136.4	170.4	7.2	-81	-95	0	0	0	109
1344	S	24.3	Very low	25	Very low	88 Å²	88	133.9 Å²	133.9	62%	0.615	72%	0.719	S	S	*	*			cis	176.4	-178.1	-27	-172.4	0	0	0	0	107.8
1345	I	24	Very low	25.3	Very low	140 Å²	140	133.7 Å²	133.7	72%	0.718	72%	0.721	S	S	*	*			trans	71.4	127.9	164	-62.7	169.4	0	0	0	114.4
1346	K	24.2	Very low	25.6	Very low	162 Å²	162	134.4 Å²	134.4	70%	0.704	72%	0.723	S	S	*	*			cis	-153.5	137.1	7.2	-109.5	161.9	-170.5	162.7	0	108.9
1347	Q	26.1	Very low	25.9	Very low	140 Å²	140	131.6 Å²	131.6	65%	0.654	72%	0.72	S	S	*	*				64.8	137.2	93.5	-72.2	-172.5	-21.6	0	0	116.4
1348	T	24.8	Very low	26.1	Very low	70 Å²	70	136 Å²	136	43%	0.429	73%	0.73	S	S	.	*			cis	-156.9	156.5	4.9	39.3	0	0	0	0	113.5	M1	M1-T1348 PolarHBondContact O-OG1 3.18Å
1349	S	26.6	Very low	26.4	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	73%	0.73	S	S	*	*			trans	64.5	146.2	140	62	0	0	0	0	121.8
1350	S	26.1	Very low	26.5	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	73%	0.728	S	S	*	*			cis	-176.1	170.8	-10.3	49.6	0	0	0	0	113.2
1351	Y	26.2	Very low	26.6	Very low	209 Å²	209	134.1 Å²	134.1	82%	0.82	72%	0.722	S	S	*	*			trans	73.8	90.9	157.7	-76.9	-67.3	0	0	0	121
1352	S	26	Very low	26.8	Very low	108 Å²	108	136.2 Å²	136.2	76%	0.755	73%	0.726	S	S	*	*				-92.3	138.9	125	-67.6	0	0	0	0	109.4	S1354	S1352-S1354 PolarHBondContact O-N 3.1Å
1353	P	32.9	Very low	26.9	Very low	121 Å²	121	134.9 Å²	134.9	79%	0.786	73%	0.727	S	S	*	*			trans	-91.6	89.4	171	33.7	-30.3	0	0	0	110.8
1354	S	27	Very low	26.9	Very low	109 Å²	109	129.2 Å²	129.2	76%	0.762	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-75	140.1	172.2	40.3	0	0	0	0	111.7	S1352	S1352-S1354 PolarHBondContact O-N 3.1Å
1355	I	32	Very low	27.1	Very low	162 Å²	162	131.1 Å²	131.1	83%	0.831	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-72.4	130.4	176.2	-62.5	173.3	0	0	0	108.8
1356	P	29.7	Very low	27.3	Very low	111 Å²	111	130.9 Å²	130.9	72%	0.721	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-79.1	143	-169.9	30.1	-35.7	0	0	0	113.6
1357	P	30	Very low	27.5	Very low	117 Å²	117	129 Å²	129	76%	0.76	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-77.3	159.4	168.2	33.6	-34.7	0	0	0	111.7	P1359	P1357-P1359 WeakPolarHBondContact O-CD 3.39Å
1358	K	26.3	Very low	27.7	Very low	207 Å²	207	130.3 Å²	130.3	90%	0.9	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-74.6	127.9	172	-74.1	-176.1	175	-176.5	0	111.3
1359	P	29.7	Very low	28.1	Very low	126 Å²	126	131.6 Å²	131.6	82%	0.818	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-89.6	145.5	156.3	35	-30.6	0	0	0	110.6	P1357	P1357-P1359 WeakPolarHBondContact O-CD 3.39Å
1360	S	25.5	Very low	28.3	Very low	98 Å²	98	137.5 Å²	137.5	69%	0.685	74%	0.743	S	S	*	*			trans	-155.8	114.8	163.9	57.9	0	0	0	0	109.3
1361	Y	26.8	Very low	28.6	Very low	155 Å²	155	139.8 Å²	139.8	61%	0.608	75%	0.746	S	S	*	*			trans	-173.3	135.7	140.9	-94.4	-54	0	0	0	112.2
1362	L	24.6	Very low	28.8	Very low	128 Å²	128	134.8 Å²	134.8	67%	0.67	73%	0.733	S	S	*	*			trans	53.1	136.5	141.6	-73.2	160.1	0	0	0	123.4
1363	Q	25.5	Very low	29.1	Very low	170 Å²	170	139.3 Å²	139.3	79%	0.794	74%	0.735	S	S	*	*			trans	69.3	140.9	147.4	-77.9	159.2	-63.3	0	0	118
1364	S	26.1	Very low	29.1	Very low	90 Å²	90	141 Å²	141	63%	0.629	73%	0.732	S	S	*	*			cis	-152.1	168.3	-1.6	66.4	0	0	0	0	113.2
1365	N	28.3	Very low	29.3	Very low	129 Å²	129	140.9 Å²	140.9	69%	0.69	73%	0.731	S	S	*	*			trans	56.8	105.9	145.5	-64.5	-5.2	0	0	0	121.1
1366	N	28.2	Very low	29.2	Very low	134 Å²	134	143.2 Å²	143.2	72%	0.717	73%	0.729	S	S	*	*				85.8	141.6	118.5	-63.8	-14	0	0	0	122.2
1367	N	30.3	Very low	29.2	Very low	122 Å²	122	143.9 Å²	143.9	65%	0.652	72%	0.723	S	S	*	*			trans	83.4	106.2	150.3	-66.1	-16.5	0	0	0	120.8
1368	Q	30	Very low	29.2	Very low	168 Å²	168	144.3 Å²	144.3	79%	0.785	72%	0.719	S	S	*	*				69.4	130.2	122.3	-62.6	165.5	1.1	0	0	117.1
1369	S	32.7	Very low	29.4	Very low	98 Å²	98	140.4 Å²	140.4	69%	0.685	71%	0.708	S	S	*	*			cis	-156.2	152.9	29.8	-60.8	0	0	0	0	113.7
1370	R	30.7	Very low	29.6	Very low	229 Å²	229	140.8 Å²	140.8	86%	0.864	70%	0.703	S	S	*	*			trans	44	141.2	133.7	-65.5	178.8	170.2	166.3	-3.1	119.8
1371	I	33	Very low	29.9	Very low	145 Å²	145	141.5 Å²	141.5	74%	0.744	70%	0.703	S	S	*	*			cis	-139.3	126.9	27.1	-63.9	174.3	0	0	0	111.9
1372	I	30.7	Very low	29.9	Very low	103 Å²	103	139.3 Å²	139.3	53%	0.528	71%	0.706	S	S	.	*				25.2	138.2	123.4	-24.2	176.6	0	0	0	117.9
1373	Y	32.2	Very low	30.1	Very low	204 Å²	204	138.5 Å²	138.5	80%	0.8	71%	0.707	S	S	*	*			cis	-129.6	149.4	17.6	-64.7	-102.8	0	0	0	110.5
1374	Q	31.2	Very low	30.2	Very low	157 Å²	157	135.9 Å²	135.9	73%	0.734	70%	0.702	S	S	*	*			cis	99.8	137.5	17.4	-161.2	-177.7	29.7	0	0	115.5
1375	S	31	Very low	30.3	Very low	105 Å²	105	136.6 Å²	136.6	73%	0.734	70%	0.703	S	S	*	*			trans	85.8	143	166.6	-63	0	0	0	0	119.3
1376	R	30.2	Very low	30.3	Very low	212 Å²	212	137.1 Å²	137.1	80%	0.8	71%	0.706	S	S	*	*			cis	-156.5	149.6	-23.1	-168.8	161.5	-173.4	163.6	7.3	112.7
1377	E	30.4	Very low	30.3	Very low	125 Å²	125	136.3 Å²	136.3	58%	0.584	71%	0.706	S	S	*	*			trans	-37.4	162.3	172.4	-42	157.7	122.9	0	0	120.7
1378	N	29.7	Very low	30.3	Very low	126 Å²	126	135.7 Å²	135.7	67%	0.674	71%	0.707	S	S	*	*				99.5	131.2	125.1	-85.1	-6.5	0	0	0	124.9
1379	N	31.1	Very low	30.2	Very low	124 Å²	124	134.3 Å²	134.3	66%	0.663	71%	0.705	S	S	*	*				108.6	145.9	126.1	-81.4	3.8	0	0	0	123.1
1380	N	33.6	Very low	30	Very low	134 Å²	134	134.7 Å²	134.7	72%	0.717	70%	0.703	S	S	*	*			trans	76.2	139.4	153.5	-71.2	7.9	0	0	0	118.3
1381	T	31.2	Very low	29.9	Very low	114 Å²	114	129.1 Å²	129.1	70%	0.699	70%	0.695	S	S	*	*			cis	149.7	151.6	-8.8	38.2	0	0	0	0	105
1382	T	28.3	Very low	29.8	Very low	109 Å²	109	128.7 Å²	128.7	67%	0.669	70%	0.699	S	S	*	*			cis	-167.7	170.4	-21.8	-57.9	0	0	0	0	106.5
1383	T	27.5	Very low	29.7	Very low	111 Å²	111	127.1 Å²	127.1	68%	0.681	70%	0.702	S	S	*	*			trans	70.7	106.9	148	24	0	0	0	0	122.5
1384	T	27.1	Very low	29.6	Very low	114 Å²	114	124.4 Å²	124.4	70%	0.699	70%	0.701	S	S	*	*				71.7	140.5	118.7	54.2	0	0	0	0	126.1
1385	T	28.2	Very low	29.6	Very low	106 Å²	106	123.1 Å²	123.1	65%	0.65	70%	0.699	S	S	*	*			trans	79.5	104.1	136.8	48.2	0	0	0	0	123.2
1386	N	28.7	Very low	29.6	Very low	139 Å²	139	123.5 Å²	123.5	74%	0.743	69%	0.693	S	S	*	*				91.6	136.1	112.8	-69.7	4.9	0	0	0	123.8
1387	T	29.1	Very low	29.7	Very low	117 Å²	117	119.4 Å²	119.4	72%	0.718	69%	0.687	S	S	*	*			trans	77.4	117.3	141.2	41.9	0	0	0	0	122.7
1388	T	28.8	Very low	29.7	Very low	109 Å²	109	121.4 Å²	121.4	67%	0.669	70%	0.696	S	S	*	*			trans	73.8	129.8	133.7	53.9	0	0	0	0	122.3
1389	N	29.7	Very low	29.7	Very low	140 Å²	140	123 Å²	123	75%	0.749	70%	0.699	S	S	*	*			trans	70.6	151.5	141	-60.9	-2.8	0	0	0	118.4
1390	T	27.8	Very low	29.7	Very low	106 Å²	106	122.7 Å²	122.7	65%	0.65	70%	0.697	S	S	*	*			cis	-158.4	160.3	-27.8	20.5	0	0	0	0	108.2
1391	T	28.2	Very low	29.6	Very low	112 Å²	112	123.8 Å²	123.8	69%	0.687	70%	0.701	S	S	*	*			trans	54.1	134.9	151.1	47.9	0	0	0	0	121.8
1392	T	30.3	Very low	29.9	Very low	135 Å²	135	123.5 Å²	123.5	83%	0.828	70%	0.701	S	S	*	*			trans	64	158.9	146.6	50.8	0	0	0	0	119.5
1393	A	29.1	Very low	30	Very low	71 Å²	71	123.4 Å²	123.4	59%	0.587	71%	0.705	S	S	*	*			cis	-170.2	141.9	-35.5	0	0	0	0	0	109.6
1394	N	29.8	Very low	30.2	Very low	147 Å²	147	129.6 Å²	129.6	79%	0.786	72%	0.716	S	S	*	*			trans	62.6	165	160.6	-53.1	-8.3	0	0	0	117.9
1395	N	31.5	Very low	30.2	Very low	130 Å²	130	129.7 Å²	129.7	70%	0.695	72%	0.716	S	S	*	*			trans	63.7	149.4	160.3	-65.7	36.6	0	0	0	117.5
1396	D	31.8	Very low	30.4	Very low	112 Å²	112	135 Å²	135	60%	0.599	73%	0.731	S	S	*	*			cis	-159	173.7	-14.4	-99.1	-14.7	0	0	0	108.8
1397	D	32.1	Very low	30.4	Very low	126 Å²	126	133 Å²	133	67%	0.674	73%	0.727	S	S	*	*			trans	56.8	120.3	151.2	-56.4	-17.3	0	0	0	120.7
1398	E	30.8	Very low	30.6	Very low	167 Å²	167	138.9 Å²	138.9	78%	0.78	74%	0.736	S	S	*	*				82.8	149.5	104.8	-72.8	-169.8	168.5	0	0	114
1399	E	29.1	Very low	30.5	Very low	159 Å²	159	138.9 Å²	138.9	74%	0.743	74%	0.741	S	S	*	*			cis	177.9	-148.7	-23.8	-162.2	-136.7	136.2	0	0	103.3
1400	I	30.7	Very low	30.6	Very low	118 Å²	118	135.9 Å²	135.9	61%	0.605	74%	0.743	S	S	*	*			trans	72.3	92.6	148.9	-70.6	164.7	0	0	0	117.9
1401	I	31.6	Very low	30.6	Very low	158 Å²	158	139.2 Å²	139.2	81%	0.81	75%	0.751	S	S	*	*				121.2	136.8	125.1	-80.3	174.6	0	0	0	119.3
1402	P	37.1	Very low	30.8	Very low	107 Å²	107	141.4 Å²	141.4	70%	0.695	76%	0.757	S	S	*	*			trans	-136.4	-140.3	-154.1	42.7	-20	0	0	0	113
1403	S	30.1	Very low	30.7	Very low	107 Å²	107	142.1 Å²	142.1	75%	0.748	76%	0.756	S	S	*	*			trans	93.2	148.2	170.1	-33.9	0	0	0	0	115.3
1404	R	32.6	Very low	30.7	Very low	241 Å²	241	143.3 Å²	143.3	91%	0.909	76%	0.76	S	S	*	*			cis	-128.8	155.8	5.1	-80.8	-174.3	169.7	167.9	-2.4	113
1405	T	28	Very low	31	Very low	117 Å²	117	142.8 Å²	142.8	72%	0.718	76%	0.763	S	S	*	*			trans	-75.3	155	169.3	50.2	0	0	0	0	113.5
1406	F	31.9	Very low	31.2	Very low	217 Å²	217	144 Å²	144	95%	0.952	77%	0.767	S	S	*	*			trans	-140	137.3	139.4	-123.9	-83.6	0	0	0	109.9
1407	S	28.2	Very low	31.7	Very low	96 Å²	96	143.2 Å²	143.2	67%	0.671	77%	0.769	S	S	*	*			trans	-134.6	135.4	-163.7	-45.8	0	0	0	0	111.4
1408	R	32.4	Very low	32.5	Very low	241 Å²	241	140.5 Å²	140.5	91%	0.909	76%	0.757	S	S	*	*			trans	-154.9	123.9	141.4	-151.6	156.9	-174.3	172.5	0.3	114.1
1409	S	27.5	Very low	33.1	Very low	110 Å²	110	139.7 Å²	139.7	77%	0.769	75%	0.751	S	S	*	*			trans	-29.9	141.5	169.3	53.2	0	0	0	0	118.9
1410	G	31.3	Very low	34	Very low	77 Å²	77	138.8 Å²	138.8	79%	0.794	75%	0.747	S	S	*	*			trans	-175.2	100.1	160.1	0	0	0	0	0	110.6
1411	E	28.2	Very low	35.4	Very low	175 Å²	175	137.2 Å²	137.2	82%	0.818	74%	0.739	S	S	*	*			trans	-86	125.5	-169.4	-61.1	175.9	105.4	0	0	113.8
1412	I	33.5	Very low	36.6	Very low	158 Å²	158	135 Å²	135	81%	0.81	73%	0.726	S	S	*	*			trans	-142.3	105.6	140.7	-55.1	-177	0	0	0	108.1
1413	N	27.6	Very low	37.3	Very low	150 Å²	150	131.5 Å²	131.5	80%	0.802	71%	0.705	S	S	*	*			trans	-85.1	114.6	177.6	-86.8	-46.7	0	0	0	111.6
1414	S	30	Very low	38.9	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	70%	0.695	S	S	*	*			trans	-147.5	76.7	164.7	52.9	0	0	0	0	111.6	I1416	S1414-I1416 PolarHBondContact O-N 3.32Å
1415	T	35.1	Very low	40.6	Very low	137 Å²	137	126.6 Å²	126.6	84%	0.84	68%	0.681	S	S	*	*			trans	-64.5	104.4	174	8.9	0	0	0	0	110.3	P1417	T1415-P1417 WeakPolarHBondContact O-CD 3.43Å
1416	I	34.9	Very low	42.1	Very low	154 Å²	154	122.9 Å²	122.9	79%	0.79	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-60	120	177.7	-59.5	174.3	0	0	0	108.7	S1414 T1418	S1414-I1416 PolarHBondContact O-N 3.32Å; I1416-T1418 PolarHBondContact O-N 2.86Å
1417	P	43.1	Very low	43.1	Very low	97 Å²	97	116.8 Å²	116.8	63%	0.63	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-61.2	137.8	177.2	-21.8	33.1	0	0	0	110.7	T1415 D1421	T1415-P1417 WeakPolarHBondContact O-CD 3.43Å; P1417-D1421 HydrophobicContact CB-CB 4.33Å
1418	T	49.1	Very low	45	Very low	69 Å²	69	118.6 Å²	118.6	42%	0.423	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-68.2	160.8	174.7	69.8	0	0	0	0	110.5	I1416 E1420 D1421 H1422	I1416-T1418 PolarHBondContact O-N 2.86Å; T1418-E1420 PolarHBondContact O-N 2.91Å; T1418-E1420 PolarHBondContact OG1-N 3.15Å; T1418-D1421 WeakPolarHBondContact CB-OD2 3.32Å; T1418-D1421 WeakPolarHBondContact CG2-OD2 3.34Å; T1418-D1421 PolarHBondContact N-OD2 3.29Å; T1418-D1421 PolarHBondContact O-N 3.1Å; T1418-D1421 PolarHBondContact OG1-N 3.18Å; T1418-D1421 PolarHBondContact OG1-OD2 3.13Å; T1418-H1422 PolarHBondContact O-N 3.09Å; T1418-H1422 VanDerWaalsContact O-N 3.12Å
1419	F	42.8	Very low	46.8	Very low	149 Å²	149	114.2 Å²	114.2	65%	0.654	61%	0.614	S	S	*	*	H	α-helix	trans	-60	-33.3	172	179.9	-100.2	0	0	0	111.3	H1422 A1423	F1419-H1422 PolarHBondContact O-N 3.2Å; F1419-A1423 WeakPolarHBondContact O-CB 3.27Å; F1419-A1423 PolarHBondContact O-N 3.49Å
1420	E	48.8	Very low	48.4	Very low	141 Å²	141	112.9 Å²	112.9	66%	0.659	60%	0.601	S	S	*	*	H	α-helix	trans	-67.3	-43.5	175.6	-62.9	-177.7	117.5	0	0	111.5	T1418 H1422 A1423 I1424	T1418-E1420 PolarHBondContact O-N 2.91Å; T1418-E1420 PolarHBondContact OG1-N 3.15Å; E1420-H1422 VanDerWaalsContact C-N 3.32Å; E1420-H1422 PolarHBondContact O-N 2.83Å; E1420-A1423 PolarHBondContact O-N 2.87Å; E1420-I1424 WeakPolarHBondContact O-CB 3.38Å; E1420-I1424 VanDerWaalsContact O-CG1 3.23Å; E1420-I1424 WeakPolarHBondContact O-CG1 3.42Å; E1420-I1424 PolarHBondContact O-N 3Å
1421	D	59.2	Low	49.7	Very low	85 Å²	85	113 Å²	113	46%	0.455	59%	0.587	S	S	.	*	H	α-helix	trans	-56.8	-45.7	173.3	-68.4	-61	0	0	0	111.5	P1417 T1418 K1425	P1417-D1421 HydrophobicContact CB-CB 4.33Å; T1418-D1421 WeakPolarHBondContact CB-OD2 3.32Å; T1418-D1421 WeakPolarHBondContact CG2-OD2 3.34Å; T1418-D1421 PolarHBondContact N-OD2 3.29Å; T1418-D1421 PolarHBondContact O-N 3.1Å; T1418-D1421 PolarHBondContact OG1-N 3.18Å; T1418-D1421 PolarHBondContact OG1-OD2 3.13Å; D1421-K1425 WeakPolarHBondContact O-CB 3.33Å; D1421-K1425 PolarHBondContact O-N 3.37Å
1422	H	57.6	Low	51.5	Low	112 Å²	112	108.6 Å²	108.6	52%	0.519	57%	0.569	S	S	.	*	H	α-helix	trans	-68.8	-37.6	179.2	-164.9	-88.4	0	0	0	112	T1418 F1419 E1420 S1426	T1418-H1422 PolarHBondContact O-N 3.09Å; T1418-H1422 VanDerWaalsContact O-N 3.12Å; F1419-H1422 PolarHBondContact O-N 3.2Å; E1420-H1422 VanDerWaalsContact C-N 3.32Å; E1420-H1422 PolarHBondContact O-N 2.83Å; H1422-S1426 PolarHBondContact CE1-OG 3.49Å; H1422-S1426 PolarHBondContact ND1-OG 2.8Å; H1422-S1426 WeakPolarHBondContact O-CB 3.48Å; H1422-S1426 PolarHBondContact O-N 3.39Å; H1422-S1426 PolarHBondContact O-OG 2.84Å
1423	A	51.2	Low	53	Low	32 Å²	32	108.2 Å²	108.2	26%	0.264	56%	0.562	S	S	.	*	H	α-helix	trans	-65.1	-46.7	174.8	0	0	0	0	0	111.9	F1419 E1420 S1426 M1427	F1419-A1423 WeakPolarHBondContact O-CB 3.27Å; F1419-A1423 PolarHBondContact O-N 3.49Å; E1420-A1423 PolarHBondContact O-N 2.87Å; A1423-S1426 PolarHBondContact O-N 2.88Å; A1423-M1427 WeakPolarHBondContact O-CB 3.22Å; A1423-M1427 WeakPolarHBondContact O-CG 3.2Å; A1423-M1427 PolarHBondContact O-N 3.18Å
1424	I	64.2	Low	54.5	Low	106 Å²	106	104.3 Å²	104.3	54%	0.544	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-46.2	177.6	-68.5	164.7	0	0	0	110.6	E1420 S1426 M1427 K1428	E1420-I1424 WeakPolarHBondContact O-CB 3.38Å; E1420-I1424 VanDerWaalsContact O-CG1 3.23Å; E1420-I1424 WeakPolarHBondContact O-CG1 3.42Å; E1420-I1424 PolarHBondContact O-N 3Å; I1424-S1426 VanDerWaalsContact C-N 3.3Å; I1424-S1426 PolarHBondContact O-N 3.14Å; I1424-M1427 HydrophobicContact CG1-CE 4.46Å; I1424-M1427 PolarHBondContact O-N 2.89Å; I1424-K1428 WeakPolarHBondContact O-CB 3.2Å; I1424-K1428 PolarHBondContact O-N 3.12Å
1425	K	68.5	Low	55.9	Low	140 Å²	140	105.8 Å²	105.8	61%	0.609	54%	0.539	S	S	*	.	H	α-helix	trans	-68.1	-29.6	178.8	-159.9	167.7	-167.5	169.1	0	112.1	D1421 R1429	D1421-K1425 WeakPolarHBondContact O-CB 3.33Å; D1421-K1425 PolarHBondContact O-N 3.37Å; K1425-R1429 VanDerWaalsContact O-CG 3.28Å; K1425-R1429 WeakPolarHBondContact O-CG 3.29Å; K1425-R1429 PolarHBondContact O-N 2.85Å; K1425-R1429 VanDerWaalsContact O-N 3.14Å
1426	S	58.1	Low	57.4	Low	38 Å²	38	107.8 Å²	107.8	27%	0.266	54%	0.536	S	S	.	.	H	α-helix	trans	-74.3	-44.5	172.5	-61.8	0	0	0	0	112.2	H1422 A1423 I1424 R1429 V1430	H1422-S1426 PolarHBondContact CE1-OG 3.49Å; H1422-S1426 PolarHBondContact ND1-OG 2.8Å; H1422-S1426 WeakPolarHBondContact O-CB 3.48Å; H1422-S1426 PolarHBondContact O-N 3.39Å; H1422-S1426 PolarHBondContact O-OG 2.84Å; A1423-S1426 PolarHBondContact O-N 2.88Å; I1424-S1426 VanDerWaalsContact C-N 3.3Å; I1424-S1426 PolarHBondContact O-N 3.14Å; S1426-R1429 PolarHBondContact O-N 3.39Å; S1426-V1430 WeakPolarHBondContact O-CG2 3.5Å; S1426-V1430 PolarHBondContact O-N 2.88Å
1427	M	53	Low	58.6	Low	89 Å²	89	105.5 Å²	105.5	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-59.3	-47.2	172.8	-77.1	-173.1	-72.7	0	0	110.8	A1423 I1424 R1429 V1430 T1431	A1423-M1427 WeakPolarHBondContact O-CB 3.22Å; A1423-M1427 WeakPolarHBondContact O-CG 3.2Å; A1423-M1427 PolarHBondContact O-N 3.18Å; I1424-M1427 HydrophobicContact CG1-CE 4.46Å; I1424-M1427 PolarHBondContact O-N 2.89Å; M1427-R1429 PolarHBondContact O-N 2.86Å; M1427-V1430 CarbonylContact O-C 3.35Å; M1427-V1430 WeakPolarHBondContact O-CA 3.46Å; M1427-V1430 WeakPolarHBondContact O-CB 3.31Å; M1427-V1430 PolarHBondContact O-N 2.9Å; M1427-T1431 PolarHBondContact O-N 2.91Å; M1427-T1431 PolarHBondContact O-OG1 3.38Å; M1427-T1431 VanDerWaalsContact O-OG1 3.06Å
1428	K	69.8	Low	58.5	Low	135 Å²	135	105 Å²	105	59%	0.587	52%	0.515	S	S	*	.	H	α-helix	trans	-58.9	-45.8	177.9	-162.9	173.5	-178.1	176.7	0	112	I1424 V1430 T1431 D1432	I1424-K1428 WeakPolarHBondContact O-CB 3.2Å; I1424-K1428 PolarHBondContact O-N 3.12Å; K1428-V1430 VanDerWaalsContact C-N 3.25Å; K1428-V1430 PolarHBondContact O-N 3.14Å; K1428-T1431 PolarHBondContact O-N 3.28Å; K1428-T1431 VanDerWaalsContact O-N 3.14Å; K1428-D1432 WeakPolarHBondContact O-CB 3.5Å; K1428-D1432 PolarHBondContact O-N 3.36Å
1429	R	69	Low	58.2	Low	148 Å²	148	106.3 Å²	106.3	56%	0.558	52%	0.519	S	S	*	.	H	α-helix	trans	-56.8	-34.1	172	-78.1	170.2	174.9	167.5	-3	113.8	K1425 S1426 M1427 K1433	K1425-R1429 VanDerWaalsContact O-CG 3.28Å; K1425-R1429 WeakPolarHBondContact O-CG 3.29Å; K1425-R1429 PolarHBondContact O-N 2.85Å; K1425-R1429 VanDerWaalsContact O-N 3.14Å; S1426-R1429 PolarHBondContact O-N 3.39Å; M1427-R1429 PolarHBondContact O-N 2.86Å; R1429-K1433 WeakPolarHBondContact O-CB 3.08Å; R1429-K1433 WeakPolarHBondContact O-CG 3.35Å; R1429-K1433 PolarHBondContact O-N 3.03Å; R1429-K1433 VanDerWaalsContact O-N 3.1Å
1430	V	61.7	Low	58.1	Low	82 Å²	82	102.9 Å²	102.9	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-73.6	-44.7	175.8	171.9	0	0	0	0	110.3	S1426 M1427 K1428 K1433 V1434	S1426-V1430 WeakPolarHBondContact O-CG2 3.5Å; S1426-V1430 PolarHBondContact O-N 2.88Å; M1427-V1430 CarbonylContact O-C 3.35Å; M1427-V1430 WeakPolarHBondContact O-CA 3.46Å; M1427-V1430 WeakPolarHBondContact O-CB 3.31Å; M1427-V1430 PolarHBondContact O-N 2.9Å; K1428-V1430 VanDerWaalsContact C-N 3.25Å; K1428-V1430 PolarHBondContact O-N 3.14Å; V1430-K1433 PolarHBondContact O-N 3.46Å; V1430-V1434 HydrophobicContact CG1-CG2 4.31Å; V1430-V1434 WeakPolarHBondContact O-CB 3.26Å; V1430-V1434 VanDerWaalsContact O-CG2 3.29Å; V1430-V1434 WeakPolarHBondContact O-CG2 3.27Å; V1430-V1434 PolarHBondContact O-N 3.42Å
1431	T	57.6	Low	57.9	Low	79 Å²	79	103.1 Å²	103.1	49%	0.485	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-49	174.6	-44	0	0	0	0	111.2	M1427 K1428 K1433 V1434 Q1435	M1427-T1431 PolarHBondContact O-N 2.91Å; M1427-T1431 PolarHBondContact O-OG1 3.38Å; M1427-T1431 VanDerWaalsContact O-OG1 3.06Å; K1428-T1431 PolarHBondContact O-N 3.28Å; K1428-T1431 VanDerWaalsContact O-N 3.14Å; T1431-K1433 VanDerWaalsContact C-N 3.32Å; T1431-K1433 PolarHBondContact O-N 3.4Å; T1431-V1434 PolarHBondContact O-N 2.96Å; T1431-V1434 VanDerWaalsContact O-N 3.14Å; T1431-Q1435 WeakPolarHBondContact O-CB 3.3Å; T1431-Q1435 PolarHBondContact O-N 2.87Å
1432	D	67.4	Low	57.1	Low	84 Å²	84	105.8 Å²	105.8	45%	0.449	52%	0.523	S	S	.	.	H	α-helix	trans	-58.9	-41.8	177.9	-60.9	-21.9	0	0	0	111.1	K1428 K1436	K1428-D1432 WeakPolarHBondContact O-CB 3.5Å; K1428-D1432 PolarHBondContact O-N 3.36Å; D1432-K1436 WeakPolarHBondContact O-CB 3.45Å; D1432-K1436 PolarHBondContact O-N 3.01Å
1433	K	65	Low	56.2	Low	150 Å²	150	104.6 Å²	104.6	65%	0.652	52%	0.519	S	S	*	.	H	α-helix	trans	-66.5	-44.2	173.5	-88.3	-170.4	172.1	-173.4	0	112.6	R1429 V1430 T1431 K1436 I1437	R1429-K1433 WeakPolarHBondContact O-CB 3.08Å; R1429-K1433 WeakPolarHBondContact O-CG 3.35Å; R1429-K1433 PolarHBondContact O-N 3.03Å; R1429-K1433 VanDerWaalsContact O-N 3.1Å; V1430-K1433 PolarHBondContact O-N 3.46Å; T1431-K1433 VanDerWaalsContact C-N 3.32Å; T1431-K1433 PolarHBondContact O-N 3.4Å; K1433-K1436 PolarHBondContact O-N 3.37Å; K1433-I1437 VanDerWaalsContact O-CB 3.32Å; K1433-I1437 WeakPolarHBondContact O-CB 3.32Å; K1433-I1437 WeakPolarHBondContact O-CD1 3.42Å; K1433-I1437 WeakPolarHBondContact O-CG1 3.45Å; K1433-I1437 PolarHBondContact O-N 3.26Å
1434	V	58.5	Low	55.6	Low	68 Å²	68	108.3 Å²	108.3	41%	0.412	54%	0.535	S	S	.	.	H	α-helix	trans	-64.2	-44.2	-179.9	163.4	0	0	0	0	110.3	V1430 T1431 I1437 M1438	V1430-V1434 HydrophobicContact CG1-CG2 4.31Å; V1430-V1434 WeakPolarHBondContact O-CB 3.26Å; V1430-V1434 VanDerWaalsContact O-CG2 3.29Å; V1430-V1434 WeakPolarHBondContact O-CG2 3.27Å; V1430-V1434 PolarHBondContact O-N 3.42Å; T1431-V1434 PolarHBondContact O-N 2.96Å; T1431-V1434 VanDerWaalsContact O-N 3.14Å; V1434-I1437 PolarHBondContact O-N 3.12Å; V1434-M1438 HydrophobicContact CG1-CE 3.58Å; V1434-M1438 HydrophobicContact CG1-SD 4.02Å; V1434-M1438 WeakPolarHBondContact O-CB 3.41Å; V1434-M1438 VanDerWaalsContact O-CG 3.31Å; V1434-M1438 WeakPolarHBondContact O-CG 3.28Å; V1434-M1438 PolarHBondContact O-N 3.17Å
1435	Q	60	Low	54.4	Low	126 Å²	126	109.2 Å²	109.2	59%	0.589	54%	0.541	S	S	*	.	H	α-helix	trans	-65.4	-40.9	176.8	-165.6	159.1	-13.8	0	0	111.7	T1431 I1437 M1438 N1439	T1431-Q1435 WeakPolarHBondContact O-CB 3.3Å; T1431-Q1435 PolarHBondContact O-N 2.87Å; Q1435-I1437 VanDerWaalsContact C-N 3.32Å; Q1435-I1437 PolarHBondContact O-N 3.21Å; Q1435-M1438 PolarHBondContact O-N 3.11Å; Q1435-N1439 PolarHBondContact O-N 3.26Å
1436	K	65.7	Low	53	Low	179 Å²	179	106.9 Å²	106.9	78%	0.778	54%	0.538	S	S	*	.	H	α-helix	trans	-71.5	-19.4	174.2	-168.3	164.7	-174.1	168.2	0	114.5	D1432 K1433	D1432-K1436 WeakPolarHBondContact O-CB 3.45Å; D1432-K1436 PolarHBondContact O-N 3.01Å; K1433-K1436 PolarHBondContact O-N 3.37Å
1437	I	59.4	Low	52	Low	106 Å²	106	108.8 Å²	108.8	54%	0.544	55%	0.548	S	S	.	.	H	α-helix	trans	-86.3	-34.4	172.7	-73.2	165.6	0	0	0	111.3	K1433 V1434 Q1435 N1439	K1433-I1437 VanDerWaalsContact O-CB 3.32Å; K1433-I1437 WeakPolarHBondContact O-CB 3.32Å; K1433-I1437 WeakPolarHBondContact O-CD1 3.42Å; K1433-I1437 WeakPolarHBondContact O-CG1 3.45Å; K1433-I1437 PolarHBondContact O-N 3.26Å; V1434-I1437 PolarHBondContact O-N 3.12Å; Q1435-I1437 VanDerWaalsContact C-N 3.32Å; Q1435-I1437 PolarHBondContact O-N 3.21Å; I1437-N1439 VanDerWaalsContact C-N 3.33Å
1438	M	42.4	Very low	51.3	Low	86 Å²	86	110.6 Å²	110.6	42%	0.424	56%	0.56	S	S	.	*	H	α-helix	trans	-77.9	-14.9	-179.3	-70.4	-174.2	-49.7	0	0	114	V1434 Q1435 L1440	V1434-M1438 HydrophobicContact CG1-CE 3.58Å; V1434-M1438 HydrophobicContact CG1-SD 4.02Å; V1434-M1438 WeakPolarHBondContact O-CB 3.41Å; V1434-M1438 VanDerWaalsContact O-CG 3.31Å; V1434-M1438 WeakPolarHBondContact O-CG 3.28Å; V1434-M1438 PolarHBondContact O-N 3.17Å; Q1435-M1438 PolarHBondContact O-N 3.11Å; M1438-L1440 HydrophobicContact CB-CD1 3.93Å; M1438-L1440 HydrophobicContact CB-CG 4.31Å; M1438-L1440 HydrophobicContact CE-CD1 3.87Å; M1438-L1440 PolarHBondContact O-N 3.44Å
1439	N	43	Very low	49.9	Very low	97 Å²	97	108.5 Å²	108.5	52%	0.519	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	49.3	41.4	166.8	-143.4	51.9	0	0	0	113.6	Q1435 I1437 D1441 Q1442	Q1435-N1439 PolarHBondContact O-N 3.26Å; I1437-N1439 VanDerWaalsContact C-N 3.33Å; N1439-D1441 PolarHBondContact O-N 2.87Å; N1439-D1441 VanDerWaalsContact O-N 3.11Å; N1439-Q1442 PolarHBondContact O-N 2.8Å
1440	L	40.8	Very low	48.4	Very low	78 Å²	78	107.2 Å²	107.2	41%	0.408	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-62.8	-20.8	-164.6	-93.4	142.9	0	0	0	114.6	M1438 Q1442 I1443	M1438-L1440 HydrophobicContact CB-CD1 3.93Å; M1438-L1440 HydrophobicContact CB-CG 4.31Å; M1438-L1440 HydrophobicContact CE-CD1 3.87Å; M1438-L1440 PolarHBondContact O-N 3.44Å; L1440-Q1442 PolarHBondContact O-N 2.88Å; L1440-I1443 HydrophobicContact CD2-CD1 3.94Å; L1440-I1443 HydrophobicContact CG-CD1 4.47Å; L1440-I1443 WeakPolarHBondContact O-CB 3.33Å; L1440-I1443 PolarHBondContact O-N 3.07Å
1441	D	44.2	Very low	47.2	Very low	145 Å²	145	108 Å²	108	78%	0.775	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-62	-6.8	-179.3	-49.3	-17.4	0	0	0	114.1	N1439	N1439-D1441 PolarHBondContact O-N 2.87Å; N1439-D1441 VanDerWaalsContact O-N 3.11Å
1442	Q	43.1	Very low	46.4	Very low	141 Å²	141	109.4 Å²	109.4	66%	0.659	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-98.2	-11.6	170.4	-67.7	-165.3	-6.9	0	0	114.6	N1439 L1440	N1439-Q1442 PolarHBondContact O-N 2.8Å; L1440-Q1442 PolarHBondContact O-N 2.88Å
1443	I	38.3	Very low	44.9	Very low	88 Å²	88	112.9 Å²	112.9	45%	0.451	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	-34.5	-174.4	-64.4	-175.1	0	0	0	111.7	L1440 N1445 V1446 T1447	L1440-I1443 HydrophobicContact CD2-CD1 3.94Å; L1440-I1443 HydrophobicContact CG-CD1 4.47Å; L1440-I1443 WeakPolarHBondContact O-CB 3.33Å; L1440-I1443 PolarHBondContact O-N 3.07Å; I1443-N1445 PolarHBondContact O-N 3.06Å; I1443-N1445 VanDerWaalsContact O-N 3.15Å; I1443-V1446 PolarHBondContact O-N 3.11Å; I1443-T1447 PolarHBondContact O-N 2.9Å; I1443-T1447 PolarHBondContact O-OG1 3.4Å; I1443-T1447 VanDerWaalsContact O-OG1 3.13Å
1444	D	38.1	Very low	43.3	Very low	109 Å²	109	113.4 Å²	113.4	58%	0.583	60%	0.598	S	S	*	*	H	α-helix	trans	-61.9	-24.7	-179.4	-69.8	-25.7	0	0	0	113.7	N1448	D1444-N1448 PolarHBondContact O-ND2 3.48Å
1445	N	39.4	Very low	42.1	Very low	125 Å²	125	118 Å²	118	67%	0.668	62%	0.62	S	S	*	*	H	α-helix	trans	-75.9	-21.9	173.4	-74.5	-35.3	0	0	0	113.6	I1443	I1443-N1445 PolarHBondContact O-N 3.06Å; I1443-N1445 VanDerWaalsContact O-N 3.15Å
1446	V	37.5	Very low	40.8	Very low	91 Å²	91	120 Å²	120	55%	0.552	63%	0.634	S	S	*	*	H	α-helix	trans	-85.3	-40.4	177.4	-176.7	0	0	0	0	110.6	I1443 N1448 S1449	I1443-V1446 PolarHBondContact O-N 3.11Å; V1446-N1448 VanDerWaalsContact C-N 3.29Å; V1446-N1448 PolarHBondContact O-N 3.29Å; V1446-S1449 PolarHBondContact O-N 3.04Å; V1446-S1449 VanDerWaalsContact O-N 3.1Å
1447	T	37.8	Very low	39.2	Very low	78 Å²	78	116.9 Å²	116.9	48%	0.479	63%	0.632	S	S	.	*	H	α-helix	trans	-57.8	-41.7	-179.5	-37.9	0	0	0	0	112	I1443 S1449 I1450	I1443-T1447 PolarHBondContact O-N 2.9Å; I1443-T1447 PolarHBondContact O-OG1 3.4Å; I1443-T1447 VanDerWaalsContact O-OG1 3.13Å; T1447-S1449 PolarHBondContact O-N 2.81Å; T1447-I1450 PolarHBondContact O-N 3.16Å
1448	N	39.3	Very low	38	Very low	128 Å²	128	117.7 Å²	117.7	68%	0.684	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-10.7	-179.9	-75.8	-60.2	0	0	0	114.8	D1444 V1446	D1444-N1448 PolarHBondContact O-ND2 3.48Å; V1446-N1448 VanDerWaalsContact C-N 3.29Å; V1446-N1448 PolarHBondContact O-N 3.29Å
1449	S	39.3	Very low	37.4	Very low	90 Å²	90	122 Å²	122	63%	0.629	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-8.9	178.6	-63.9	0	0	0	0	114.2	V1446 T1447	V1446-S1449 PolarHBondContact O-N 3.04Å; V1446-S1449 VanDerWaalsContact O-N 3.1Å; T1447-S1449 PolarHBondContact O-N 2.81Å
1450	I	37.6	Very low	36.8	Very low	122 Å²	122	121.7 Å²	121.7	63%	0.626	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-20.5	-169.7	-65	177.5	0	0	0	113.1	T1447 S1452	T1447-I1450 PolarHBondContact O-N 3.16Å; I1450-S1452 PolarHBondContact O-N 3.39Å; I1450-S1452 VanDerWaalsContact O-N 3.08Å
1451	D	36.8	Very low	36.4	Very low	98 Å²	98	125.1 Å²	125.1	52%	0.524	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.9	-5.9	-179.2	-93.5	-47.2	0	0	0	115	I1453 K1454	D1451-I1453 VanDerWaalsContact C-N 3.28Å; D1451-I1453 PolarHBondContact O-N 2.69Å; D1451-K1454 WeakPolarHBondContact OD1-CE 3.49Å; D1451-K1454 IonicContact OD1-NZ 3.56Å; D1451-K1454 PolarHBondContact OD1-NZ 2.85Å
1452	S	41.7	Very low	35.8	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-3.7	-179.4	-61.7	0	0	0	0	115.3	I1450	I1450-S1452 PolarHBondContact O-N 3.39Å; I1450-S1452 VanDerWaalsContact O-N 3.08Å
1453	I	36	Very low	35.2	Very low	156 Å²	156	126 Å²	126	80%	0.8	71%	0.707	S	S	*	*			trans	-121.5	50.7	-174.6	-40	-176.4	0	0	0	111.9	D1451	D1451-I1453 VanDerWaalsContact C-N 3.28Å; D1451-I1453 PolarHBondContact O-N 2.69Å
1454	K	30	Very low	34.6	Very low	161 Å²	161	129.4 Å²	129.4	70%	0.7	73%	0.725	S	S	*	*			trans	-117.7	58.3	174.2	-75.7	175.7	178.4	161.3	0	112.7	D1451	D1451-K1454 WeakPolarHBondContact OD1-CE 3.49Å; D1451-K1454 IonicContact OD1-NZ 3.56Å; D1451-K1454 PolarHBondContact OD1-NZ 2.85Å
1455	L	34.1	Very low	34.1	Very low	164 Å²	164	129.8 Å²	129.8	86%	0.859	73%	0.731	S	S	*	*			trans	-138.5	92.6	173.3	-89.4	171.1	0	0	0	112.2
1456	L	31.4	Very low	33.7	Very low	169 Å²	169	130 Å²	130	89%	0.885	73%	0.732	S	S	*	*				177	142.3	119.1	-90.2	161.6	0	0	0	110.9
1457	P	32.8	Very low	33.2	Very low	113 Å²	113	131.8 Å²	131.8	73%	0.734	74%	0.739	S	S	*	*			trans	-95.9	173.3	-168.5	39	-36.8	0	0	0	114.5
1458	P	34.3	Very low	32.8	Very low	123 Å²	123	135.3 Å²	135.3	80%	0.799	75%	0.749	S	S	*	*			trans	-95	165.6	-165.1	37.6	-36.9	0	0	0	115.5
1459	L	29	Very low	32.2	Very low	176 Å²	176	132.5 Å²	132.5	92%	0.921	74%	0.74	S	S	*	*			trans	-130.8	149	167.3	-87.4	166	0	0	0	110.9
1460	A	30.2	Very low	31.7	Very low	91 Å²	91	134.1 Å²	134.1	75%	0.752	74%	0.742	S	S	*	*			trans	-134.1	133.2	178.9	0	0	0	0	0	111.5
1461	N	33.4	Very low	31.3	Very low	150 Å²	150	134.4 Å²	134.4	80%	0.802	74%	0.743	S	S	*	*			trans	-134	138.9	164.2	-79.1	-46.6	0	0	0	107.4
1462	K	32.3	Very low	30.9	Very low	188 Å²	188	133.8 Å²	133.8	82%	0.817	75%	0.746	S	S	*	*			cis	86.5	139.4	30.3	-156.5	179.1	-172.5	-174.8	0	113
1463	S	30.1	Very low	30.4	Very low	118 Å²	118	135 Å²	135	83%	0.825	74%	0.743	S	S	*	*			trans	65.3	125.9	178.2	36.9	0	0	0	0	119.6
1464	I	25.2	Very low	29.9	Very low	159 Å²	159	134 Å²	134	82%	0.815	74%	0.738	S	S	*	*			trans	-87.3	145	157.1	-61.1	153.8	0	0	0	107.1
1465	T	28.2	Very low	30	Very low	116 Å²	116	129.5 Å²	129.5	71%	0.712	73%	0.727	S	S	*	*			trans	169.5	143.7	132.1	30.8	0	0	0	0	114.2
1466	N	29.6	Very low	29.7	Very low	130 Å²	130	127.9 Å²	127.9	70%	0.695	72%	0.719	S	S	*	*			trans	55	141.5	138.6	-61.1	6.8	0	0	0	123.6
1467	N	28.9	Very low	29.6	Very low	129 Å²	129	126.6 Å²	126.6	69%	0.69	71%	0.709	S	S	*	*			trans	71.8	149.1	138	-73.1	11.6	0	0	0	120.3
1468	Q	27.7	Very low	29.3	Very low	151 Å²	151	127 Å²	127	71%	0.706	70%	0.704	S	S	*	*			cis	-162.3	161.8	-31.8	-140.8	171.5	-7.5	0	0	109
1469	S	27.9	Very low	29	Very low	70 Å²	70	123.1 Å²	123.1	49%	0.49	68%	0.679	S	S	.	*			trans	70.9	159.4	147.5	80.1	0	0	0	0	121.2	K555	K555-S1469 PolarHBondContact NZ-O 2.86Å
1470	N	27.7	Very low	28.9	Very low	124 Å²	124	116.9 Å²	116.9	66%	0.663	65%	0.646	S	S	*	*			trans	76.9	130.6	135.9	-74.6	4.7	0	0	0	124.5
1471	I	28.9	Very low	28.7	Very low	128 Å²	128	116.7 Å²	116.7	66%	0.656	64%	0.636	S	S	*	*			trans	74.8	131.6	135.6	-69.4	169.8	0	0	0	116.2
1472	S	30.2	Very low	28.4	Very low	84 Å²	84	114.7 Å²	114.7	59%	0.587	63%	0.629	S	S	*	*			cis	-164.6	-173.3	-13.2	51.2	0	0	0	0	106.8
1473	I	29.4	Very low	28.1	Very low	134 Å²	134	111.1 Å²	111.1	69%	0.687	62%	0.623	S	S	*	*			cis	-168	143.8	23.5	-148.4	157	0	0	0	109.2
1474	L	27	Very low	27.9	Very low	136 Å²	136	112 Å²	112	71%	0.712	62%	0.618	S	S	*	*			trans	56.6	171.2	156	-66.4	165.1	0	0	0	118
1475	S	30.8	Very low	28.1	Very low	66 Å²	66	109.7 Å²	109.7	46%	0.462	61%	0.612	S	S	.	*			cis	-172.2	171.8	-34.6	58.4	0	0	0	0	108.8
1476	N	28	Very low	28.1	Very low	130 Å²	130	109.7 Å²	109.7	70%	0.695	61%	0.612	S	S	*	*			trans	30.8	126	140.4	-57.6	-0.5	0	0	0	117.6
1477	Q	29.4	Very low	28	Very low	142 Å²	142	109.5 Å²	109.5	66%	0.664	62%	0.616	S	S	*	*			cis	172.9	170.4	30.8	-124.4	175.1	-10	0	0	108.3
1478	L	26.5	Very low	28	Very low	121 Å²	121	108.2 Å²	108.2	63%	0.634	61%	0.612	S	S	*	*			trans	57.3	101.5	145.1	-62.4	165.1	0	0	0	121.2
1479	T	28	Very low	27.9	Very low	43 Å²	43	104.8 Å²	104.8	26%	0.264	61%	0.606	S	S	.	*				89.1	139.2	113.2	78.7	0	0	0	0	126.2	E545 N547	E545-T1479 VanDerWaalsContact CB-CB 3.49Å; E545-T1479 HydrophobicContact CB-CG2 3.39Å; E545-T1479 VanDerWaalsContact CG-CB 3.47Å; E545-T1479 HydrophobicContact CG-CG2 3.65Å; E545-T1479 WeakPolarHBondContact OE1-CB 3.28Å; E545-T1479 WeakPolarHBondContact OE1-CG2 3.46Å; E545-T1479 PolarHBondContact OE1-OG1 2.84Å; N547-T1479 PolarHBondContact ND2-O 3.31Å; N547-T1479 VanDerWaalsContact ND2-O 3.12Å
1480	D	27.2	Very low	27.8	Very low	44 Å²	44	104.1 Å²	104.1	24%	0.235	60%	0.596	C	S	.	*			trans	96.7	143.2	149.1	-113.8	-24.7	0	0	0	127	E545 T546 N547	E545-D1480 HydrophobicContact CG-CB 4.46Å; E545-D1480 WeakPolarHBondContact CG-OD2 3.31Å; E545-D1480 VanDerWaalsContact N-CG 3.26Å; E545-D1480 PolarHBondContact N-OD1 2.78Å; T546-D1480 VanDerWaalsContact C-N 3.29Å; T546-D1480 CarbonylContact O-C 3.56Å; N547-D1480 PolarHBondContact ND2-O 2.97Å; N547-D1480 PolarHBondContact OD1-O 2.82Å
1481	T	26.8	Very low	27.8	Very low	88 Å²	88	102.1 Å²	102.1	54%	0.54	59%	0.589	S	S	.	*			trans	-27.8	152.1	-178.4	48.4	0	0	0	0	124.3
1482	T	26.4	Very low	27.8	Very low	107 Å²	107	101.2 Å²	101.2	66%	0.656	59%	0.585	S	S	*	*			trans	71.7	127.6	134.1	55.2	0	0	0	0	124
1483	T	26.2	Very low	27.8	Very low	113 Å²	113	100.6 Å²	100.6	69%	0.693	58%	0.575	S	S	*	*			trans	69.1	169.3	136.8	62.7	0	0	0	0	120.7
1484	N	26.2	Very low	27.8	Very low	136 Å²	136	102.1 Å²	102.1	73%	0.727	57%	0.573	S	S	*	*			trans	70	101.8	156.5	-67.7	-10.7	0	0	0	117.1
1485	T	28.6	Very low	27.9	Very low	112 Å²	112	101 Å²	101	69%	0.687	57%	0.566	S	S	*	*				66.7	112.8	85.3	61.8	0	0	0	0	115.5
1486	T	28	Very low	27.8	Very low	116 Å²	116	101.4 Å²	101.4	71%	0.712	56%	0.563	S	S	*	*			trans	65	122.9	130.8	-40.2	0	0	0	0	118.6
1487	T	28.7	Very low	27.7	Very low	125 Å²	125	100.6 Å²	100.6	77%	0.767	56%	0.559	S	S	*	*			trans	64.3	171.8	160.4	47.8	0	0	0	0	115.3
1488	T	27.5	Very low	27.6	Very low	102 Å²	102	99.8 Å²	99.8	63%	0.626	56%	0.563	S	S	*	*			cis	-146.2	130.5	6.5	-21	0	0	0	0	111.2	N1490	T1488-N1490 PolarHBondContact O-ND2 2.95Å
1489	S	26	Very low	27.5	Very low	80 Å²	80	99.2 Å²	99.2	56%	0.559	57%	0.565	S	S	*	*			trans	53.7	167.7	142.3	57.2	0	0	0	0	119.2
1490	N	26.6	Very low	27.4	Very low	55 Å²	55	106.8 Å²	106.8	29%	0.294	59%	0.59	S	S	.	*				177.1	156.5	76.7	-81	-61	0	0	0	111.8	T530 P531 N532 T1488	T530-N1490 VanDerWaalsContact CB-OD1 3.3Å; T530-N1490 WeakPolarHBondContact CB-OD1 3.48Å; T530-N1490 WeakPolarHBondContact CG2-OD1 3.29Å; P531-N1490 WeakPolarHBondContact CA-OD1 3.46Å; P531-N1490 HydrophobicContact CB-CB 3.79Å; P531-N1490 WeakPolarHBondContact CB-OD1 3.37Å; N532-N1490 PolarHBondContact OD1-ND2 3.17Å; T1488-N1490 PolarHBondContact O-ND2 2.95Å
1491	T	26.7	Very low	27.5	Very low	82 Å²	82	110.3 Å²	110.3	50%	0.503	61%	0.609	S	S	.	*			trans	68.8	141.8	159.4	51.3	0	0	0	0	118.3	T530 P531	T530-T1491 VanDerWaalsContact OG1-CA 3.24Å; T530-T1491 WeakPolarHBondContact OG1-CA 3.36Å; T530-T1491 PolarHBondContact OG1-N 2.88Å; P531-T1491 HydrophobicContact CB-CG2 4.16Å; P531-T1491 HydrophobicContact CG-CG2 3.89Å
1492	N	30.1	Very low	27.5	Very low	110 Å²	110	112.6 Å²	112.6	59%	0.588	62%	0.623	S	S	*	*			cis	-145.9	141.1	9.4	-121.1	-11.2	0	0	0	115.9	S529	S529-N1492 WeakPolarHBondContact OG-CA 3.36Å; S529-N1492 PolarHBondContact OG-OD1 3.27Å
1493	D	30.5	Very low	27.8	Very low	70 Å²	70	110.5 Å²	110.5	37%	0.374	61%	0.61	S	S	.	*			trans	46.9	131.6	140.6	-116.1	-8.4	0	0	0	124.7	S529	S529-D1493 PolarHBondContact OG-N 3.2Å
1494	R	28.3	Very low	28.2	Very low	167 Å²	167	111.2 Å²	111.2	63%	0.63	61%	0.61	S	S	*	*			trans	67.3	149.2	146.8	-72	166.5	161.5	135.3	-11.4	119.7	L528	L528-R1494 WeakPolarHBondContact CD2-O 3.13Å
1495	I	29.9	Very low	28.6	Very low	112 Å²	112	111.1 Å²	111.1	57%	0.574	61%	0.609	S	S	*	*			cis	-160.4	168.6	-6.7	-124.8	167.3	0	0	0	112.6
1496	N	27.8	Very low	29.1	Very low	75 Å²	75	110.1 Å²	110.1	40%	0.401	60%	0.603	S	S	.	*			trans	-9.6	148.9	163.6	-47.4	-33.6	0	0	0	123.8	S526	S526-N1496 WeakPolarHBondContact CB-OD1 3.36Å
1497	N	25.8	Very low	29.6	Very low	113 Å²	113	108.9 Å²	108.9	60%	0.604	59%	0.589	S	S	*	*			trans	66.5	169.4	137.9	-66.3	-13.6	0	0	0	120.5
1498	T	27.6	Very low	30.2	Very low	124 Å²	124	106 Å²	106	76%	0.761	57%	0.574	S	S	*	*			trans	65.1	131	170	30.3	0	0	0	0	115.1
1499	T	25.3	Very low	31	Very low	109 Å²	109	106 Å²	106	67%	0.669	57%	0.57	S	S	*	*			cis	70.6	124.5	39.1	-35.8	0	0	0	0	113.2
1500	Y	26.1	Very low	32.3	Very low	203 Å²	203	106.3 Å²	106.3	80%	0.796	57%	0.569	S	S	*	*			trans	80.4	128.8	175.4	-64.8	-70.1	0	0	0	120
1501	N	28.5	Very low	33.6	Very low	117 Å²	117	110 Å²	110	63%	0.626	58%	0.584	S	S	*	*			trans	62.7	83.2	139	-56.9	-0.9	0	0	0	120.7
1502	T	26.6	Very low	34.8	Very low	136 Å²	136	113.1 Å²	113.1	83%	0.834	59%	0.591	S	S	*	*				-120.3	40.4	127.7	37.4	0	0	0	0	111.5
1503	T	33.9	Very low	36.5	Very low	63 Å²	63	113 Å²	113	39%	0.387	59%	0.59	S	S	.	*			trans	-59.4	155.4	158.1	35.3	0	0	0	0	110.5	E1507	T1503-E1507 WeakPolarHBondContact CB-OE2 3.48Å; T1503-E1507 WeakPolarHBondContact CG2-OE2 3.44Å
1504	N	33.6	Very low	38	Very low	129 Å²	129	113 Å²	113	69%	0.69	60%	0.595	S	S	*	*	S	Bend	trans	111.8	-48.9	-179.3	-60.3	-12.3	0	0	0	116.6
1505	N	34.3	Very low	39.8	Very low	134 Å²	134	108.9 Å²	108.9	72%	0.717	59%	0.591	S	S	*	*	H	α-helix	trans	-100.3	-17.4	-175.7	-81.7	-11.9	0	0	0	115.3	S1508 N1509	N1505-S1508 PolarHBondContact O-OG 2.89Å; N1505-N1509 PolarHBondContact O-ND2 2.79Å
1506	T	38.4	Very low	41.7	Very low	90 Å²	90	109.2 Å²	109.2	55%	0.552	59%	0.588	S	S	*	*	H	α-helix	trans	-89.3	-34.5	174.1	45	0	0	0	0	112	N1509 T1510	T1506-N1509 PolarHBondContact O-N 3.42Å; T1506-T1510 PolarHBondContact O-N 2.66Å; T1506-T1510 PolarHBondContact O-OG1 3.36Å
1507	E	39.1	Very low	43.7	Very low	91 Å²	91	112.3 Å²	112.3	43%	0.425	60%	0.6	S	S	.	*	H	α-helix	trans	-69	-34.8	-179.6	-69.8	178.5	121.2	0	0	113.2	T1503 N1509 T1510 Q1511	T1503-E1507 WeakPolarHBondContact CB-OE2 3.48Å; T1503-E1507 WeakPolarHBondContact CG2-OE2 3.44Å; E1507-N1509 VanDerWaalsContact C-N 3.33Å; E1507-N1509 PolarHBondContact O-N 2.94Å; E1507-T1510 WeakPolarHBondContact CA-OG1 3.12Å; E1507-T1510 PolarHBondContact O-N 3.22Å; E1507-T1510 PolarHBondContact O-OG1 3.06Å; E1507-Q1511 VanDerWaalsContact O-CB 3.29Å; E1507-Q1511 WeakPolarHBondContact O-CB 3.36Å; E1507-Q1511 WeakPolarHBondContact O-CG 3.42Å; E1507-Q1511 PolarHBondContact O-N 3.27Å
1508	S	41.4	Very low	45.8	Very low	64 Å²	64	111.6 Å²	111.6	45%	0.448	59%	0.594	S	S	.	*	H	α-helix	trans	-61	-43.1	171	53.5	0	0	0	0	111.5	N1505 F1512	N1505-S1508 PolarHBondContact O-OG 2.89Å; S1508-F1512 WeakPolarHBondContact O-CB 3.47Å; S1508-F1512 PolarHBondContact O-N 3.01Å
1509	N	44.7	Very low	48	Very low	102 Å²	102	113.1 Å²	113.1	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-69.5	-41.5	177.3	-78.1	-75.1	0	0	0	112.8	N1505 T1506 E1507 F1512 I1513	N1505-N1509 PolarHBondContact O-ND2 2.79Å; T1506-N1509 PolarHBondContact O-N 3.42Å; E1507-N1509 VanDerWaalsContact C-N 3.33Å; E1507-N1509 PolarHBondContact O-N 2.94Å; N1509-F1512 PolarHBondContact O-N 3.11Å; N1509-I1513 WeakPolarHBondContact O-CB 3.45Å; N1509-I1513 VanDerWaalsContact O-CG1 3.28Å; N1509-I1513 WeakPolarHBondContact O-CG1 3.48Å; N1509-I1513 PolarHBondContact O-N 2.85Å
1510	T	53.5	Low	50.2	Low	86 Å²	86	113.7 Å²	113.7	53%	0.528	58%	0.583	S	S	.	*	H	α-helix	trans	-72.5	-33.7	177.1	55.9	0	0	0	0	112.6	T1506 E1507 S1514	T1506-T1510 PolarHBondContact O-N 2.66Å; T1506-T1510 PolarHBondContact O-OG1 3.36Å; E1507-T1510 WeakPolarHBondContact CA-OG1 3.12Å; E1507-T1510 PolarHBondContact O-N 3.22Å; E1507-T1510 PolarHBondContact O-OG1 3.06Å; T1510-S1514 VanDerWaalsContact O-CB 3.22Å; T1510-S1514 WeakPolarHBondContact O-CB 3.44Å; T1510-S1514 PolarHBondContact O-N 3.46Å
1511	Q	52.7	Low	52.6	Low	133 Å²	133	111 Å²	111	62%	0.621	57%	0.573	S	S	*	*	H	α-helix	trans	-64.8	-44.2	168.5	-74.7	-168	26.9	0	0	111.3	E1507 I1513 S1514 C1515	E1507-Q1511 VanDerWaalsContact O-CB 3.29Å; E1507-Q1511 WeakPolarHBondContact O-CB 3.36Å; E1507-Q1511 WeakPolarHBondContact O-CG 3.42Å; E1507-Q1511 PolarHBondContact O-N 3.27Å; Q1511-I1513 PolarHBondContact O-N 2.96Å; Q1511-S1514 WeakPolarHBondContact O-CB 3.14Å; Q1511-S1514 PolarHBondContact O-N 2.88Å; Q1511-S1514 VanDerWaalsContact O-N 3.16Å; Q1511-C1515 WeakPolarHBondContact O-CB 3.47Å; Q1511-C1515 PolarHBondContact O-N 3.01Å; Q1511-C1515 PolarHBondContact O-SG 3.4Å; Q1511-C1515 VanDerWaalsContact O-SG 3.35Å
1512	F	53.6	Low	54.9	Low	148 Å²	148	110.1 Å²	110.1	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-61.4	-42.7	177.8	-156.2	-85.2	0	0	0	112	S1508 N1509 F1516	S1508-F1512 WeakPolarHBondContact O-CB 3.47Å; S1508-F1512 PolarHBondContact O-N 3.01Å; N1509-F1512 PolarHBondContact O-N 3.11Å; F1512-F1516 VanDerWaalsContact O-CB 3.31Å; F1512-F1516 WeakPolarHBondContact O-CB 3.41Å; F1512-F1516 PolarHBondContact O-N 2.96Å
1513	I	66	Low	57.3	Low	108 Å²	108	109.9 Å²	109.9	55%	0.554	55%	0.549	S	S	*	.	H	α-helix	trans	-63.5	-43.4	173.7	-69.5	165.7	0	0	0	111.2	N1509 Q1511 F1516 Q1517	N1509-I1513 WeakPolarHBondContact O-CB 3.45Å; N1509-I1513 VanDerWaalsContact O-CG1 3.28Å; N1509-I1513 WeakPolarHBondContact O-CG1 3.48Å; N1509-I1513 PolarHBondContact O-N 2.85Å; Q1511-I1513 PolarHBondContact O-N 2.96Å; I1513-F1516 PolarHBondContact O-N 3.44Å; I1513-Q1517 VanDerWaalsContact O-CB 3.31Å; I1513-Q1517 WeakPolarHBondContact O-CB 3.08Å; I1513-Q1517 PolarHBondContact O-N 2.83Å
1514	S	61.3	Low	59.2	Low	69 Å²	69	110.4 Å²	110.4	48%	0.483	55%	0.549	S	S	.	.	H	α-helix	trans	-62.3	-49	177.5	-172.8	0	0	0	0	111.8	T1510 Q1511 F1516 Q1517 Q1518	T1510-S1514 VanDerWaalsContact O-CB 3.22Å; T1510-S1514 WeakPolarHBondContact O-CB 3.44Å; T1510-S1514 PolarHBondContact O-N 3.46Å; Q1511-S1514 WeakPolarHBondContact O-CB 3.14Å; Q1511-S1514 PolarHBondContact O-N 2.88Å; Q1511-S1514 VanDerWaalsContact O-N 3.16Å; S1514-F1516 VanDerWaalsContact C-N 3.35Å; S1514-F1516 PolarHBondContact O-N 3.4Å; S1514-Q1517 PolarHBondContact O-N 3.37Å; S1514-Q1518 WeakPolarHBondContact O-CB 3.32Å; S1514-Q1518 PolarHBondContact O-N 3.33Å
1515	C	66.5	Low	61.3	Low	81 Å²	81	107 Å²	107	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-59.2	-43.2	174.5	-70.8	0	0	0	0	111.7	Q1511 Q1518 F1519	Q1511-C1515 WeakPolarHBondContact O-CB 3.47Å; Q1511-C1515 PolarHBondContact O-N 3.01Å; Q1511-C1515 PolarHBondContact O-SG 3.4Å; Q1511-C1515 VanDerWaalsContact O-SG 3.35Å; C1515-Q1518 PolarHBondContact O-N 3.1Å; C1515-F1519 WeakPolarHBondContact O-CB 3.34Å; C1515-F1519 PolarHBondContact O-N 3.22Å
1516	F	70	Confident	63.2	Low	118 Å²	118	103.3 Å²	103.3	52%	0.518	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-42	177.1	-159.5	-86.1	0	0	0	111.7	F1512 I1513 S1514 F1519 F1520	F1512-F1516 VanDerWaalsContact O-CB 3.31Å; F1512-F1516 WeakPolarHBondContact O-CB 3.41Å; F1512-F1516 PolarHBondContact O-N 2.96Å; I1513-F1516 PolarHBondContact O-N 3.44Å; S1514-F1516 VanDerWaalsContact C-N 3.35Å; S1514-F1516 PolarHBondContact O-N 3.4Å; F1516-F1519 PolarHBondContact O-N 2.98Å; F1516-F1520 VanDerWaalsContact O-CB 3.32Å; F1516-F1520 WeakPolarHBondContact O-CB 3.17Å; F1516-F1520 PolarHBondContact O-N 3.14Å
1517	Q	68.3	Low	65	Low	140 Å²	140	104.2 Å²	104.2	65%	0.654	52%	0.517	S	S	*	.	H	α-helix	trans	-65.8	-39.6	176.2	-174.7	171.1	-24.6	0	0	112.1	I1513 S1514 Y1521	I1513-Q1517 VanDerWaalsContact O-CB 3.31Å; I1513-Q1517 WeakPolarHBondContact O-CB 3.08Å; I1513-Q1517 PolarHBondContact O-N 2.83Å; S1514-Q1517 PolarHBondContact O-N 3.37Å; Q1517-Y1521 WeakPolarHBondContact O-CB 3.35Å; Q1517-Y1521 PolarHBondContact O-N 2.87Å
1518	Q	70.1	Confident	66.6	Low	99 Å²	99	104.1 Å²	104.1	46%	0.463	52%	0.518	S	S	.	.	H	α-helix	trans	-63.7	-45.5	173.8	-164	84	-5.2	0	0	111.3	S1514 C1515 Y1521 Y1522	S1514-Q1518 WeakPolarHBondContact O-CB 3.32Å; S1514-Q1518 PolarHBondContact O-N 3.33Å; C1515-Q1518 PolarHBondContact O-N 3.1Å; Q1518-Y1521 WeakPolarHBondContact O-CB 3.47Å; Q1518-Y1521 PolarHBondContact O-N 3.24Å; Q1518-Y1522 HydrophobicContact CG-CD2 4.09Å; Q1518-Y1522 HydrophobicContact CG-CE2 3.71Å; Q1518-Y1522 WeakPolarHBondContact O-CD2 3.44Å; Q1518-Y1522 PolarHBondContact O-N 2.98Å
1519	F	73.9	Confident	68.3	Low	156 Å²	156	103.9 Å²	103.9	68%	0.684	51%	0.514	S	S	*	.	H	α-helix	trans	-65.9	-40.5	178.8	-152.6	-82.8	0	0	0	111.5	C1515 F1516 Y1522 F1523	C1515-F1519 WeakPolarHBondContact O-CB 3.34Å; C1515-F1519 PolarHBondContact O-N 3.22Å; F1516-F1519 PolarHBondContact O-N 2.98Å; F1519-Y1522 PolarHBondContact O-N 2.78Å; F1519-F1523 WeakPolarHBondContact O-CB 3.39Å; F1519-F1523 PolarHBondContact O-N 3.14Å
1520	F	71	Confident	69.7	Low	120 Å²	120	105.8 Å²	105.8	53%	0.526	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-38	175.1	-154.1	-100.4	0	0	0	111.9	F1516 F1523 I1524	F1516-F1520 VanDerWaalsContact O-CB 3.32Å; F1516-F1520 WeakPolarHBondContact O-CB 3.17Å; F1516-F1520 PolarHBondContact O-N 3.14Å; F1520-F1523 PolarHBondContact O-N 3.41Å; F1520-I1524 HydrophobicContact CD1-CD1 3.66Å; F1520-I1524 HydrophobicContact CD1-CG1 4.41Å; F1520-I1524 HydrophobicContact CE1-CD1 3.75Å; F1520-I1524 HydrophobicContact CE1-CG1 4.48Å; F1520-I1524 WeakPolarHBondContact O-CG1 3.23Å; F1520-I1524 PolarHBondContact O-N 3.35Å
1521	Y	77.1	Confident	70.5	Confident	147 Å²	147	106.8 Å²	106.8	58%	0.576	51%	0.512	S	S	*	.	H	α-helix	trans	-62.2	-50.1	172	178.3	-97	0	0	0	111.9	Q1517 Q1518 F1523 I1524 V1525	Q1517-Y1521 WeakPolarHBondContact O-CB 3.35Å; Q1517-Y1521 PolarHBondContact O-N 2.87Å; Q1518-Y1521 WeakPolarHBondContact O-CB 3.47Å; Q1518-Y1521 PolarHBondContact O-N 3.24Å; Y1521-F1523 VanDerWaalsContact C-N 3.32Å; Y1521-F1523 PolarHBondContact O-N 3.14Å; Y1521-I1524 PolarHBondContact O-N 2.83Å; Y1521-V1525 HydrophobicContact CD1-CG2 4.3Å; Y1521-V1525 HydrophobicContact CE1-CG2 3.91Å; Y1521-V1525 HydrophobicContact CE2-CG2 4.29Å; Y1521-V1525 WeakPolarHBondContact O-CG2 3.38Å; Y1521-V1525 PolarHBondContact O-N 2.88Å
1522	Y	76.4	Confident	71.5	Confident	99 Å²	99	104.4 Å²	104.4	39%	0.388	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-38.5	176.4	-76.3	-59.9	0	0	0	112.6	Q1518 F1519 V1525 A1526	Q1518-Y1522 HydrophobicContact CG-CD2 4.09Å; Q1518-Y1522 HydrophobicContact CG-CE2 3.71Å; Q1518-Y1522 WeakPolarHBondContact O-CD2 3.44Å; Q1518-Y1522 PolarHBondContact O-N 2.98Å; F1519-Y1522 PolarHBondContact O-N 2.78Å; Y1522-V1525 PolarHBondContact O-N 3.41Å; Y1522-A1526 VanDerWaalsContact O-CB 3.29Å; Y1522-A1526 WeakPolarHBondContact O-CB 3.45Å; Y1522-A1526 PolarHBondContact O-N 3.07Å
1523	F	77.8	Confident	72.4	Confident	130 Å²	130	100.4 Å²	100.4	57%	0.57	49%	0.487	S	S	*	.	H	α-helix	trans	-63.3	-42.8	175.1	-175	-94.4	0	0	0	112.2	F1519 F1520 Y1521 A1526 F1527	F1519-F1523 WeakPolarHBondContact O-CB 3.39Å; F1519-F1523 PolarHBondContact O-N 3.14Å; F1520-F1523 PolarHBondContact O-N 3.41Å; Y1521-F1523 VanDerWaalsContact C-N 3.32Å; Y1521-F1523 PolarHBondContact O-N 3.14Å; F1523-A1526 PolarHBondContact O-N 3.38Å; F1523-F1527 VanDerWaalsContact O-CB 3.31Å; F1523-F1527 WeakPolarHBondContact O-CB 3.4Å; F1523-F1527 PolarHBondContact O-N 2.84Å
1524	I	74.6	Confident	72.5	Confident	75 Å²	75	98 Å²	98	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-62	-46.5	174.3	-72.7	167.8	0	0	0	110.8	F1520 Y1521 F1527 I1528	F1520-I1524 HydrophobicContact CD1-CD1 3.66Å; F1520-I1524 HydrophobicContact CD1-CG1 4.41Å; F1520-I1524 HydrophobicContact CE1-CD1 3.75Å; F1520-I1524 HydrophobicContact CE1-CG1 4.48Å; F1520-I1524 WeakPolarHBondContact O-CG1 3.23Å; F1520-I1524 PolarHBondContact O-N 3.35Å; Y1521-I1524 PolarHBondContact O-N 2.83Å; I1524-F1527 PolarHBondContact O-N 3.48Å; I1524-I1528 HydrophobicContact CG2-CD1 3.73Å; I1524-I1528 HydrophobicContact CG2-CG1 4.48Å; I1524-I1528 WeakPolarHBondContact O-CB 3.36Å; I1524-I1528 VanDerWaalsContact O-CG1 3.28Å; I1524-I1528 WeakPolarHBondContact O-CG1 3.17Å; I1524-I1528 PolarHBondContact O-N 3.35Å
1525	V	76.2	Confident	72.6	Confident	56 Å²	56	102.2 Å²	102.2	34%	0.339	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-46.1	178.2	172.2	0	0	0	0	111	Y1521 Y1522 F1527 I1528 V1529	Y1521-V1525 HydrophobicContact CD1-CG2 4.3Å; Y1521-V1525 HydrophobicContact CE1-CG2 3.91Å; Y1521-V1525 HydrophobicContact CE2-CG2 4.29Å; Y1521-V1525 WeakPolarHBondContact O-CG2 3.38Å; Y1521-V1525 PolarHBondContact O-N 2.88Å; Y1522-V1525 PolarHBondContact O-N 3.41Å; V1525-F1527 PolarHBondContact O-N 2.7Å; V1525-I1528 PolarHBondContact O-N 3.32Å; V1525-V1529 HydrophobicContact CG1-CG2 4.46Å; V1525-V1529 WeakPolarHBondContact O-CG2 3.19Å; V1525-V1529 PolarHBondContact O-N 2.91Å
1526	A	74.5	Confident	72.5	Confident	57 Å²	57	105 Å²	105	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-61.8	-41.1	176.6	0	0	0	0	0	112.1	Y1522 F1523 V1529 Y1530	Y1522-A1526 VanDerWaalsContact O-CB 3.29Å; Y1522-A1526 WeakPolarHBondContact O-CB 3.45Å; Y1522-A1526 PolarHBondContact O-N 3.07Å; F1523-A1526 PolarHBondContact O-N 3.38Å; A1526-V1529 PolarHBondContact O-N 2.92Å; A1526-Y1530 VanDerWaalsContact O-CB 3.26Å; A1526-Y1530 WeakPolarHBondContact O-CB 3.35Å; A1526-Y1530 PolarHBondContact O-N 2.8Å
1527	F	75.8	Confident	72.1	Confident	109 Å²	109	104.6 Å²	104.6	48%	0.478	49%	0.487	S	S	.	.	H	α-helix	trans	-66.5	-37.8	176.1	-173.1	-96.5	0	0	0	112.4	F1523 I1524 V1525 K1531	F1523-F1527 VanDerWaalsContact O-CB 3.31Å; F1523-F1527 WeakPolarHBondContact O-CB 3.4Å; F1523-F1527 PolarHBondContact O-N 2.84Å; I1524-F1527 PolarHBondContact O-N 3.48Å; V1525-F1527 PolarHBondContact O-N 2.7Å; F1527-K1531 HydrophobicContact CD1-CG 4.17Å; F1527-K1531 HydrophobicContact CE1-CG 3.89Å; F1527-K1531 HydrophobicContact CZ-CG 4.24Å; F1527-K1531 VanDerWaalsContact O-CB 3.32Å; F1527-K1531 WeakPolarHBondContact O-CB 3.44Å; F1527-K1531 VanDerWaalsContact O-CG 3.27Å; F1527-K1531 WeakPolarHBondContact O-CG 3.48Å; F1527-K1531 PolarHBondContact O-N 3.38Å
1528	I	74.2	Confident	71.3	Confident	89 Å²	89	103.1 Å²	103.1	46%	0.456	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-46.7	173.3	-70.7	166.4	0	0	0	110.6	I1524 V1525 K1531 L1532	I1524-I1528 HydrophobicContact CG2-CD1 3.73Å; I1524-I1528 HydrophobicContact CG2-CG1 4.48Å; I1524-I1528 WeakPolarHBondContact O-CB 3.36Å; I1524-I1528 VanDerWaalsContact O-CG1 3.28Å; I1524-I1528 WeakPolarHBondContact O-CG1 3.17Å; I1524-I1528 PolarHBondContact O-N 3.35Å; V1525-I1528 PolarHBondContact O-N 3.32Å; I1528-K1531 PolarHBondContact O-N 3.31Å; I1528-L1532 HydrophobicContact CG2-CD1 3.92Å; I1528-L1532 HydrophobicContact CG2-CG 4.47Å; I1528-L1532 WeakPolarHBondContact O-CG 3.09Å; I1528-L1532 PolarHBondContact O-N 3.43Å
1529	V	75.8	Confident	70	Confident	60 Å²	60	104 Å²	104	36%	0.364	49%	0.485	S	S	.	.	H	α-helix	trans	-61.6	-45.8	177.1	169.7	0	0	0	0	111	V1525 A1526 K1531 L1532 I1533	V1525-V1529 HydrophobicContact CG1-CG2 4.46Å; V1525-V1529 WeakPolarHBondContact O-CG2 3.19Å; V1525-V1529 PolarHBondContact O-N 2.91Å; A1526-V1529 PolarHBondContact O-N 2.92Å; V1529-K1531 VanDerWaalsContact C-N 3.34Å; V1529-K1531 PolarHBondContact O-N 3.46Å; V1529-L1532 PolarHBondContact O-N 2.61Å; V1529-I1533 HydrophobicContact CG1-CD1 3.76Å; V1529-I1533 HydrophobicContact CG1-CG1 4.41Å; V1529-I1533 VanDerWaalsContact O-CG1 3.32Å; V1529-I1533 WeakPolarHBondContact O-CG1 3.29Å; V1529-I1533 PolarHBondContact O-N 3.21Å
1530	Y	75.2	Confident	68.3	Low	142 Å²	142	102.5 Å²	102.5	56%	0.557	49%	0.491	S	S	*	.	H	α-helix	trans	-59.9	-41.9	174.5	178.1	-108.9	0	0	0	112.2	A1526 I1533 I1534	A1526-Y1530 VanDerWaalsContact O-CB 3.26Å; A1526-Y1530 WeakPolarHBondContact O-CB 3.35Å; A1526-Y1530 PolarHBondContact O-N 2.8Å; Y1530-I1533 PolarHBondContact O-N 2.98Å; Y1530-I1534 HydrophobicContact CD1-CD1 3.97Å; Y1530-I1534 HydrophobicContact CD2-CD1 4.41Å; Y1530-I1534 HydrophobicContact CE1-CD1 3.45Å; Y1530-I1534 VanDerWaalsContact CE1-CD1 3.45Å; Y1530-I1534 HydrophobicContact CE2-CD1 3.95Å; Y1530-I1534 HydrophobicContact CG-CD1 4.42Å; Y1530-I1534 VanDerWaalsContact CZ-CD1 3.45Å; Y1530-I1534 WeakPolarHBondContact O-CB 3.28Å; Y1530-I1534 WeakPolarHBondContact O-CG1 3.12Å; Y1530-I1534 PolarHBondContact O-N 3.23Å
1531	K	69.6	Low	66.7	Low	107 Å²	107	102 Å²	102	47%	0.465	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-37.5	174.1	-79.1	-69.9	179.2	-168.3	0	113.1	F1527 I1528 V1529 W1535	F1527-K1531 HydrophobicContact CD1-CG 4.17Å; F1527-K1531 HydrophobicContact CE1-CG 3.89Å; F1527-K1531 HydrophobicContact CZ-CG 4.24Å; F1527-K1531 VanDerWaalsContact O-CB 3.32Å; F1527-K1531 WeakPolarHBondContact O-CB 3.44Å; F1527-K1531 VanDerWaalsContact O-CG 3.27Å; F1527-K1531 WeakPolarHBondContact O-CG 3.48Å; F1527-K1531 PolarHBondContact O-N 3.38Å; I1528-K1531 PolarHBondContact O-N 3.31Å; V1529-K1531 VanDerWaalsContact C-N 3.34Å; V1529-K1531 PolarHBondContact O-N 3.46Å; K1531-W1535 VanDerWaalsContact O-CB 3.27Å; K1531-W1535 WeakPolarHBondContact O-CB 3.49Å; K1531-W1535 PolarHBondContact O-N 2.95Å
1532	L	72.9	Confident	64.7	Low	82 Å²	82	104 Å²	104	43%	0.429	51%	0.51	S	S	.	.	H	α-helix	trans	-67.9	-46.9	175	-73.3	167.1	0	0	0	111.2	I1528 V1529 I1534 W1535 F1536	I1528-L1532 HydrophobicContact CG2-CD1 3.92Å; I1528-L1532 HydrophobicContact CG2-CG 4.47Å; I1528-L1532 WeakPolarHBondContact O-CG 3.09Å; I1528-L1532 PolarHBondContact O-N 3.43Å; V1529-L1532 PolarHBondContact O-N 2.61Å; L1532-I1534 VanDerWaalsContact C-N 3.33Å; L1532-I1534 PolarHBondContact O-N 2.78Å; L1532-W1535 PolarHBondContact O-N 3.48Å; L1532-F1536 WeakPolarHBondContact O-CD2 3.37Å; L1532-F1536 PolarHBondContact O-N 3.3Å
1533	I	72.3	Confident	62.6	Low	64 Å²	64	106.5 Å²	106.5	33%	0.328	57%	0.566	S	S	.	*	H	α-helix	trans	-57.1	-46.6	175.9	-69.1	166.8	0	0	0	110.6	V1529 Y1530 W1535 N1537	V1529-I1533 HydrophobicContact CG1-CD1 3.76Å; V1529-I1533 HydrophobicContact CG1-CG1 4.41Å; V1529-I1533 VanDerWaalsContact O-CG1 3.32Å; V1529-I1533 WeakPolarHBondContact O-CG1 3.29Å; V1529-I1533 PolarHBondContact O-N 3.21Å; Y1530-I1533 PolarHBondContact O-N 2.98Å; I1533-W1535 VanDerWaalsContact C-N 3.34Å; I1533-W1535 PolarHBondContact O-N 3.19Å; I1533-N1537 VanDerWaalsContact O-CB 3.28Å; I1533-N1537 WeakPolarHBondContact O-CB 3.33Å; I1533-N1537 PolarHBondContact O-N 2.86Å; I1533-N1537 PolarHBondContact O-ND2 2.79Å
1534	I	70.1	Confident	61.9	Low	57 Å²	57	105.3 Å²	105.3	29%	0.292	57%	0.565	S	S	.	*	H	α-helix	trans	-59.4	-43.7	173.6	-76.5	178.2	0	0	0	111.6	Y1530 L1532 N1537 L1538	Y1530-I1534 HydrophobicContact CD1-CD1 3.97Å; Y1530-I1534 HydrophobicContact CD2-CD1 4.41Å; Y1530-I1534 HydrophobicContact CE1-CD1 3.45Å; Y1530-I1534 VanDerWaalsContact CE1-CD1 3.45Å; Y1530-I1534 HydrophobicContact CE2-CD1 3.95Å; Y1530-I1534 HydrophobicContact CG-CD1 4.42Å; Y1530-I1534 VanDerWaalsContact CZ-CD1 3.45Å; Y1530-I1534 WeakPolarHBondContact O-CB 3.28Å; Y1530-I1534 WeakPolarHBondContact O-CG1 3.12Å; Y1530-I1534 PolarHBondContact O-N 3.23Å; L1532-I1534 VanDerWaalsContact C-N 3.33Å; L1532-I1534 PolarHBondContact O-N 2.78Å; I1534-N1537 PolarHBondContact O-N 2.72Å; I1534-L1538 HydrophobicContact CG2-CD1 3.7Å; I1534-L1538 WeakPolarHBondContact O-CB 3.25Å; I1534-L1538 PolarHBondContact O-N 3.12Å; I1534-L1538 VanDerWaalsContact O-N 3.1Å
1535	W	62.6	Low	61.2	Low	159 Å²	159	106.9 Å²	106.9	60%	0.602	58%	0.575	S	S	*	*	H	α-helix	trans	-68.7	-40.6	-176.6	-173.1	74.8	0	0	0	113	K1531 L1532 I1533	K1531-W1535 VanDerWaalsContact O-CB 3.27Å; K1531-W1535 WeakPolarHBondContact O-CB 3.49Å; K1531-W1535 PolarHBondContact O-N 2.95Å; L1532-W1535 PolarHBondContact O-N 3.48Å; I1533-W1535 VanDerWaalsContact C-N 3.34Å; I1533-W1535 PolarHBondContact O-N 3.19Å
1536	F	64.6	Low	60.4	Low	139 Å²	139	109.7 Å²	109.7	61%	0.61	59%	0.588	S	S	*	*	H	α-helix	trans	-67	-42.6	172.8	-83.1	-75.3	0	0	0	111.7	L1532 L1538 K1539	L1532-F1536 WeakPolarHBondContact O-CD2 3.37Å; L1532-F1536 PolarHBondContact O-N 3.3Å; F1536-L1538 PolarHBondContact O-N 3.48Å; F1536-K1539 PolarHBondContact O-N 2.89Å
1537	N	62.2	Low	59.5	Low	110 Å²	110	112.8 Å²	112.8	59%	0.588	60%	0.595	S	S	*	*	H	α-helix	trans	-70	-15.5	179.1	-70.9	-12.5	0	0	0	114.2	I1533 I1534	I1533-N1537 VanDerWaalsContact O-CB 3.28Å; I1533-N1537 WeakPolarHBondContact O-CB 3.33Å; I1533-N1537 PolarHBondContact O-N 2.86Å; I1533-N1537 PolarHBondContact O-ND2 2.79Å; I1534-N1537 PolarHBondContact O-N 2.72Å
1538	L	51.5	Low	58.5	Low	108 Å²	108	113.1 Å²	113.1	57%	0.565	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	5.4	178.6	-85.9	159.1	0	0	0	114.4	F373 I1534 F1536	F373-L1538 HydrophobicContact CE1-CD1 4.49Å; I1534-L1538 HydrophobicContact CG2-CD1 3.7Å; I1534-L1538 WeakPolarHBondContact O-CB 3.25Å; I1534-L1538 PolarHBondContact O-N 3.12Å; I1534-L1538 VanDerWaalsContact O-N 3.1Å; F1536-L1538 PolarHBondContact O-N 3.48Å
1539	K	42.7	Very low	57.5	Low	118 Å²	118	114.7 Å²	114.7	51%	0.513	61%	0.612	S	S	.	*			trans	-141.2	90.2	175.9	-85.3	-163	162.6	-153	0	112.7	F1536 T1541	F1536-K1539 PolarHBondContact O-N 2.89Å; K1539-T1541 PolarHBondContact O-N 3.02Å; K1539-T1541 VanDerWaalsContact O-N 3.12Å
1540	P	37.3	Very low	56.2	Low	125 Å²	125	118.6 Å²	118.6	81%	0.812	63%	0.63	S	S	*	*			trans	-78.7	18.1	174.2	34.4	-36.7	0	0	0	113.9
1541	T	36.9	Very low	54.7	Low	108 Å²	108	116.8 Å²	116.8	66%	0.663	64%	0.635	S	S	*	*			trans	-145	61.7	-168.6	46.3	0	0	0	0	113.6	K1539	K1539-T1541 PolarHBondContact O-N 3.02Å; K1539-T1541 VanDerWaalsContact O-N 3.12Å
1542	F	36.5	Very low	53.5	Low	190 Å²	190	117.6 Å²	117.6	83%	0.833	65%	0.649	S	S	*	*			trans	-159.7	131.4	147.8	-104.1	-75.9	0	0	0	107.4
1543	G	32.3	Very low	51.7	Low	151 Å²	151	120.8 Å²	120.8	100%	1.557	67%	0.669	S	S	*	*			trans	-88.2	0	171.8	0	0	0	0	0	112.2

Retrieved 1,543 of 1,543 residues in 1448.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).