A0A3Q0KQ15_SCHMA Loading...

Putative asparagine-rich antigen

AlphaFold DB , UniProt , Accession A0A3Q0KQ15, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,266 aa.

						>A0A3Q0KQ15_SCHMA|A0A3Q0KQ15
MKLQSVQNTSRTNIMRKKRERKHRSKVSHSVTLSPCLVLSSSLEQTKSINDELSEKRVDQRKERSRLAAQIRRNREGQSLMLIQNALPISSHVLGLNLIQQNSKSSNSINGTKQINQPSENNNMITPGTIGRGQKKTAYFNSTVSNTMTGFLTTTSTATTTETSSSTISNIPSAINLEKARVLRIAGHTLFLLNKLSSYLRLQAKLYLSLNSQSVYGMLIDSKEMRIAYATPALAKAIGWSWIKLLGAPLHKLIKPTETSENSTETITKLSSKSQYSPLISPSHFNTTMKTPITHSFYPIHHEASCMNLTSNNSNNECINTTTTTTTTTTDNEFILPEFITLLKSNPNDQHLLCTSKNSKLDETVLNSSLMSDNNNSTTFSNVSDINRNGFIGNITKTHRIINSDHSINHKMNIINKSIRKSSSTPLISSKLVLNRFIPGNTIDNNNCNSDDINDYDPLNKKSFPQNNNDNELICYCWSKSMINIFTDNSTGLSEILNSLHECDVNNISTDDSNYINGDNDDYDDKSLLNNELLDILMKDAFSPDSLTFESSWGNSNPSSTINNPCNSCDGYNELSSTLSTGLYLCLLQPVCNKISSFEDLTNRVNSIINDTEYNHNNTISNDSNDNNINGEVNQNNLLDPSIHILEDLQKSATNDKQDSSISFELHNNINIMQSEESLMELSDIDTTSSSLLNGSTSMKIPSLEQKKECIKSKSFQCHTYLNCALTIKMVQGNYTDCFDIEDQSDIVDYSYLEFIHPDDLQNVITIFTRITHTNSLAWISPYRVSAHNKTVNNNTEKSYRWIRSLVSYDKMKNIFICSNQFLGSCELYDCAVGSNQRLLSVTFENSFKQFELKINNTTNNSNISSQNFMRTFNYDPSNESSINSRYHQQPKSKQVRISNSSSRSVRLKKSPTSLVIKNSNIIKPIKLFPFQSSQYIKQQSGQGYNQIISGNNQIRSIRLLPFTTTNNNKVPCLSYLNTHLYDSSKANDNSYTRQTNSVLNISTTKSSLYHSPSNVSSVPYYVKSMLPVVNYTSSSSKKLIFLSSASSLPSSISINKLQTFNTSNISRNKFRNDNKRGKYIEYSAISQDNNPTSLHYKNNIPFSDSSINDLYNQMIFGPDNNKTSNPIKLTVKTVCNDHQWNSGDNWSPSLIDNSSPHSVYSSHGSSTSISLSPNEQNLTDLNVSMQMETTVSELLESIPLSNKLSYDNDGVQMNIDFNGNSYDSNTFEYEDSELSHLDSDFESSENFTGFQPDLISDSDVLNSPV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.1	Very low	33.3	Very low	238 Å²	238	157.1 Å²	157.1	100%	1.172	80%	0.804	S	S	*	*				0	125.5	0	-76.8	163.3	162.6	0	0	107.4
2	K	31.8	Very low	33.1	Very low	190 Å²	190	154.7 Å²	154.7	83%	0.826	80%	0.803	S	S	*	*				72.5	142.9	77	-117.1	-177.8	-174.8	-179.7	0	112.1
3	L	36.1	Very low	33.3	Very low	149 Å²	149	153.2 Å²	153.2	78%	0.78	80%	0.797	S	S	*	*			trans	79.3	93	179.9	-55.2	165.4	0	0	0	113.7
4	Q	30.1	Very low	33.8	Very low	156 Å²	156	152.5 Å²	152.5	73%	0.729	79%	0.792	S	S	*	*			cis	66.7	132.7	28.3	-155.3	-171.6	7.9	0	0	112.8
5	S	33	Very low	33.7	Very low	91 Å²	91	151.8 Å²	151.8	64%	0.636	79%	0.786	S	S	*	*			trans	69.1	161.5	169	88.9	0	0	0	0	114.5
6	V	34.4	Very low	33.7	Very low	116 Å²	116	155.8 Å²	155.8	70%	0.703	79%	0.788	S	S	*	*			cis	-162	135.6	-20.2	124.7	0	0	0	0	105.4
7	Q	37.2	Very low	34	Very low	191 Å²	191	158.7 Å²	158.7	89%	0.893	79%	0.794	S	S	*	*			trans	-172.6	61.4	153.1	-105.4	160.8	14.4	0	0	110.3
8	N	28	Very low	34	Very low	145 Å²	145	161.2 Å²	161.2	78%	0.775	80%	0.799	S	S	*	*			trans	-71.8	168.6	141.1	-111.2	-9.3	0	0	0	108.8
9	T	30.1	Very low	34.1	Very low	128 Å²	128	163.5 Å²	163.5	79%	0.785	80%	0.798	S	S	*	*			trans	74.3	135.2	178.2	82	0	0	0	0	112.8
10	S	31.6	Very low	34	Very low	100 Å²	100	162.2 Å²	162.2	70%	0.699	79%	0.79	S	S	*	*			cis	-154.3	178.3	31.8	-67.1	0	0	0	0	112.6
11	R	33.7	Very low	34	Very low	224 Å²	224	165 Å²	165	85%	0.845	79%	0.792	S	S	*	*			trans	85.3	97.8	-178.6	-55	175.6	176.2	-177.9	-1.2	112.4
12	T	31.1	Very low	33.9	Very low	128 Å²	128	162.4 Å²	162.4	79%	0.785	77%	0.774	S	S	*	*			cis	49.7	86	19.8	48.3	0	0	0	0	114.7
13	N	36.2	Very low	34	Very low	136 Å²	136	161.9 Å²	161.9	73%	0.727	77%	0.774	S	S	*	*			trans	-160.3	138.3	150.7	-110.6	-25.9	0	0	0	113.7
14	I	39.6	Very low	34	Very low	143 Å²	143	166.8 Å²	166.8	73%	0.733	78%	0.782	S	S	*	*			trans	60.4	96.7	151.3	-51.6	159.7	0	0	0	114.4
15	M	31.9	Very low	34	Very low	142 Å²	142	164.1 Å²	164.1	70%	0.7	78%	0.781	S	S	*	*			cis	59.2	106.6	38.2	-106.3	-166.3	79.8	0	0	116.5
16	R	34	Very low	34.3	Very low	216 Å²	216	169.6 Å²	169.6	82%	0.815	79%	0.793	S	S	*	*			trans	61	110.3	151.7	-68.4	-176.7	172	154.7	-4.1	120.8
17	K	38.6	Very low	34.3	Very low	205 Å²	205	170 Å²	170	89%	0.891	80%	0.796	S	S	*	*			trans	149.2	119.7	141	-86.5	163.6	178.9	177.3	0	105.8
18	K	35.4	Very low	34.1	Very low	203 Å²	203	165.5 Å²	165.5	88%	0.883	79%	0.785	S	S	*	*			cis	59.2	114.1	29.1	-148	179.2	-171.5	-178.8	0	114.5
19	R	35	Very low	34.5	Very low	206 Å²	206	167.1 Å²	167.1	78%	0.777	79%	0.788	S	S	*	*			trans	98	119.8	173	-73.3	-172.7	158.4	140.7	-1	118
20	E	31.6	Very low	34.6	Very low	136 Å²	136	165.2 Å²	165.2	64%	0.636	78%	0.78	S	S	*	*				55	120.6	127.5	-59.3	155.6	-166.4	0	0	119.5
21	R	35	Very low	34.8	Very low	221 Å²	221	167 Å²	167	83%	0.834	79%	0.786	S	S	*	*				176.6	118.7	116.7	-90.3	146.3	-164.5	-160.8	-0.4	108.6
22	K	37.4	Very low	34.8	Very low	185 Å²	185	161.7 Å²	161.7	80%	0.804	78%	0.779	S	S	*	*				80.3	117.1	79	-80.5	-166.3	176.2	-170.7	0	112.9
23	H	33.7	Very low	35	Very low	179 Å²	179	163.7 Å²	163.7	83%	0.829	78%	0.784	S	S	*	*			trans	24.4	125.2	149.7	-60.5	-93.9	0	0	0	120.1
24	R	35.7	Very low	34.9	Very low	251 Å²	251	162.6 Å²	162.6	95%	0.947	79%	0.787	S	S	*	*				-159.3	123.1	118.5	-115.4	174.7	176.3	-169.7	-2.6	111.2
25	S	31.5	Very low	34.9	Very low	100 Å²	100	160.9 Å²	160.9	70%	0.699	79%	0.785	S	S	*	*			trans	-93.6	156.1	163	51.5	0	0	0	0	110.3
26	K	37.9	Very low	35	Very low	207 Å²	207	160.2 Å²	160.2	90%	0.9	79%	0.793	S	S	*	*			trans	-133.4	115.4	154.4	-69	-179	173.1	-174.8	0	103.6
27	V	34.9	Very low	35.2	Very low	125 Å²	125	157.5 Å²	157.5	76%	0.758	79%	0.794	S	S	*	*			cis	76	96.8	42.4	-173.8	0	0	0	0	113.1
28	S	33.9	Very low	35.3	Very low	96 Å²	96	153.7 Å²	153.7	67%	0.671	79%	0.787	S	S	*	*			trans	164.5	119.5	155.9	49.1	0	0	0	0	107.5
29	H	36.1	Very low	35.8	Very low	178 Å²	178	150.7 Å²	150.7	82%	0.824	78%	0.78	S	S	*	*			cis	-144.7	153.2	1.3	-84.3	-75	0	0	0	112.1
30	S	32.7	Very low	36.2	Very low	88 Å²	88	146.5 Å²	146.5	62%	0.615	78%	0.782	S	S	*	*			trans	-19.4	145.2	151.2	45.5	0	0	0	0	117.1
31	V	34.1	Very low	36.9	Very low	138 Å²	138	144.4 Å²	144.4	84%	0.836	78%	0.783	S	S	*	*				-141.8	127.1	60.7	176.2	0	0	0	0	109.1
32	T	34.7	Very low	37.6	Very low	113 Å²	113	137 Å²	137	69%	0.693	77%	0.765	S	S	*	*			cis	78.1	90.6	49.1	-37.2	0	0	0	0	115.9
33	L	35.9	Very low	38.3	Very low	170 Å²	170	134.8 Å²	134.8	89%	0.89	76%	0.761	S	S	*	*			trans	174.3	79.5	148.9	-95.4	171.5	0	0	0	106.7
34	S	34	Very low	38.9	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	76%	0.757	S	S	*	*				75.6	132.8	88.2	-151.2	0	0	0	0	114.2
35	P	39	Very low	39.7	Very low	106 Å²	106	128.4 Å²	128.4	69%	0.688	74%	0.742	S	S	*	*			trans	-120.6	167.6	-144.5	41.5	-29.6	0	0	0	116.2
36	C	34.2	Very low	40.9	Very low	128 Å²	128	126.7 Å²	126.7	87%	0.865	73%	0.728	S	S	*	*			trans	-116.1	128.1	159.8	-163.6	0	0	0	0	110.4
37	L	38.1	Very low	42.1	Very low	159 Å²	159	123.9 Å²	123.9	83%	0.832	72%	0.716	S	S	*	*			trans	-107.7	84.9	-168.8	-78.1	165.7	0	0	0	112.5
38	V	40.5	Very low	43.5	Very low	126 Å²	126	121.3 Å²	121.3	76%	0.764	70%	0.703	S	S	*	*			trans	-151.1	120.1	159.2	-171.6	0	0	0	0	108.8
39	L	45.4	Very low	45	Very low	139 Å²	139	121.2 Å²	121.2	73%	0.728	69%	0.694	S	S	*	*			trans	172.8	-7.7	156.9	-102.5	160.1	0	0	0	115.3	S41 S42	L39-S41 PolarHBondContact O-N 3.32Å; L39-S42 PolarHBondContact O-N 2.74Å
40	S	43.6	Very low	46.6	Very low	118 Å²	118	117.7 Å²	117.7	83%	0.825	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-1	-169.9	49.4	0	0	0	0	116.9
41	S	46.3	Very low	48.4	Very low	93 Å²	93	118.1 Å²	118.1	65%	0.65	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-26	177.6	50.4	0	0	0	0	114.6	L39	L39-S41 PolarHBondContact O-N 3.32Å
42	S	50	Low	50.1	Low	64 Å²	64	116.4 Å²	116.4	45%	0.448	66%	0.66	S	S	.	*	H	α-helix	trans	-74.5	-28	-174.7	-179	0	0	0	0	113.6	L39 E44 T46	L39-S42 PolarHBondContact O-N 2.74Å; S42-E44 VanDerWaalsContact C-N 3.35Å; S42-E44 PolarHBondContact O-N 3.49Å; S42-T46 PolarHBondContact O-N 3.44Å; S42-T46 PolarHBondContact O-OG1 2.81Å; S42-T46 VanDerWaalsContact O-OG1 3.07Å
43	L	51.9	Low	51.9	Low	140 Å²	140	114.7 Å²	114.7	73%	0.733	65%	0.646	S	S	*	*	H	α-helix	trans	-76.8	-17	-173.5	-162.6	64.4	0	0	0	114.1	T46	L43-T46 WeakPolarHBondContact CA-OG1 3.4Å; L43-T46 PolarHBondContact O-OG1 3.23Å
44	E	47.5	Very low	54	Low	160 Å²	160	109.3 Å²	109.3	75%	0.748	62%	0.623	S	S	*	*	H	α-helix	trans	-85.8	-38.4	175.6	-66.5	-165.4	146.6	0	0	112.2	S42 K47 S48	S42-E44 VanDerWaalsContact C-N 3.35Å; S42-E44 PolarHBondContact O-N 3.49Å; E44-K47 WeakPolarHBondContact O-CB 3.43Å; E44-K47 PolarHBondContact O-N 3.12Å; E44-S48 PolarHBondContact O-N 3.09Å
45	Q	50.9	Low	56.4	Low	135 Å²	135	110 Å²	110	63%	0.631	61%	0.613	S	S	*	*	H	α-helix	trans	-65.8	-40.8	175.9	-73.1	-175.8	-13	0	0	112.6	K47 S48 I49	Q45-K47 PolarHBondContact O-N 3.1Å; Q45-S48 PolarHBondContact O-N 2.67Å; Q45-S48 PolarHBondContact O-OG 3.42Å; Q45-I49 WeakPolarHBondContact O-CD1 3.39Å; Q45-I49 WeakPolarHBondContact O-CG1 2.98Å; Q45-I49 PolarHBondContact O-N 2.67Å
46	T	57	Low	58.5	Low	65 Å²	65	110.3 Å²	110.3	40%	0.399	60%	0.604	S	S	.	*	H	α-helix	trans	-63.4	-22.4	176	46.8	0	0	0	0	112.6	S42 L43 N50	S42-T46 PolarHBondContact O-N 3.44Å; S42-T46 PolarHBondContact O-OG1 2.81Å; S42-T46 VanDerWaalsContact O-OG1 3.07Å; L43-T46 WeakPolarHBondContact CA-OG1 3.4Å; L43-T46 PolarHBondContact O-OG1 3.23Å; T46-N50 PolarHBondContact O-ND2 3.19Å
47	K	63.2	Low	60.8	Low	147 Å²	147	111.3 Å²	111.3	64%	0.639	59%	0.589	S	S	*	*	H	α-helix	trans	-80.1	-44.8	175.6	-157.1	172.8	-175.4	179.5	0	112.5	E44 Q45 I49 N50 D51	E44-K47 WeakPolarHBondContact O-CB 3.43Å; E44-K47 PolarHBondContact O-N 3.12Å; Q45-K47 PolarHBondContact O-N 3.1Å; K47-I49 VanDerWaalsContact C-N 3.34Å; K47-I49 PolarHBondContact O-N 2.7Å; K47-N50 PolarHBondContact O-N 3.39Å; K47-D51 PolarHBondContact O-N 3.23Å; K47-D51 VanDerWaalsContact O-N 3.1Å
48	S	65	Low	63.1	Low	71 Å²	71	106.8 Å²	106.8	50%	0.497	57%	0.568	S	S	.	*	H	α-helix	trans	-63.6	-37.4	178.1	57.1	0	0	0	0	113	E44 Q45 N50 D51 E52	E44-S48 PolarHBondContact O-N 3.09Å; Q45-S48 PolarHBondContact O-N 2.67Å; Q45-S48 PolarHBondContact O-OG 3.42Å; S48-N50 VanDerWaalsContact C-N 3.33Å; S48-N50 PolarHBondContact O-N 3.23Å; S48-D51 PolarHBondContact O-N 3.17Å; S48-E52 PolarHBondContact O-N 2.79Å
49	I	64.8	Low	65.3	Low	94 Å²	94	104.2 Å²	104.2	48%	0.482	55%	0.55	S	S	.	*	H	α-helix	trans	-64	-39.2	177	-64.3	164.8	0	0	0	111.2	Q45 K47 L53	Q45-I49 WeakPolarHBondContact O-CD1 3.39Å; Q45-I49 WeakPolarHBondContact O-CG1 2.98Å; Q45-I49 PolarHBondContact O-N 2.67Å; K47-I49 VanDerWaalsContact C-N 3.34Å; K47-I49 PolarHBondContact O-N 2.7Å; I49-L53 HydrophobicContact CG2-CD1 4.16Å; I49-L53 WeakPolarHBondContact O-CB 3.16Å; I49-L53 WeakPolarHBondContact O-CG 3.31Å; I49-L53 PolarHBondContact O-N 3.4Å
50	N	69.3	Low	67.3	Low	104 Å²	104	103.4 Å²	103.4	56%	0.556	54%	0.543	S	S	*	.	H	α-helix	trans	-68.6	-37.6	176.7	-84.7	-64.4	0	0	0	112.4	T46 K47 S48 S54	T46-N50 PolarHBondContact O-ND2 3.19Å; K47-N50 PolarHBondContact O-N 3.39Å; S48-N50 VanDerWaalsContact C-N 3.33Å; S48-N50 PolarHBondContact O-N 3.23Å; N50-S54 WeakPolarHBondContact O-CB 3.4Å; N50-S54 PolarHBondContact O-N 3.32Å
51	D	71.2	Confident	69.3	Low	98 Å²	98	106.3 Å²	106.3	52%	0.524	54%	0.536	S	S	.	.	H	α-helix	trans	-65.2	-44.6	175.6	-71.4	-24.6	0	0	0	110.9	K47 S48 S54 E55	K47-D51 PolarHBondContact O-N 3.23Å; K47-D51 VanDerWaalsContact O-N 3.1Å; S48-D51 PolarHBondContact O-N 3.17Å; D51-S54 WeakPolarHBondContact O-CA 3.49Å; D51-S54 WeakPolarHBondContact O-CB 3.37Å; D51-S54 PolarHBondContact O-N 3.22Å; D51-S54 VanDerWaalsContact O-N 3.08Å; D51-S54 PolarHBondContact O-OG 3.45Å; D51-E55 PolarHBondContact O-N 3.44Å
52	E	69.1	Low	71.4	Confident	102 Å²	102	107.8 Å²	107.8	48%	0.477	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-41.5	177.4	-164.2	-166.8	147	0	0	112.7	S48 S54 E55 K56	S48-E52 PolarHBondContact O-N 2.79Å; E52-S54 PolarHBondContact O-N 3.32Å; E52-E55 PolarHBondContact O-N 3.43Å; E52-K56 PolarHBondContact O-N 3.36Å; E52-K56 WeakPolarHBondContact OE1-CE 3.46Å; E52-K56 IonicContact OE1-NZ 3.25Å; E52-K56 PolarHBondContact OE1-NZ 3.46Å
53	L	74	Confident	73	Confident	77 Å²	77	108.6 Å²	108.6	40%	0.403	53%	0.527	S	S	.	.	H	α-helix	trans	-64.4	-30.3	172.3	-74.3	173.2	0	0	0	112.3	I49 R57	I49-L53 HydrophobicContact CG2-CD1 4.16Å; I49-L53 WeakPolarHBondContact O-CB 3.16Å; I49-L53 WeakPolarHBondContact O-CG 3.31Å; I49-L53 PolarHBondContact O-N 3.4Å; L53-R57 WeakPolarHBondContact O-CD 3.21Å; L53-R57 VanDerWaalsContact O-CG 3.23Å; L53-R57 WeakPolarHBondContact O-CG 3.46Å; L53-R57 PolarHBondContact O-N 3.46Å
54	S	80	Confident	74.6	Confident	57 Å²	57	111 Å²	111	40%	0.399	53%	0.527	S	S	.	.	H	α-helix	trans	-69.9	-40.5	174.6	88.4	0	0	0	0	111.6	N50 D51 E52 R57 V58	N50-S54 WeakPolarHBondContact O-CB 3.4Å; N50-S54 PolarHBondContact O-N 3.32Å; D51-S54 WeakPolarHBondContact O-CA 3.49Å; D51-S54 WeakPolarHBondContact O-CB 3.37Å; D51-S54 PolarHBondContact O-N 3.22Å; D51-S54 VanDerWaalsContact O-N 3.08Å; D51-S54 PolarHBondContact O-OG 3.45Å; E52-S54 PolarHBondContact O-N 3.32Å; S54-R57 PolarHBondContact O-N 3.18Å; S54-V58 WeakPolarHBondContact O-CG2 3.39Å; S54-V58 PolarHBondContact O-N 2.76Å
55	E	83.2	Confident	76.5	Confident	126 Å²	126	107 Å²	107	59%	0.589	52%	0.516	S	S	*	.	H	α-helix	trans	-66.6	-47.7	178.9	-171	159.4	-145.8	0	0	111.1	D51 E52 R57 V58 D59	D51-E55 PolarHBondContact O-N 3.44Å; E52-E55 PolarHBondContact O-N 3.43Å; E55-R57 VanDerWaalsContact C-N 3.3Å; E55-R57 PolarHBondContact O-N 3.09Å; E55-V58 WeakPolarHBondContact O-CA 3.35Å; E55-V58 WeakPolarHBondContact O-CB 3.34Å; E55-V58 PolarHBondContact O-N 3.12Å; E55-D59 PolarHBondContact O-N 2.73Å
56	K	83.7	Confident	78.4	Confident	113 Å²	113	106.4 Å²	106.4	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-56.4	-40.6	173.9	-71.1	176.5	-174.3	169.2	0	112.6	E52 D59 Q60	E52-K56 PolarHBondContact O-N 3.36Å; E52-K56 WeakPolarHBondContact OE1-CE 3.46Å; E52-K56 IonicContact OE1-NZ 3.25Å; E52-K56 PolarHBondContact OE1-NZ 3.46Å; K56-D59 PolarHBondContact O-N 3.4Å; K56-Q60 WeakPolarHBondContact O-CG 3.31Å; K56-Q60 PolarHBondContact O-N 3.48Å
57	R	82.9	Confident	79.9	Confident	149 Å²	149	107 Å²	107	56%	0.562	51%	0.508	S	S	*	.	H	α-helix	trans	-67.9	-35.6	174.4	-72.9	172.1	-170.8	164.3	5.8	112.8	L53 S54 E55 R61	L53-R57 WeakPolarHBondContact O-CD 3.21Å; L53-R57 VanDerWaalsContact O-CG 3.23Å; L53-R57 WeakPolarHBondContact O-CG 3.46Å; L53-R57 PolarHBondContact O-N 3.46Å; S54-R57 PolarHBondContact O-N 3.18Å; E55-R57 VanDerWaalsContact C-N 3.3Å; E55-R57 PolarHBondContact O-N 3.09Å; R57-R61 VanDerWaalsContact O-CG 3.28Å; R57-R61 WeakPolarHBondContact O-CG 3.29Å; R57-R61 PolarHBondContact O-N 3.24Å
58	V	86.3	Confident	80.9	Confident	65 Å²	65	102.8 Å²	102.8	39%	0.394	50%	0.501	S	S	.	.	H	α-helix	trans	-67.5	-41.9	175.9	163.6	0	0	0	0	110.5	S54 E55 R61 K62	S54-V58 WeakPolarHBondContact O-CG2 3.39Å; S54-V58 PolarHBondContact O-N 2.76Å; E55-V58 WeakPolarHBondContact O-CA 3.35Å; E55-V58 WeakPolarHBondContact O-CB 3.34Å; E55-V58 PolarHBondContact O-N 3.12Å; V58-R61 WeakPolarHBondContact O-CB 3.49Å; V58-R61 PolarHBondContact O-N 3.4Å; V58-K62 WeakPolarHBondContact O-CG 3.43Å; V58-K62 PolarHBondContact O-N 3.07Å
59	D	86.6	Confident	81.7	Confident	71 Å²	71	101.5 Å²	101.5	38%	0.38	50%	0.495	S	S	.	.	H	α-helix	trans	-71.9	-38.6	179.7	-72	-17.6	0	0	0	112.7	E55 K56 R61 K62 E63	E55-D59 PolarHBondContact O-N 2.73Å; K56-D59 PolarHBondContact O-N 3.4Å; D59-R61 PolarHBondContact O-N 3.35Å; D59-K62 WeakPolarHBondContact O-CB 3.47Å; D59-K62 PolarHBondContact O-N 3.16Å; D59-K62 VanDerWaalsContact O-N 3.14Å; D59-K62 WeakPolarHBondContact OD1-CD 3.47Å; D59-K62 WeakPolarHBondContact OD1-CE 3.33Å; D59-K62 IonicContact OD1-NZ 2.9Å; D59-K62 PolarHBondContact OD1-NZ 3.31Å; D59-E63 WeakPolarHBondContact O-CB 3.45Å; D59-E63 PolarHBondContact O-N 3.42Å
60	Q	87.1	Confident	82.8	Confident	123 Å²	123	101.2 Å²	101.2	58%	0.575	49%	0.491	S	S	*	.	H	α-helix	trans	-57.4	-36.6	168.2	-76.2	-178.4	-5.1	0	0	112.5	K56 R64	K56-Q60 WeakPolarHBondContact O-CG 3.31Å; K56-Q60 PolarHBondContact O-N 3.48Å; Q60-R64 WeakPolarHBondContact O-CB 3.37Å; Q60-R64 WeakPolarHBondContact O-CG 3.48Å; Q60-R64 PolarHBondContact O-N 2.63Å
61	R	84.9	Confident	83.4	Confident	179 Å²	179	100.5 Å²	100.5	68%	0.675	49%	0.487	S	S	*	.	H	α-helix	trans	-70.4	-39.7	174.7	-72.6	169.6	-179.3	179	0.1	112.3	R57 V58 D59 S65	R57-R61 VanDerWaalsContact O-CG 3.28Å; R57-R61 WeakPolarHBondContact O-CG 3.29Å; R57-R61 PolarHBondContact O-N 3.24Å; V58-R61 WeakPolarHBondContact O-CB 3.49Å; V58-R61 PolarHBondContact O-N 3.4Å; D59-R61 PolarHBondContact O-N 3.35Å; R61-S65 WeakPolarHBondContact O-CB 3.31Å; R61-S65 PolarHBondContact O-N 3.36Å; R61-S65 PolarHBondContact O-OG 3.1Å
62	K	89.9	Confident	83.6	Confident	124 Å²	124	102 Å²	102	54%	0.539	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-45.9	172.8	-68.9	173.8	-166.5	154.5	0	110.5	V58 D59 S65 R66	V58-K62 WeakPolarHBondContact O-CG 3.43Å; V58-K62 PolarHBondContact O-N 3.07Å; D59-K62 WeakPolarHBondContact O-CB 3.47Å; D59-K62 PolarHBondContact O-N 3.16Å; D59-K62 VanDerWaalsContact O-N 3.14Å; D59-K62 WeakPolarHBondContact OD1-CD 3.47Å; D59-K62 WeakPolarHBondContact OD1-CE 3.33Å; D59-K62 IonicContact OD1-NZ 2.9Å; D59-K62 PolarHBondContact OD1-NZ 3.31Å; K62-S65 CarbonylContact O-C 3.47Å; K62-S65 WeakPolarHBondContact O-CB 3.28Å; K62-S65 PolarHBondContact O-N 3.48Å; K62-R66 PolarHBondContact O-N 2.83Å
63	E	85.1	Confident	83.9	Confident	81 Å²	81	106.1 Å²	106.1	38%	0.379	50%	0.496	S	S	.	.	H	α-helix	trans	-70.2	-43	-176.5	-174.4	54	-156.7	0	0	112.5	D59 S65 R66 L67	D59-E63 WeakPolarHBondContact O-CB 3.45Å; D59-E63 PolarHBondContact O-N 3.42Å; E63-S65 PolarHBondContact O-N 3.23Å; E63-R66 VanDerWaalsContact CD-NE 3.28Å; E63-R66 WeakPolarHBondContact O-CB 3.16Å; E63-R66 PolarHBondContact O-N 2.87Å; E63-R66 VanDerWaalsContact O-N 3.11Å; E63-R66 IonicContact OE1-CZ 3.53Å; E63-R66 IonicContact OE1-NE 3.67Å; E63-R66 PolarHBondContact OE1-NE 3.44Å; E63-R66 IonicContact OE1-NH2 3.4Å; E63-R66 PolarHBondContact OE1-NH2 3.04Å; E63-R66 WeakPolarHBondContact OE2-CD 3.27Å; E63-R66 IonicContact OE2-CZ 3.68Å; E63-R66 IonicContact OE2-NE 2.97Å; E63-R66 PolarHBondContact OE2-NE 3.35Å; E63-R66 IonicContact OE2-NH2 3.76Å; E63-L67 HydrophobicContact CG-CD1 4.45Å; E63-L67 WeakPolarHBondContact O-CG 3.19Å; E63-L67 PolarHBondContact O-N 2.85Å
64	R	85.7	Confident	84.1	Confident	191 Å²	191	107 Å²	107	72%	0.721	50%	0.502	S	S	*	.	H	α-helix	trans	-57	-38.2	169	-75.2	-179.7	178.4	-165.3	-0	112	Q60 A68	Q60-R64 WeakPolarHBondContact O-CB 3.37Å; Q60-R64 WeakPolarHBondContact O-CG 3.48Å; Q60-R64 PolarHBondContact O-N 2.63Å; R64-A68 VanDerWaalsContact O-CB 3.28Å; R64-A68 WeakPolarHBondContact O-CB 3.47Å; R64-A68 PolarHBondContact O-N 2.84Å
65	S	86.1	Confident	83.8	Confident	76 Å²	76	112 Å²	112	53%	0.531	51%	0.511	S	S	.	.	H	α-helix	trans	-69.2	-37.9	175.9	-56	0	0	0	0	112.4	R61 K62 E63 A69	R61-S65 WeakPolarHBondContact O-CB 3.31Å; R61-S65 PolarHBondContact O-N 3.36Å; R61-S65 PolarHBondContact O-OG 3.1Å; K62-S65 CarbonylContact O-C 3.47Å; K62-S65 WeakPolarHBondContact O-CB 3.28Å; K62-S65 PolarHBondContact O-N 3.48Å; E63-S65 PolarHBondContact O-N 3.23Å; S65-A69 WeakPolarHBondContact O-CB 3.33Å; S65-A69 PolarHBondContact O-N 2.73Å
66	R	92.2	Very high	83.1	Confident	121 Å²	121	108.3 Å²	108.3	46%	0.457	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-49	175.4	-167.5	-166	69.6	71.9	-0.4	110.9	K62 E63 A69 Q70	K62-R66 PolarHBondContact O-N 2.83Å; E63-R66 VanDerWaalsContact CD-NE 3.28Å; E63-R66 WeakPolarHBondContact O-CB 3.16Å; E63-R66 PolarHBondContact O-N 2.87Å; E63-R66 VanDerWaalsContact O-N 3.11Å; E63-R66 IonicContact OE1-CZ 3.53Å; E63-R66 IonicContact OE1-NE 3.67Å; E63-R66 PolarHBondContact OE1-NE 3.44Å; E63-R66 IonicContact OE1-NH2 3.4Å; E63-R66 PolarHBondContact OE1-NH2 3.04Å; E63-R66 WeakPolarHBondContact OE2-CD 3.27Å; E63-R66 IonicContact OE2-CZ 3.68Å; E63-R66 IonicContact OE2-NE 2.97Å; E63-R66 PolarHBondContact OE2-NE 3.35Å; E63-R66 IonicContact OE2-NH2 3.76Å; R66-A69 PolarHBondContact O-N 3.21Å; R66-Q70 WeakPolarHBondContact O-CB 3.47Å; R66-Q70 PolarHBondContact O-N 2.96Å
67	L	88.3	Confident	82.5	Confident	77 Å²	77	104.2 Å²	104.2	40%	0.403	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-45.5	177.1	-69.7	170.7	0	0	0	111.9	E63 A69 Q70 I71	E63-L67 HydrophobicContact CG-CD1 4.45Å; E63-L67 WeakPolarHBondContact O-CG 3.19Å; E63-L67 PolarHBondContact O-N 2.85Å; L67-A69 VanDerWaalsContact C-N 3.32Å; L67-A69 PolarHBondContact O-N 2.94Å; L67-Q70 PolarHBondContact O-N 3.07Å; L67-Q70 VanDerWaalsContact O-N 3.14Å; L67-I71 WeakPolarHBondContact O-CG1 3.25Å; L67-I71 PolarHBondContact O-N 3.29Å
68	A	83.4	Confident	81.8	Confident	60 Å²	60	103 Å²	103	50%	0.496	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-39.8	176.2	0	0	0	0	0	112.4	R64 R72	R64-A68 VanDerWaalsContact O-CB 3.28Å; R64-A68 WeakPolarHBondContact O-CB 3.47Å; R64-A68 PolarHBondContact O-N 2.84Å; A68-R72 VanDerWaalsContact O-CB 3.29Å; A68-R72 WeakPolarHBondContact O-CB 3.23Å; A68-R72 PolarHBondContact O-N 3.26Å
69	A	82.4	Confident	80.8	Confident	44 Å²	44	102.5 Å²	102.5	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-67.3	-36.6	174.5	0	0	0	0	0	112.7	S65 R66 L67 R73	S65-A69 WeakPolarHBondContact O-CB 3.33Å; S65-A69 PolarHBondContact O-N 2.73Å; R66-A69 PolarHBondContact O-N 3.21Å; L67-A69 VanDerWaalsContact C-N 3.32Å; L67-A69 PolarHBondContact O-N 2.94Å; A69-R73 WeakPolarHBondContact O-CG 3.34Å; A69-R73 PolarHBondContact O-N 3.39Å
70	Q	87.6	Confident	79.8	Confident	87 Å²	87	100.5 Å²	100.5	41%	0.407	47%	0.473	S	S	.	.	H	α-helix	trans	-67.7	-48	175.9	-173.8	171.1	-8	0	0	111.6	R66 L67 R72 R73 N74	R66-Q70 WeakPolarHBondContact O-CB 3.47Å; R66-Q70 PolarHBondContact O-N 2.96Å; L67-Q70 PolarHBondContact O-N 3.07Å; L67-Q70 VanDerWaalsContact O-N 3.14Å; Q70-R72 VanDerWaalsContact C-N 3.29Å; Q70-R72 PolarHBondContact O-N 3.37Å; Q70-R73 PolarHBondContact O-N 3.11Å; Q70-N74 PolarHBondContact O-N 2.92Å; Q70-N74 PolarHBondContact O-OD1 3.42Å
71	I	81.7	Confident	78.7	Confident	90 Å²	90	98 Å²	98	46%	0.462	46%	0.463	S	S	.	.	H	α-helix	trans	-58.4	-42.6	174.8	-67.4	163.7	0	0	0	110.6	L67 N74 R75	L67-I71 WeakPolarHBondContact O-CG1 3.25Å; L67-I71 PolarHBondContact O-N 3.29Å; I71-N74 PolarHBondContact O-N 2.91Å; I71-R75 WeakPolarHBondContact O-CG 3.39Å; I71-R75 PolarHBondContact O-N 2.94Å
72	R	74.6	Confident	77.8	Confident	130 Å²	130	95 Å²	95	49%	0.491	46%	0.459	S	S	.	.	H	α-helix	trans	-60.4	-47.2	176.5	-177.4	176.9	179.3	149	13.5	112	A68 Q70 N74 R75 E76	A68-R72 VanDerWaalsContact O-CB 3.29Å; A68-R72 WeakPolarHBondContact O-CB 3.23Å; A68-R72 PolarHBondContact O-N 3.26Å; Q70-R72 VanDerWaalsContact C-N 3.29Å; Q70-R72 PolarHBondContact O-N 3.37Å; R72-N74 PolarHBondContact O-N 2.97Å; R72-R75 PolarHBondContact O-N 2.67Å; R72-E76 HydrophobicContact CG-CG 4.49Å; R72-E76 WeakPolarHBondContact CG-OE1 3.4Å; R72-E76 IonicContact CZ-OE1 3.95Å; R72-E76 IonicContact NE-OE1 3.68Å; R72-E76 PolarHBondContact NE-OE1 2.95Å; R72-E76 IonicContact NH2-OE1 2.62Å; R72-E76 PolarHBondContact NH2-OE1 2.9Å; R72-E76 WeakPolarHBondContact O-CB 3.22Å; R72-E76 WeakPolarHBondContact O-CG 3.31Å; R72-E76 PolarHBondContact O-N 2.84Å
73	R	76.6	Confident	76.4	Confident	187 Å²	187	90.9 Å²	90.9	71%	0.706	44%	0.443	S	S	*	.	H	α-helix	trans	-61.8	-41.6	176.1	-74	176.6	-173.4	165	2.7	112.3	A69 Q70 E76 G77	A69-R73 WeakPolarHBondContact O-CG 3.34Å; A69-R73 PolarHBondContact O-N 3.39Å; Q70-R73 PolarHBondContact O-N 3.11Å; R73-E76 PolarHBondContact O-N 3.23Å; R73-G77 PolarHBondContact O-N 2.83Å
74	N	77.5	Confident	75.1	Confident	96 Å²	96	89.3 Å²	89.3	51%	0.513	44%	0.435	S	S	.	.	H	α-helix	trans	-64	-42.8	178.6	-70.3	7.3	0	0	0	111.6	Q70 I71 R72 G77 Q78	Q70-N74 PolarHBondContact O-N 2.92Å; Q70-N74 PolarHBondContact O-OD1 3.42Å; I71-N74 PolarHBondContact O-N 2.91Å; R72-N74 PolarHBondContact O-N 2.97Å; N74-G77 PolarHBondContact O-N 3.41Å; N74-Q78 WeakPolarHBondContact O-CG 3.36Å; N74-Q78 PolarHBondContact O-N 2.92Å
75	R	74.5	Confident	73.7	Confident	161 Å²	161	85.9 Å²	85.9	61%	0.608	43%	0.431	S	S	*	.	H	α-helix	trans	-67.5	-40.4	174.8	-71.6	-178.9	178.7	178.6	0.6	112.9	I71 R72 G77 S79	I71-R75 WeakPolarHBondContact O-CG 3.39Å; I71-R75 PolarHBondContact O-N 2.94Å; R72-R75 PolarHBondContact O-N 2.67Å; R75-G77 VanDerWaalsContact C-N 3.35Å; R75-S79 WeakPolarHBondContact O-CB 3.38Å; R75-S79 PolarHBondContact O-N 2.92Å; R75-S79 PolarHBondContact O-OG 2.91Å
76	E	67.7	Low	72.1	Confident	50 Å²	50	86.1 Å²	86.1	23%	0.234	44%	0.438	C	S	.	.	H	α-helix	trans	-61.2	-44	173.2	-75.4	-179.2	-157	0	0	110.1	R72 R73 S79 L80 R184	R72-E76 HydrophobicContact CG-CG 4.49Å; R72-E76 WeakPolarHBondContact CG-OE1 3.4Å; R72-E76 IonicContact CZ-OE1 3.95Å; R72-E76 IonicContact NE-OE1 3.68Å; R72-E76 PolarHBondContact NE-OE1 2.95Å; R72-E76 IonicContact NH2-OE1 2.62Å; R72-E76 PolarHBondContact NH2-OE1 2.9Å; R72-E76 WeakPolarHBondContact O-CB 3.22Å; R72-E76 WeakPolarHBondContact O-CG 3.31Å; R72-E76 PolarHBondContact O-N 2.84Å; R73-E76 PolarHBondContact O-N 3.23Å; E76-S79 WeakPolarHBondContact O-CB 3.42Å; E76-S79 PolarHBondContact O-N 3.39Å; E76-L80 VanDerWaalsContact O-CG 3.32Å; E76-L80 WeakPolarHBondContact O-CG 3.42Å; E76-L80 PolarHBondContact O-N 2.89Å; E76-R184 IonicContact OE2-CZ 3.3Å; E76-R184 IonicContact OE2-NE 3.49Å; E76-R184 IonicContact OE2-NH2 3.09Å; E76-R184 PolarHBondContact OE2-NH2 3.35Å
77	G	71.9	Confident	70	Confident	26 Å²	26	83.8 Å²	83.8	27%	0.268	43%	0.434	S	S	.	.	H	α-helix	trans	-63.6	-44.2	176	0	0	0	0	0	114.6	R73 N74 R75 S79 L80 M81	R73-G77 PolarHBondContact O-N 2.83Å; N74-G77 PolarHBondContact O-N 3.41Å; R75-G77 VanDerWaalsContact C-N 3.35Å; G77-S79 VanDerWaalsContact C-N 3.31Å; G77-S79 PolarHBondContact O-N 3.41Å; G77-L80 PolarHBondContact O-N 3.2Å; G77-M81 PolarHBondContact O-N 3.44Å
78	Q	67.8	Low	68	Low	124 Å²	124	86.1 Å²	86.1	58%	0.579	45%	0.454	S	S	*	.	H	α-helix	trans	-61.1	-40.6	172.8	-75.7	176.8	-12.2	0	0	111.8	N74 M81 L82	N74-Q78 WeakPolarHBondContact O-CG 3.36Å; N74-Q78 PolarHBondContact O-N 2.92Å; Q78-M81 PolarHBondContact O-N 3.09Å; Q78-L82 WeakPolarHBondContact O-CG 3.47Å; Q78-L82 PolarHBondContact O-N 3.41Å
79	S	64.8	Low	66.4	Low	54 Å²	54	86.2 Å²	86.2	38%	0.378	45%	0.445	S	S	.	.	H	α-helix	trans	-65	-41	177.3	-54.7	0	0	0	0	111.7	R75 E76 G77 L82 I83	R75-S79 WeakPolarHBondContact O-CB 3.38Å; R75-S79 PolarHBondContact O-N 2.92Å; R75-S79 PolarHBondContact O-OG 2.91Å; E76-S79 WeakPolarHBondContact O-CB 3.42Å; E76-S79 PolarHBondContact O-N 3.39Å; G77-S79 VanDerWaalsContact C-N 3.31Å; G77-S79 PolarHBondContact O-N 3.41Å; S79-L82 PolarHBondContact O-N 3.14Å; S79-I83 WeakPolarHBondContact O-CD1 3.33Å; S79-I83 VanDerWaalsContact O-CG1 3.27Å; S79-I83 WeakPolarHBondContact O-CG1 3.21Å; S79-I83 PolarHBondContact O-N 3.34Å
80	L	65.5	Low	64.8	Low	30 Å²	30	87.5 Å²	87.5	16%	0.157	45%	0.452	C	S	.	.	H	α-helix	trans	-62.6	-43	174.4	-71.8	172.3	0	0	0	112	E76 G77 I83 Q84 L183	E76-L80 VanDerWaalsContact O-CG 3.32Å; E76-L80 WeakPolarHBondContact O-CG 3.42Å; E76-L80 PolarHBondContact O-N 2.89Å; G77-L80 PolarHBondContact O-N 3.2Å; L80-I83 PolarHBondContact O-N 2.96Å; L80-Q84 WeakPolarHBondContact O-CB 3.43Å; L80-Q84 PolarHBondContact O-N 2.98Å; L80-L183 HydrophobicContact CD2-CB 3.93Å; L80-L183 HydrophobicContact CD2-CD1 3.68Å; L80-L183 HydrophobicContact CD2-CD2 4.22Å; L80-L183 HydrophobicContact CD2-CG 4.16Å
81	M	64.9	Low	62.9	Low	71 Å²	71	85.5 Å²	85.5	35%	0.35	45%	0.447	S	S	.	.	H	α-helix	trans	-62.5	-43	176.1	-172.3	-176	75.3	0	0	111.9	G77 Q78 Q84 N85	G77-M81 PolarHBondContact O-N 3.44Å; Q78-M81 PolarHBondContact O-N 3.09Å; M81-Q84 PolarHBondContact O-N 3.2Å; M81-N85 VanDerWaalsContact O-CG 3.23Å; M81-N85 PolarHBondContact O-N 3.02Å; M81-N85 PolarHBondContact O-OD1 3.05Å
82	L	66.1	Low	61.4	Low	115 Å²	115	87.9 Å²	87.9	60%	0.602	46%	0.456	S	S	*	.	H	α-helix	trans	-63.3	-40.9	175.3	-72.7	169.8	0	0	0	112.2	Q78 S79 N85 A86	Q78-L82 WeakPolarHBondContact O-CG 3.47Å; Q78-L82 PolarHBondContact O-N 3.41Å; S79-L82 PolarHBondContact O-N 3.14Å; L82-N85 PolarHBondContact O-N 3.09Å; L82-A86 WeakPolarHBondContact O-CB 3.25Å; L82-A86 PolarHBondContact O-N 3.48Å; L82-A86 VanDerWaalsContact O-N 3.1Å
83	I	60.5	Low	60.1	Low	38 Å²	38	86.5 Å²	86.5	20%	0.195	46%	0.462	C	S	.	.	H	α-helix	trans	-68.9	-39.6	176.9	-67	164	0	0	0	111.1	S79 L80 N85 A86 L87 L183	S79-I83 WeakPolarHBondContact O-CD1 3.33Å; S79-I83 VanDerWaalsContact O-CG1 3.27Å; S79-I83 WeakPolarHBondContact O-CG1 3.21Å; S79-I83 PolarHBondContact O-N 3.34Å; L80-I83 PolarHBondContact O-N 2.96Å; I83-N85 VanDerWaalsContact C-N 3.29Å; I83-N85 PolarHBondContact O-N 2.97Å; I83-A86 PolarHBondContact O-N 2.84Å; I83-A86 VanDerWaalsContact O-N 3.12Å; I83-L87 HydrophobicContact CG2-CD1 3.7Å; I83-L87 HydrophobicContact CG2-CG 4.16Å; I83-L87 WeakPolarHBondContact O-CG 3.37Å; I83-L87 PolarHBondContact O-N 2.99Å; I83-L183 HydrophobicContact CB-CD2 4.4Å; I83-L183 HydrophobicContact CD1-CD2 4.06Å; I83-L183 HydrophobicContact CG2-CD2 3.66Å
84	Q	57.3	Low	58.5	Low	47 Å²	47	78.1 Å²	78.1	22%	0.22	43%	0.431	C	S	.	.	H	α-helix	trans	-60.9	-38.9	174.5	-178.3	179.1	-29	0	0	111.7	L80 M81 A86	L80-Q84 WeakPolarHBondContact O-CB 3.43Å; L80-Q84 PolarHBondContact O-N 2.98Å; M81-Q84 PolarHBondContact O-N 3.2Å; Q84-A86 VanDerWaalsContact C-N 3.3Å; Q84-A86 PolarHBondContact O-N 3.12Å
85	N	55.7	Low	56.7	Low	120 Å²	120	75 Å²	75	64%	0.642	42%	0.422	S	S	*	.	H	α-helix	trans	-74.4	-18.7	175.9	-67	-9.6	0	0	0	113.5	M81 L82 I83	M81-N85 VanDerWaalsContact O-CG 3.23Å; M81-N85 PolarHBondContact O-N 3.02Å; M81-N85 PolarHBondContact O-OD1 3.05Å; L82-N85 PolarHBondContact O-N 3.09Å; I83-N85 VanDerWaalsContact C-N 3.29Å; I83-N85 PolarHBondContact O-N 2.97Å
86	A	52.6	Low	55.3	Low	81 Å²	81	69 Å²	69	67%	0.669	40%	0.401	S	S	*	.	H	α-helix	trans	-95.9	-16.2	-179.7	0	0	0	0	0	114	L82 I83 Q84	L82-A86 WeakPolarHBondContact O-CB 3.25Å; L82-A86 PolarHBondContact O-N 3.48Å; L82-A86 VanDerWaalsContact O-N 3.1Å; I83-A86 PolarHBondContact O-N 2.84Å; I83-A86 VanDerWaalsContact O-N 3.12Å; Q84-A86 VanDerWaalsContact C-N 3.3Å; Q84-A86 PolarHBondContact O-N 3.12Å
87	L	49.6	Very low	54.1	Low	72 Å²	72	71.6 Å²	71.6	38%	0.377	42%	0.417	S	S	.	.	S	Bend	trans	-93.1	133.3	178.8	-73.4	172	0	0	0	111.2	I83 I89	I83-L87 HydrophobicContact CG2-CD1 3.7Å; I83-L87 HydrophobicContact CG2-CG 4.16Å; I83-L87 WeakPolarHBondContact O-CG 3.37Å; I83-L87 PolarHBondContact O-N 2.99Å; L87-I89 HydrophobicContact CB-CG1 4.43Å; L87-I89 PolarHBondContact O-N 2.85Å
88	P	44.6	Very low	52.6	Low	125 Å²	125	78.3 Å²	78.3	81%	0.812	45%	0.446	S	S	*	.	S	Bend	trans	-77.9	47.7	174.4	35	-37	0	0	0	111.6
89	I	51.4	Low	51.2	Low	63 Å²	63	76.1 Å²	76.1	32%	0.323	44%	0.437	S	S	.	.	S	Bend	trans	-133.4	123.4	-174.4	-52.5	177.3	0	0	0	108.9	L87 V93 L94	L87-I89 HydrophobicContact CB-CG1 4.43Å; L87-I89 PolarHBondContact O-N 2.85Å; I89-V93 HydrophobicContact CG2-CB 3.84Å; I89-V93 HydrophobicContact CG2-CG1 3.9Å; I89-L94 HydrophobicContact CB-CD1 4.3Å; I89-L94 HydrophobicContact CB-CD2 4.41Å; I89-L94 HydrophobicContact CB-CG 4.33Å; I89-L94 HydrophobicContact CD1-CD2 4.44Å; I89-L94 HydrophobicContact CG2-CD1 4.3Å; I89-L94 HydrophobicContact CG2-CD2 3.89Å; I89-L94 HydrophobicContact CG2-CG 3.8Å
90	S	47.3	Very low	49.7	Very low	71 Å²	71	82.1 Å²	82.1	50%	0.497	46%	0.459	S	S	.	.			trans	-56.6	139.6	177.4	171.9	0	0	0	0	112.1	H92 V93 L94	S90-H92 PolarHBondContact O-N 3.28Å; S90-H92 VanDerWaalsContact O-N 3.1Å; S90-H92 PolarHBondContact OG-N 2.71Å; S90-V93 WeakPolarHBondContact O-CB 3.33Å; S90-V93 PolarHBondContact O-N 2.81Å; S90-L94 PolarHBondContact O-N 3.11Å
91	S	48.6	Very low	48.2	Very low	45 Å²	45	87.1 Å²	87.1	32%	0.315	48%	0.482	S	S	.	.	H	α-helix	trans	-52.5	-32.1	175.3	52.4	0	0	0	0	113.1	V93 L94 G95 L96	S91-V93 VanDerWaalsContact C-N 3.3Å; S91-V93 PolarHBondContact O-N 2.99Å; S91-L94 PolarHBondContact O-N 3.01Å; S91-G95 PolarHBondContact O-N 2.92Å; S91-G95 VanDerWaalsContact O-N 3.15Å; S91-L96 PolarHBondContact O-N 3.23Å; S91-L96 VanDerWaalsContact O-N 3.15Å
92	H	49.2	Very low	46.5	Very low	140 Å²	140	91.6 Å²	91.6	65%	0.648	51%	0.507	S	S	*	.	H	α-helix	trans	-65.8	-29.3	176.7	-165.6	-62	0	0	0	113	S90	S90-H92 PolarHBondContact O-N 3.28Å; S90-H92 VanDerWaalsContact O-N 3.1Å; S90-H92 PolarHBondContact OG-N 2.71Å
93	V	47.1	Very low	44.8	Very low	100 Å²	100	89.9 Å²	89.9	61%	0.606	51%	0.505	S	S	*	.	H	α-helix	trans	-81.8	-33.1	177	179.8	0	0	0	0	110.9	I89 S90 S91 G95	I89-V93 HydrophobicContact CG2-CB 3.84Å; I89-V93 HydrophobicContact CG2-CG1 3.9Å; S90-V93 WeakPolarHBondContact O-CB 3.33Å; S90-V93 PolarHBondContact O-N 2.81Å; S91-V93 VanDerWaalsContact C-N 3.3Å; S91-V93 PolarHBondContact O-N 2.99Å; V93-G95 VanDerWaalsContact C-N 3.31Å; V93-G95 PolarHBondContact O-N 2.94Å
94	L	43.4	Very low	43.2	Very low	11 Å²	11	97.6 Å²	97.6	6%	0.058	54%	0.537	C	S	.	.	H	α-helix	trans	-81.4	-6.2	178.8	-61.4	171.4	0	0	0	113.7	I89 S90 S91 L96 L177	I89-L94 HydrophobicContact CB-CD1 4.3Å; I89-L94 HydrophobicContact CB-CD2 4.41Å; I89-L94 HydrophobicContact CB-CG 4.33Å; I89-L94 HydrophobicContact CD1-CD2 4.44Å; I89-L94 HydrophobicContact CG2-CD1 4.3Å; I89-L94 HydrophobicContact CG2-CD2 3.89Å; I89-L94 HydrophobicContact CG2-CG 3.8Å; S90-L94 PolarHBondContact O-N 3.11Å; S91-L94 PolarHBondContact O-N 3.01Å; L94-L96 HydrophobicContact CB-CD1 3.82Å; L94-L96 HydrophobicContact CB-CG 3.86Å; L94-L96 HydrophobicContact CD1-CD1 4.04Å; L94-L96 PolarHBondContact O-N 2.79Å; L94-L177 HydrophobicContact CB-CD1 4.44Å; L94-L177 HydrophobicContact CD2-CD1 3.64Å
95	G	39.8	Very low	41.8	Very low	31 Å²	31	100.3 Å²	100.3	32%	0.32	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	71.6	13.5	-177.4	0	0	0	0	0	114.8	S91 V93 N97	S91-G95 PolarHBondContact O-N 2.92Å; S91-G95 VanDerWaalsContact O-N 3.15Å; V93-G95 VanDerWaalsContact C-N 3.31Å; V93-G95 PolarHBondContact O-N 2.94Å; G95-N97 PolarHBondContact O-N 2.79Å; G95-N97 VanDerWaalsContact O-N 3.13Å
96	L	45.8	Very low	40.4	Very low	34 Å²	34	99.1 Å²	99.1	18%	0.178	56%	0.562	C	S	.	*			trans	-87.1	34.8	-171	-65	175	0	0	0	113.2	S91 L94 L98	S91-L96 PolarHBondContact O-N 3.23Å; S91-L96 VanDerWaalsContact O-N 3.15Å; L94-L96 HydrophobicContact CB-CD1 3.82Å; L94-L96 HydrophobicContact CB-CG 3.86Å; L94-L96 HydrophobicContact CD1-CD1 4.04Å; L94-L96 PolarHBondContact O-N 2.79Å; L96-L98 PolarHBondContact O-N 2.81Å
97	N	42.6	Very low	39.2	Very low	105 Å²	105	101.8 Å²	101.8	56%	0.561	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	32.9	-178.5	-72.3	-7.5	0	0	0	113.9	G95	G95-N97 PolarHBondContact O-N 2.79Å; G95-N97 VanDerWaalsContact O-N 3.13Å
98	L	40.2	Very low	38.3	Very low	167 Å²	167	104.3 Å²	104.3	87%	0.874	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.9	10.4	-177.7	-100	122.2	0	0	0	114.9	L96	L96-L98 PolarHBondContact O-N 2.81Å
99	I	38	Very low	37.6	Very low	79 Å²	79	104.3 Å²	104.3	41%	0.405	58%	0.581	S	S	.	*			trans	-117.3	47	166.3	-40.1	179.7	0	0	0	109.9
100	Q	33.7	Very low	36.6	Very low	179 Å²	179	108.1 Å²	108.1	84%	0.836	60%	0.602	S	S	*	*			trans	-76	119.7	155.2	-165.8	166.4	11.6	0	0	106.2	N102	Q100-N102 PolarHBondContact O-N 3.23Å
101	Q	34	Very low	35.8	Very low	136 Å²	136	108.5 Å²	108.5	64%	0.636	62%	0.617	S	S	*	*			trans	-54.4	136.7	175.9	-73	178.7	-26.5	0	0	109.1	S103	Q101-S103 WeakPolarHBondContact CB-OG 3.43Å; Q101-S103 PolarHBondContact O-N 2.8Å
102	N	28.7	Very low	34.9	Very low	164 Å²	164	113 Å²	113	88%	0.877	64%	0.643	S	S	*	*			trans	-73.6	53.8	167.1	-81.2	-41.4	0	0	0	110.3	Q100 K104	Q100-N102 PolarHBondContact O-N 3.23Å; N102-K104 VanDerWaalsContact C-N 3.31Å; N102-K104 PolarHBondContact O-N 2.86Å
103	S	30.2	Very low	34.3	Very low	79 Å²	79	115.9 Å²	115.9	55%	0.552	65%	0.654	S	S	*	*			trans	-67.2	94.6	163.4	-35.7	0	0	0	0	106.2	Q101 S105	Q101-S103 WeakPolarHBondContact CB-OG 3.43Å; Q101-S103 PolarHBondContact O-N 2.8Å; S103-S105 PolarHBondContact O-N 2.83Å
104	K	26.9	Very low	33.5	Very low	200 Å²	200	120 Å²	120	87%	0.87	67%	0.667	S	S	*	*			trans	-69.7	70.4	171.8	-73.8	-178.3	175.9	178	0	110	N102 S106	N102-K104 VanDerWaalsContact C-N 3.31Å; N102-K104 PolarHBondContact O-N 2.86Å; K104-S106 VanDerWaalsContact C-N 3.27Å; K104-S106 PolarHBondContact O-N 2.93Å
105	S	27.7	Very low	33.1	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	71%	0.705	S	S	*	*			trans	-94.6	60.7	162	65	0	0	0	0	109.3	S103	S103-S105 PolarHBondContact O-N 2.83Å
106	S	27.1	Very low	32.9	Very low	94 Å²	94	133 Å²	133	66%	0.657	73%	0.726	S	S	*	*			trans	-64.1	133.2	161.8	45.9	0	0	0	0	108.7	K104	K104-S106 VanDerWaalsContact C-N 3.27Å; K104-S106 PolarHBondContact O-N 2.93Å
107	N	27.6	Very low	32.3	Very low	137 Å²	137	140 Å²	140	73%	0.733	76%	0.759	S	S	*	*			trans	86.7	81.5	174.2	-47.8	-18.3	0	0	0	116.8
108	S	29.7	Very low	31.8	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	76%	0.763	S	S	*	*			trans	-125.2	89.3	130.1	71.7	0	0	0	0	108.9
109	I	30.8	Very low	31.3	Very low	125 Å²	125	136.6 Å²	136.6	64%	0.641	76%	0.755	S	S	*	*			trans	-73.3	151.1	179.3	-76.7	167.7	0	0	0	110
110	N	30.3	Very low	31.1	Very low	143 Å²	143	140.2 Å²	140.2	77%	0.765	77%	0.77	S	S	*	*			trans	70.1	95.4	168.8	-64.7	-15.1	0	0	0	118.8	T112	N110-T112 PolarHBondContact O-N 2.86Å
111	G	29.8	Very low	31.2	Very low	80 Å²	80	137.2 Å²	137.2	83%	0.825	76%	0.759	S	S	*	*			trans	-65.4	122.2	141.4	0	0	0	0	0	109.7	K113	G111-K113 PolarHBondContact O-N 2.87Å; G111-K113 VanDerWaalsContact O-N 3.12Å
112	T	30.1	Very low	31.2	Very low	139 Å²	139	136.7 Å²	136.7	85%	0.853	76%	0.761	S	S	*	*			trans	-67.3	104.5	-178.6	45.9	0	0	0	0	112.1	N110	N110-T112 PolarHBondContact O-N 2.86Å
113	K	36.1	Very low	31.6	Very low	200 Å²	200	135.4 Å²	135.4	87%	0.87	75%	0.754	S	S	*	*			trans	-105.8	126.1	150.1	-82.8	-170.1	173.9	-175.7	0	108.8	G111 I115	G111-K113 PolarHBondContact O-N 2.87Å; G111-K113 VanDerWaalsContact O-N 3.12Å; K113-I115 PolarHBondContact O-N 2.99Å
114	Q	30.1	Very low	31.6	Very low	188 Å²	188	138.5 Å²	138.5	88%	0.879	76%	0.761	S	S	*	*			trans	-60.3	121.3	-177.7	-60.9	164.1	-6.6	0	0	111.2
115	I	35.5	Very low	31.8	Very low	170 Å²	170	135.4 Å²	135.4	87%	0.872	75%	0.753	S	S	*	*			trans	-140.1	134.6	146.8	-58.6	-174.5	0	0	0	106.7	K113	K113-I115 PolarHBondContact O-N 2.99Å
116	N	35.6	Very low	31.9	Very low	143 Å²	143	136 Å²	136	77%	0.765	75%	0.753	S	S	*	*			trans	-84.4	145.5	-167.7	-75.6	-33.3	0	0	0	114.2
117	Q	33	Very low	32.2	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	76%	0.761	S	S	*	*			trans	78.1	153.8	139	-80.9	-169.8	-2.2	0	0	120.2
118	P	32.9	Very low	32.3	Very low	101 Å²	101	134.7 Å²	134.7	66%	0.656	76%	0.763	S	S	*	*				-135.5	-164.4	-125.5	44.5	-27.2	0	0	0	114.2
119	S	29.9	Very low	32.4	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	74%	0.742	S	S	*	*			trans	68.5	149.5	158.1	59.4	0	0	0	0	115.6
120	E	32.9	Very low	32.5	Very low	154 Å²	154	133.7 Å²	133.7	72%	0.72	75%	0.75	S	S	*	*			cis	-162	161.5	16.2	-141.7	170.6	-122.1	0	0	111.1
121	N	36.4	Very low	32.3	Very low	117 Å²	117	129.8 Å²	129.8	63%	0.626	74%	0.743	S	S	*	*			trans	65.4	156.1	154.6	-60.9	-41.2	0	0	0	120.7
122	N	33.9	Very low	32.3	Very low	124 Å²	124	137.9 Å²	137.9	66%	0.663	75%	0.749	S	S	*	*			cis	-179.4	150.8	-45	-108.9	-33	0	0	0	106.7
123	N	36.5	Very low	32.2	Very low	138 Å²	138	134.8 Å²	134.8	74%	0.738	75%	0.745	S	S	*	*			trans	65.7	154.4	159.7	-61.8	-11.5	0	0	0	117.3
124	M	30.3	Very low	32	Very low	143 Å²	143	134.4 Å²	134.4	70%	0.704	75%	0.746	S	S	*	*			cis	-175.4	147.2	-32	-128.4	162.8	62.8	0	0	105.1
125	I	31.1	Very low	31.9	Very low	136 Å²	136	135 Å²	135	70%	0.697	75%	0.746	S	S	*	*			trans	64.9	132.7	149.1	-70.6	176.6	0	0	0	116.8
126	T	31.2	Very low	31.5	Very low	118 Å²	118	136 Å²	136	72%	0.724	74%	0.744	S	S	*	*			cis	-156.5	168.9	-0.6	12.2	0	0	0	0	108.3
127	P	31.8	Very low	31.2	Very low	127 Å²	127	134.2 Å²	134.2	83%	0.825	74%	0.738	S	S	*	*			trans	-78.4	146.2	-169.8	32.4	-35.3	0	0	0	114.1
128	G	31.5	Very low	30.7	Very low	75 Å²	75	129.5 Å²	129.5	77%	0.773	73%	0.731	S	S	*	*			trans	-134.6	121.8	175.2	0	0	0	0	0	111.4
129	T	30.9	Very low	30.6	Very low	73 Å²	73	133.9 Å²	133.9	45%	0.448	74%	0.735	S	S	.	*			trans	-64.3	169	-174.8	-49.2	0	0	0	0	113.9	N1178	T129-N1178 WeakPolarHBondContact CG2-ND2 3.35Å
130	I	32.1	Very low	30.3	Very low	157 Å²	157	137.6 Å²	137.6	81%	0.805	74%	0.739	S	S	*	*			trans	86.9	122.3	170.1	-47.2	158.8	0	0	0	112.2
131	G	26.7	Very low	30.1	Very low	60 Å²	60	137.6 Å²	137.6	62%	0.619	74%	0.744	S	S	*	*			cis	118.9	69.8	18.2	0	0	0	0	0	110.9
132	R	30.9	Very low	29.7	Very low	250 Å²	250	136.6 Å²	136.6	94%	0.943	75%	0.747	S	S	*	*			trans	-177.7	135.9	163.9	-95	147.4	-166.6	-146.8	5.9	105.1
133	G	26.2	Very low	29.2	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	75%	0.752	S	S	*	*			cis	104.1	42.8	33.2	0	0	0	0	0	111.1
134	Q	33.2	Very low	29	Very low	192 Å²	192	136 Å²	136	90%	0.897	75%	0.752	S	S	*	*			trans	-118	97.9	165.8	-71	-162.6	-2.6	0	0	110.4
135	K	27.9	Very low	28.7	Very low	201 Å²	201	134.4 Å²	134.4	87%	0.874	76%	0.755	S	S	*	*			trans	-91.2	147.1	158	-146.8	177.3	-170.9	177	0	106.1
136	K	25.7	Very low	28.6	Very low	191 Å²	191	134.8 Å²	134.8	83%	0.83	76%	0.758	S	S	*	*			trans	81.2	135.3	-156.7	-53.7	168.3	178.1	-178.7	0	110.2
137	T	29.6	Very low	28.3	Very low	105 Å²	105	135.5 Å²	135.5	64%	0.644	76%	0.763	S	S	*	*			cis	-121.9	136.2	24.3	25.8	0	0	0	0	114.2	Y139	T137-Y139 HydrophobicContact CG2-CE2 4.06Å
138	A	23.9	Very low	28.1	Very low	85 Å²	85	138 Å²	138	70%	0.702	77%	0.766	S	S	*	*			trans	-81.3	107.9	152.4	0	0	0	0	0	107.9
139	Y	29.4	Very low	27.8	Very low	193 Å²	193	141 Å²	141	76%	0.757	77%	0.769	S	S	*	*			trans	-95.8	114.1	147.7	-71.8	-87	0	0	0	103.8	T137	T137-Y139 HydrophobicContact CG2-CE2 4.06Å
140	F	24.4	Very low	27.6	Very low	177 Å²	177	140 Å²	140	78%	0.776	77%	0.773	S	S	*	*			cis	52.9	99	34.1	-97.8	-69.3	0	0	0	112.5
141	N	27.5	Very low	27.2	Very low	154 Å²	154	141.4 Å²	141.4	82%	0.824	77%	0.774	S	S	*	*			trans	136.7	130.1	165	-71.7	-9.5	0	0	0	108.5
142	S	28.5	Very low	27.3	Very low	96 Å²	96	145.7 Å²	145.7	67%	0.671	78%	0.782	S	S	*	*			cis	-149.4	143.2	-3.9	-173.8	0	0	0	0	110.6	V144	S142-V144 PolarHBondContact O-N 2.87Å
143	T	24.5	Very low	27.1	Very low	128 Å²	128	139 Å²	139	79%	0.785	77%	0.769	S	S	*	*			trans	-50.8	131.1	152.2	35.5	0	0	0	0	110.9
144	V	31.3	Very low	27.3	Very low	121 Å²	121	142.2 Å²	142.2	73%	0.733	77%	0.774	S	S	*	*			trans	-138.6	99	148.4	-178.3	0	0	0	0	107.7	S142	S142-V144 PolarHBondContact O-N 2.87Å
145	S	23.9	Very low	26.9	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	77%	0.77	S	S	*	*			trans	-63.8	136	152.6	-56.9	0	0	0	0	107.8
146	N	29.7	Very low	27	Very low	144 Å²	144	135.8 Å²	135.8	77%	0.77	77%	0.77	S	S	*	*			trans	-156.3	110.2	151.1	-98	-24	0	0	0	111
147	T	25.4	Very low	27	Very low	133 Å²	133	133.4 Å²	133.4	82%	0.816	77%	0.772	S	S	*	*			trans	-45.2	132.2	148.6	35.3	0	0	0	0	111.4
148	M	27	Very low	26.8	Very low	180 Å²	180	132.5 Å²	132.5	89%	0.887	78%	0.775	S	S	*	*			trans	-146.4	93.4	156	-166.3	90.6	169	0	0	109.7
149	T	25.4	Very low	27	Very low	137 Å²	137	134.2 Å²	134.2	84%	0.84	78%	0.777	S	S	*	*			trans	-70.6	134.5	160.2	41.6	0	0	0	0	110.4
150	G	25.9	Very low	26.8	Very low	52 Å²	52	131.3 Å²	131.3	54%	0.536	78%	0.78	S	S	.	*			trans	113.2	141.2	148.9	0	0	0	0	0	118.1
151	F	23.8	Very low	27	Very low	188 Å²	188	129.3 Å²	129.3	83%	0.825	78%	0.782	S	S	*	*			trans	68	134.4	159.1	-65.4	-86.3	0	0	0	117.2
152	L	30.2	Very low	27	Very low	149 Å²	149	131.7 Å²	131.7	78%	0.78	79%	0.788	S	S	*	*			cis	-130.1	141	6.5	-68.3	93	0	0	0	108.7
153	T	25.1	Very low	26.9	Very low	109 Å²	109	133 Å²	133	67%	0.669	79%	0.792	S	S	*	*				51.1	83.5	61.9	65.6	0	0	0	0	116.4
154	T	31.7	Very low	27.1	Very low	143 Å²	143	131.7 Å²	131.7	88%	0.877	79%	0.788	S	S	*	*			trans	-148.7	116.1	134	21.8	0	0	0	0	111.5
155	T	24.8	Very low	26.8	Very low	133 Å²	133	131.9 Å²	131.9	82%	0.816	80%	0.795	S	S	*	*			trans	-50.8	137.1	171.1	45	0	0	0	0	115.2
156	S	28.9	Very low	26.9	Very low	124 Å²	124	132 Å²	132	87%	0.867	80%	0.796	S	S	*	*				-162.5	133.4	116.8	-81.1	0	0	0	0	112.1
157	T	25.6	Very low	26.8	Very low	141 Å²	141	130.7 Å²	130.7	87%	0.865	79%	0.793	S	S	*	*			trans	-80.7	142.3	-178.1	45.9	0	0	0	0	113.2
158	A	26.7	Very low	26.9	Very low	87 Å²	87	133.1 Å²	133.1	72%	0.719	80%	0.799	S	S	*	*				-175	123.1	124.1	0	0	0	0	0	113.7
159	T	27.6	Very low	26.8	Very low	121 Å²	121	128.2 Å²	128.2	74%	0.742	78%	0.782	S	S	*	*			trans	52.7	85.8	143.3	58.7	0	0	0	0	120.8
160	T	25.2	Very low	27	Very low	132 Å²	132	128.9 Å²	128.9	81%	0.81	78%	0.781	S	S	*	*				49.2	94.7	120.9	56.8	0	0	0	0	119.4
161	T	28.2	Very low	27.1	Very low	135 Å²	135	134.1 Å²	134.1	83%	0.828	80%	0.795	S	S	*	*			trans	-151.5	102.8	141.4	6.8	0	0	0	0	107.7	T163	T161-T163 PolarHBondContact O-N 3.48Å
162	E	28.5	Very low	27.5	Very low	204 Å²	204	129.5 Å²	129.5	95%	0.953	78%	0.784	S	S	*	*			trans	-77.2	94.9	-174.2	-73.4	-168.6	159.9	0	0	112.1
163	T	26.6	Very low	27.8	Very low	122 Å²	122	127.4 Å²	127.4	75%	0.748	78%	0.782	S	S	*	*			trans	-69.9	122.7	162.6	-26.3	0	0	0	0	109.9	T161	T161-T163 PolarHBondContact O-N 3.48Å
164	S	27.1	Very low	28.2	Very low	101 Å²	101	125.4 Å²	125.4	71%	0.706	78%	0.776	S	S	*	*			trans	44.5	97.5	144.9	63.9	0	0	0	0	119.2
165	S	25.7	Very low	28.7	Very low	126 Å²	126	121 Å²	121	88%	0.881	75%	0.747	S	S	*	*			trans	-172.3	83.1	137.9	40.1	0	0	0	0	112.9
166	S	26.4	Very low	29.5	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	73%	0.728	S	S	*	*			trans	-133.4	109	167.7	51.5	0	0	0	0	112.9
167	T	27	Very low	30.2	Very low	117 Å²	117	113.1 Å²	113.1	72%	0.718	69%	0.69	S	S	*	*			trans	57.6	97.3	139.8	-30.3	0	0	0	0	118.5	S169	T167-S169 VanDerWaalsContact C-N 3.29Å; T167-S169 WeakPolarHBondContact CG2-OG 3.33Å; T167-S169 PolarHBondContact O-N 3.2Å
168	I	27.4	Very low	31	Very low	185 Å²	185	112.6 Å²	112.6	95%	0.949	68%	0.678	S	S	*	*	S	Bend	trans	-68.5	83	162.8	-56.7	168.6	0	0	0	109.4
169	S	26	Very low	31.7	Very low	76 Å²	76	116.8 Å²	116.8	53%	0.531	68%	0.68	S	S	.	*			trans	-161.7	143.1	168.8	60.8	0	0	0	0	111.5	T167	T167-S169 VanDerWaalsContact C-N 3.29Å; T167-S169 WeakPolarHBondContact CG2-OG 3.33Å; T167-S169 PolarHBondContact O-N 3.2Å
170	N	28.2	Very low	32.7	Very low	151 Å²	151	113.1 Å²	113.1	81%	0.807	66%	0.661	S	S	*	*			trans	75.7	64.7	176.8	-53.1	-21.2	0	0	0	116.5	P172	N170-P172 WeakPolarHBondContact O-CD 3.48Å
171	I	29.7	Very low	33.7	Very low	163 Å²	163	115 Å²	115	84%	0.836	65%	0.654	S	S	*	*			trans	-65.6	123	155.1	-59.5	174.2	0	0	0	107.7
172	P	31.9	Very low	34.5	Very low	90 Å²	90	110.3 Å²	110.3	58%	0.584	63%	0.625	S	S	*	*			trans	-63.2	139.4	179.1	-20.2	32.3	0	0	0	111.3	N170 A174 M225	N170-P172 WeakPolarHBondContact O-CD 3.48Å; P172-A174 PolarHBondContact O-N 2.92Å; P172-M225 HydrophobicContact CB-CE 3.45Å; P172-M225 VanDerWaalsContact CB-CE 3.45Å
173	S	35.2	Very low	35.6	Very low	106 Å²	106	102 Å²	102	74%	0.741	59%	0.586	S	S	*	*			trans	-63.6	111.9	-178.7	56.3	0	0	0	0	111.3	I175	S173-I175 PolarHBondContact O-N 2.88Å
174	A	33.4	Very low	36.6	Very low	67 Å²	67	101.6 Å²	101.6	55%	0.554	57%	0.571	S	S	*	*			trans	-50.5	128.8	179.8	0	0	0	0	0	112.8	P172 N176	P172-A174 PolarHBondContact O-N 2.92Å; A174-N176 PolarHBondContact O-N 2.89Å
175	I	42	Very low	37.9	Very low	49 Å²	49	102 Å²	102	25%	0.251	56%	0.564	S	S	.	*			trans	-68.4	99.5	175.1	-61	177.2	0	0	0	108.1	S173 L177 M225 I227	S173-I175 PolarHBondContact O-N 2.88Å; I175-L177 HydrophobicContact CG2-CD2 3.98Å; I175-L177 HydrophobicContact CG2-CG 4.33Å; I175-L177 PolarHBondContact O-N 2.81Å; I175-M225 HydrophobicContact CD1-SD 3.89Å; I175-M225 HydrophobicContact CG1-SD 4.1Å; I175-I227 HydrophobicContact CG2-CD1 4.13Å
176	N	42	Very low	39	Very low	81 Å²	81	98.5 Å²	98.5	43%	0.433	54%	0.544	S	S	.	.			trans	-75.2	87.8	-179.3	-171.7	-47.7	0	0	0	110.1	A174 E178 K179 A180	A174-N176 PolarHBondContact O-N 2.89Å; N176-E178 PolarHBondContact O-N 3.13Å; N176-E178 VanDerWaalsContact OD1-CB 3.24Å; N176-E178 WeakPolarHBondContact OD1-CB 3.41Å; N176-E178 PolarHBondContact OD1-N 2.84Å; N176-K179 WeakPolarHBondContact O-CB 3.45Å; N176-K179 PolarHBondContact O-N 3.44Å; N176-K179 PolarHBondContact OD1-N 3.01Å; N176-K179 VanDerWaalsContact OD1-N 3.14Å; N176-A180 PolarHBondContact O-N 3.17Å
177	L	44.3	Very low	40	Very low	12 Å²	12	94.1 Å²	94.1	6%	0.063	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.9	-178.5	-65.6	168.9	0	0	0	113.4	L94 I175 A180 L183	L94-L177 HydrophobicContact CB-CD1 4.44Å; L94-L177 HydrophobicContact CD2-CD1 3.64Å; I175-L177 HydrophobicContact CG2-CD2 3.98Å; I175-L177 HydrophobicContact CG2-CG 4.33Å; I175-L177 PolarHBondContact O-N 2.81Å; L177-A180 PolarHBondContact O-N 3.38Å; L177-L183 HydrophobicContact CB-CD1 3.46Å; L177-L183 VanDerWaalsContact CB-CD1 3.46Å; L177-L183 HydrophobicContact CB-CG 4.33Å; L177-L183 HydrophobicContact CD1-CD1 4.18Å; L177-L183 HydrophobicContact CG-CD1 4.45Å
178	E	42.2	Very low	41.2	Very low	130 Å²	130	93.5 Å²	93.5	61%	0.607	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-39.6	172.4	-154.7	-173.3	-166.6	0	0	111.3	N176 A180	N176-E178 PolarHBondContact O-N 3.13Å; N176-E178 VanDerWaalsContact OD1-CB 3.24Å; N176-E178 WeakPolarHBondContact OD1-CB 3.41Å; N176-E178 PolarHBondContact OD1-N 2.84Å; E178-A180 VanDerWaalsContact C-N 3.35Å
179	K	42.3	Very low	42.3	Very low	175 Å²	175	87.9 Å²	87.9	76%	0.761	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-31.7	171.5	-77.9	-177.4	175.4	175.3	0	113.1	N176 R181	N176-K179 WeakPolarHBondContact O-CB 3.45Å; N176-K179 PolarHBondContact O-N 3.44Å; N176-K179 PolarHBondContact OD1-N 3.01Å; N176-K179 VanDerWaalsContact OD1-N 3.14Å; K179-R181 PolarHBondContact O-N 2.78Å
180	A	47.2	Very low	43.6	Very low	43 Å²	43	88 Å²	88	36%	0.355	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.1	-174.8	0	0	0	0	0	113.9	N176 L177 E178 V182	N176-A180 PolarHBondContact O-N 3.17Å; L177-A180 PolarHBondContact O-N 3.38Å; E178-A180 VanDerWaalsContact C-N 3.35Å; A180-V182 HydrophobicContact CB-CG2 4.15Å; A180-V182 PolarHBondContact O-N 3.46Å
181	R	46.6	Very low	44.7	Very low	172 Å²	172	86.8 Å²	86.8	65%	0.649	46%	0.461	S	S	*	.	S	Bend	trans	60.2	-9.7	-172.8	-54.9	-179.4	178.2	-175.1	0.4	115.6	K179 L183 R184 I185	K179-R181 PolarHBondContact O-N 2.78Å; R181-L183 PolarHBondContact O-N 3.23Å; R181-R184 CarbonylContact O-C 3.59Å; R181-R184 WeakPolarHBondContact O-CA 3.36Å; R181-R184 WeakPolarHBondContact O-CB 3.4Å; R181-R184 PolarHBondContact O-N 3.32Å; R181-I185 WeakPolarHBondContact O-CG1 3.33Å; R181-I185 PolarHBondContact O-N 3Å
182	V	45.6	Very low	46	Very low	36 Å²	36	82.6 Å²	82.6	22%	0.218	44%	0.44	C	S	.	.	H	α-helix	trans	-58.6	-47.5	-177.8	-178.6	0	0	0	0	111.8	A180 R184 I185 A186 M218	A180-V182 HydrophobicContact CB-CG2 4.15Å; A180-V182 PolarHBondContact O-N 3.46Å; V182-R184 VanDerWaalsContact C-N 3.26Å; V182-R184 PolarHBondContact O-N 2.99Å; V182-I185 PolarHBondContact O-N 3.42Å; V182-I185 VanDerWaalsContact O-N 3.15Å; V182-A186 PolarHBondContact O-N 3.36Å; V182-M218 HydrophobicContact CG1-SD 4.19Å
183	L	51	Low	47	Very low	29 Å²	29	80.9 Å²	80.9	15%	0.152	43%	0.425	C	S	.	.	H	α-helix	trans	-60.2	-35.2	173.9	-80.1	163.7	0	0	0	112.6	L80 I83 L177 R181 G187	L80-L183 HydrophobicContact CD2-CB 3.93Å; L80-L183 HydrophobicContact CD2-CD1 3.68Å; L80-L183 HydrophobicContact CD2-CD2 4.22Å; L80-L183 HydrophobicContact CD2-CG 4.16Å; I83-L183 HydrophobicContact CB-CD2 4.4Å; I83-L183 HydrophobicContact CD1-CD2 4.06Å; I83-L183 HydrophobicContact CG2-CD2 3.66Å; L177-L183 HydrophobicContact CB-CD1 3.46Å; L177-L183 VanDerWaalsContact CB-CD1 3.46Å; L177-L183 HydrophobicContact CB-CG 4.33Å; L177-L183 HydrophobicContact CD1-CD1 4.18Å; L177-L183 HydrophobicContact CG-CD1 4.45Å; R181-L183 PolarHBondContact O-N 3.23Å; L183-G187 PolarHBondContact O-N 3.31Å
184	R	47.7	Very low	47.7	Very low	114 Å²	114	79.5 Å²	79.5	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-68.9	-40.6	175.4	-178.8	178.8	-73.4	159.9	0.2	111.4	E76 R181 V182 H188	E76-R184 IonicContact OE2-CZ 3.3Å; E76-R184 IonicContact OE2-NE 3.49Å; E76-R184 IonicContact OE2-NH2 3.09Å; E76-R184 PolarHBondContact OE2-NH2 3.35Å; R181-R184 CarbonylContact O-C 3.59Å; R181-R184 WeakPolarHBondContact O-CA 3.36Å; R181-R184 WeakPolarHBondContact O-CB 3.4Å; R181-R184 PolarHBondContact O-N 3.32Å; V182-R184 VanDerWaalsContact C-N 3.26Å; V182-R184 PolarHBondContact O-N 2.99Å; R184-H188 VanDerWaalsContact O-CB 3.27Å; R184-H188 WeakPolarHBondContact O-CB 3.49Å; R184-H188 PolarHBondContact O-CD2 3.44Å; R184-H188 VanDerWaalsContact O-CD2 3.22Å; R184-H188 PolarHBondContact O-N 3.12Å
185	I	54.8	Low	48.8	Very low	109 Å²	109	80.9 Å²	80.9	56%	0.559	40%	0.403	S	S	*	.	H	α-helix	trans	-66.5	-53	177.5	-65.9	165.1	0	0	0	109.7	R181 V182 G187 H188 T189	R181-I185 WeakPolarHBondContact O-CG1 3.33Å; R181-I185 PolarHBondContact O-N 3Å; V182-I185 PolarHBondContact O-N 3.42Å; V182-I185 VanDerWaalsContact O-N 3.15Å; I185-G187 PolarHBondContact O-N 3.07Å; I185-H188 PolarHBondContact O-N 2.82Å; I185-H188 VanDerWaalsContact O-N 3.15Å; I185-T189 PolarHBondContact O-N 2.77Å; I185-T189 PolarHBondContact O-OG1 2.85Å; I185-T189 VanDerWaalsContact O-OG1 3.08Å
186	A	49.2	Very low	49.4	Very low	54 Å²	54	80.5 Å²	80.5	45%	0.446	40%	0.401	S	S	.	.	H	α-helix	trans	-58.5	-44.3	178.8	0	0	0	0	0	112.5	V182 T189 L190	V182-A186 PolarHBondContact O-N 3.36Å; A186-T189 PolarHBondContact O-N 2.8Å; A186-L190 WeakPolarHBondContact O-CB 3.48Å; A186-L190 PolarHBondContact O-N 3.21Å
187	G	46.6	Very low	50	Low	18 Å²	18	77.6 Å²	77.6	19%	0.186	39%	0.388	C	S	.	.	H	α-helix	trans	-63.9	-39.9	175.1	0	0	0	0	0	113.4	L183 I185 F191	L183-G187 PolarHBondContact O-N 3.31Å; I185-G187 PolarHBondContact O-N 3.07Å; G187-F191 WeakPolarHBondContact O-CB 3.44Å; G187-F191 PolarHBondContact O-N 2.85Å
188	H	51.3	Low	50.5	Low	103 Å²	103	80.7 Å²	80.7	48%	0.477	41%	0.41	S	S	.	.	H	α-helix	trans	-65.6	-42.3	174	-95.7	-99	0	0	0	112.2	R184 I185 F191 L192	R184-H188 VanDerWaalsContact O-CB 3.27Å; R184-H188 WeakPolarHBondContact O-CB 3.49Å; R184-H188 PolarHBondContact O-CD2 3.44Å; R184-H188 VanDerWaalsContact O-CD2 3.22Å; R184-H188 PolarHBondContact O-N 3.12Å; I185-H188 PolarHBondContact O-N 2.82Å; I185-H188 VanDerWaalsContact O-N 3.15Å; H188-F191 PolarHBondContact O-N 3.23Å; H188-L192 VanDerWaalsContact O-CB 3.31Å; H188-L192 WeakPolarHBondContact O-CB 3.42Å; H188-L192 PolarHBondContact O-N 3.23Å
189	T	50.6	Low	51	Low	67 Å²	67	81 Å²	81	41%	0.411	41%	0.407	S	S	.	.	H	α-helix	trans	-64.4	-44.8	178.2	-55.6	0	0	0	0	111.3	I185 A186 L192 L193	I185-T189 PolarHBondContact O-N 2.77Å; I185-T189 PolarHBondContact O-OG1 2.85Å; I185-T189 VanDerWaalsContact O-OG1 3.08Å; A186-T189 PolarHBondContact O-N 2.8Å; T189-L192 PolarHBondContact O-N 3.38Å; T189-L193 HydrophobicContact CG2-CD1 4.1Å; T189-L193 WeakPolarHBondContact O-CG 3.47Å; T189-L193 PolarHBondContact O-N 2.87Å
190	L	53.4	Low	51.4	Low	78 Å²	78	77.4 Å²	77.4	41%	0.408	40%	0.395	S	S	.	.	H	α-helix	trans	-66.2	-39.3	176.8	-172.6	65.7	0	0	0	112.1	A186 L193 N194 L208	A186-L190 WeakPolarHBondContact O-CB 3.48Å; A186-L190 PolarHBondContact O-N 3.21Å; L190-L193 PolarHBondContact O-N 2.99Å; L190-N194 WeakPolarHBondContact O-CB 3.49Å; L190-N194 PolarHBondContact O-N 3.31Å; L190-N194 PolarHBondContact O-ND2 2.91Å; L190-L208 HydrophobicContact CD1-CD1 4.25Å
191	F	52.8	Low	51.6	Low	126 Å²	126	84.9 Å²	84.9	55%	0.553	41%	0.414	S	S	*	.	H	α-helix	trans	-64.8	-41.2	174.1	179.2	-95.4	0	0	0	112.1	G187 H188 N194 K195	G187-F191 WeakPolarHBondContact O-CB 3.44Å; G187-F191 PolarHBondContact O-N 2.85Å; H188-F191 PolarHBondContact O-N 3.23Å; F191-N194 PolarHBondContact O-N 2.99Å; F191-K195 HydrophobicContact CE1-CG 4.03Å; F191-K195 HydrophobicContact CZ-CG 4.05Å; F191-K195 WeakPolarHBondContact O-CB 3.48Å; F191-K195 PolarHBondContact O-N 2.93Å
192	L	55.8	Low	51.5	Low	75 Å²	75	80.4 Å²	80.4	39%	0.393	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-46	176.6	-168.2	77.3	0	0	0	110.8	H188 T189 K195 L196	H188-L192 VanDerWaalsContact O-CB 3.31Å; H188-L192 WeakPolarHBondContact O-CB 3.42Å; H188-L192 PolarHBondContact O-N 3.23Å; T189-L192 PolarHBondContact O-N 3.38Å; L192-K195 WeakPolarHBondContact O-CB 3.34Å; L192-K195 PolarHBondContact O-N 3.48Å; L192-L196 HydrophobicContact CD2-CD1 4.46Å; L192-L196 HydrophobicContact CG-CD1 4.11Å; L192-L196 WeakPolarHBondContact O-CB 3.43Å; L192-L196 VanDerWaalsContact O-CG 3.29Å; L192-L196 WeakPolarHBondContact O-CG 3.37Å; L192-L196 PolarHBondContact O-N 3.49Å
193	L	52.4	Low	51.5	Low	54 Å²	54	88.4 Å²	88.4	28%	0.283	44%	0.438	S	S	.	.	H	α-helix	trans	-62	-45.9	176.9	-73.9	164	0	0	0	112.2	T189 L190 K195 L196 S197 L206 L208	T189-L193 HydrophobicContact CG2-CD1 4.1Å; T189-L193 WeakPolarHBondContact O-CG 3.47Å; T189-L193 PolarHBondContact O-N 2.87Å; L190-L193 PolarHBondContact O-N 2.99Å; L193-K195 VanDerWaalsContact C-N 3.27Å; L193-K195 PolarHBondContact O-N 2.76Å; L193-L196 PolarHBondContact O-N 2.82Å; L193-L196 VanDerWaalsContact O-N 3.11Å; L193-S197 PolarHBondContact O-N 3.29Å; L193-L206 HydrophobicContact CD2-CD1 4.46Å; L193-L206 WeakPolarHBondContact O-CD1 3.5Å; L193-L208 HydrophobicContact CD1-CD1 3.43Å; L193-L208 VanDerWaalsContact CD1-CD1 3.43Å; L193-L208 HydrophobicContact CD1-CG 4.31Å
194	N	50.5	Low	51	Low	78 Å²	78	90.1 Å²	90.1	42%	0.417	46%	0.457	S	S	.	.	H	α-helix	trans	-67.6	-24.6	175.6	-75.2	-26.7	0	0	0	113.5	L190 F191 S197	L190-N194 WeakPolarHBondContact O-CB 3.49Å; L190-N194 PolarHBondContact O-N 3.31Å; L190-N194 PolarHBondContact O-ND2 2.91Å; F191-N194 PolarHBondContact O-N 2.99Å; N194-S197 PolarHBondContact O-OG 3.25Å
195	K	56.7	Low	50.7	Low	95 Å²	95	92 Å²	92	41%	0.413	47%	0.468	S	S	.	.	H	α-helix	trans	-74	-40.7	168.5	-98.6	-75.3	174	-169.5	0	111.3	F191 L192 L193 S198 Y199	F191-K195 HydrophobicContact CE1-CG 4.03Å; F191-K195 HydrophobicContact CZ-CG 4.05Å; F191-K195 WeakPolarHBondContact O-CB 3.48Å; F191-K195 PolarHBondContact O-N 2.93Å; L192-K195 WeakPolarHBondContact O-CB 3.34Å; L192-K195 PolarHBondContact O-N 3.48Å; L193-K195 VanDerWaalsContact C-N 3.27Å; L193-K195 PolarHBondContact O-N 2.76Å; K195-S198 PolarHBondContact O-N 2.89Å; K195-S198 PolarHBondContact O-OG 3.16Å; K195-Y199 HydrophobicContact CD-CE2 4Å; K195-Y199 VanDerWaalsContact O-CD2 3.23Å; K195-Y199 WeakPolarHBondContact O-CD2 3.45Å; K195-Y199 PolarHBondContact O-N 3.49Å
196	L	53.9	Low	49.9	Very low	41 Å²	41	89.4 Å²	89.4	22%	0.215	46%	0.455	C	S	.	.	H	α-helix	trans	-66.4	-37.3	178.4	-73.4	167.4	0	0	0	111.9	L192 L193 S198 Y199 L200	L192-L196 HydrophobicContact CD2-CD1 4.46Å; L192-L196 HydrophobicContact CG-CD1 4.11Å; L192-L196 WeakPolarHBondContact O-CB 3.43Å; L192-L196 VanDerWaalsContact O-CG 3.29Å; L192-L196 WeakPolarHBondContact O-CG 3.37Å; L192-L196 PolarHBondContact O-N 3.49Å; L193-L196 PolarHBondContact O-N 2.82Å; L193-L196 VanDerWaalsContact O-N 3.11Å; L196-S198 VanDerWaalsContact C-N 3.31Å; L196-S198 PolarHBondContact O-N 2.84Å; L196-Y199 PolarHBondContact O-N 3.25Å; L196-Y199 VanDerWaalsContact O-N 3.09Å; L196-L200 HydrophobicContact CB-CD1 4.21Å; L196-L200 VanDerWaalsContact O-CB 3.29Å; L196-L200 WeakPolarHBondContact O-CB 3.27Å; L196-L200 VanDerWaalsContact O-CG 3.24Å; L196-L200 WeakPolarHBondContact O-CG 3.47Å; L196-L200 PolarHBondContact O-N 2.73Å
197	S	54.9	Low	49.4	Very low	21 Å²	21	95.4 Å²	95.4	15%	0.147	47%	0.467	C	S	.	.	H	α-helix	trans	-58.3	-40.8	173.9	55.9	0	0	0	0	112.6	L193 N194 Y199 L200 R201 L202	L193-S197 PolarHBondContact O-N 3.29Å; N194-S197 PolarHBondContact O-OG 3.25Å; S197-Y199 VanDerWaalsContact C-N 3.34Å; S197-Y199 PolarHBondContact O-N 3.16Å; S197-L200 PolarHBondContact O-N 3.41Å; S197-R201 PolarHBondContact O-N 3.22Å; S197-L202 PolarHBondContact O-N 3.41Å
198	S	54.4	Low	49.1	Very low	77 Å²	77	98 Å²	98	54%	0.538	48%	0.477	S	S	.	.	H	α-helix	trans	-68.2	-30.7	175.9	70.9	0	0	0	0	113.4	K195 L196	K195-S198 PolarHBondContact O-N 2.89Å; K195-S198 PolarHBondContact O-OG 3.16Å; L196-S198 VanDerWaalsContact C-N 3.31Å; L196-S198 PolarHBondContact O-N 2.84Å
199	Y	52.7	Low	48.4	Very low	137 Å²	137	96.5 Å²	96.5	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-82.8	-27.3	177.6	-79.9	-66.1	0	0	0	113.3	K195 L196 S197	K195-Y199 HydrophobicContact CD-CE2 4Å; K195-Y199 VanDerWaalsContact O-CD2 3.23Å; K195-Y199 WeakPolarHBondContact O-CD2 3.45Å; K195-Y199 PolarHBondContact O-N 3.49Å; L196-Y199 PolarHBondContact O-N 3.25Å; L196-Y199 VanDerWaalsContact O-N 3.09Å; S197-Y199 VanDerWaalsContact C-N 3.34Å; S197-Y199 PolarHBondContact O-N 3.16Å
200	L	50.6	Low	47.8	Very low	99 Å²	99	97.6 Å²	97.6	52%	0.518	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	3.9	-178.8	-67	169.8	0	0	0	113.5	L196 S197 L202	L196-L200 HydrophobicContact CB-CD1 4.21Å; L196-L200 VanDerWaalsContact O-CB 3.29Å; L196-L200 WeakPolarHBondContact O-CB 3.27Å; L196-L200 VanDerWaalsContact O-CG 3.24Å; L196-L200 WeakPolarHBondContact O-CG 3.47Å; L196-L200 PolarHBondContact O-N 2.73Å; S197-L200 PolarHBondContact O-N 3.41Å; L200-L202 HydrophobicContact CB-CD1 3.93Å; L200-L202 HydrophobicContact CB-CG 3.91Å; L200-L202 HydrophobicContact CD1-CD1 3.99Å; L200-L202 PolarHBondContact O-N 3.02Å
201	R	52.5	Low	47	Very low	199 Å²	199	99.1 Å²	99.1	75%	0.751	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	28.7	-173.5	-75.5	-176.5	162.7	-173.6	-7.8	113.7	S197 Q203	S197-R201 PolarHBondContact O-N 3.22Å; R201-Q203 PolarHBondContact O-N 3.09Å
202	L	44.5	Very low	46.5	Very low	78 Å²	78	95.1 Å²	95.1	41%	0.408	48%	0.476	S	S	.	.			trans	-72.3	103.9	176.4	-72.2	167.8	0	0	0	109	S197 L200 A204 L206	S197-L202 PolarHBondContact O-N 3.41Å; L200-L202 HydrophobicContact CB-CD1 3.93Å; L200-L202 HydrophobicContact CB-CG 3.91Å; L200-L202 HydrophobicContact CD1-CD1 3.99Å; L200-L202 PolarHBondContact O-N 3.02Å; L202-A204 PolarHBondContact O-N 3.05Å; L202-L206 HydrophobicContact CD1-CD1 4.06Å; L202-L206 HydrophobicContact CD1-CD2 3.99Å; L202-L206 HydrophobicContact CD1-CG 4.06Å
203	Q	45.2	Very low	45.9	Very low	204 Å²	204	97.5 Å²	97.5	95%	0.953	49%	0.486	S	S	*	.			trans	-58.7	-24.8	168.8	-70.6	-179.3	-18.2	0	0	111.6	R201 K205	R201-Q203 PolarHBondContact O-N 3.09Å; Q203-K205 PolarHBondContact O-N 2.9Å
204	A	40	Very low	45.5	Very low	66 Å²	66	99.5 Å²	99.5	55%	0.545	50%	0.504	S	S	.	.	S	Bend	trans	-72.7	120.8	170.9	0	0	0	0	0	111.6	L202 L206	L202-A204 PolarHBondContact O-N 3.05Å; A204-L206 PolarHBondContact O-N 3.23Å; A204-L206 VanDerWaalsContact O-N 3.11Å
205	K	42.6	Very low	45.2	Very low	153 Å²	153	97.4 Å²	97.4	67%	0.665	49%	0.494	S	S	*	.			trans	-55.7	114.3	165.4	-165.8	173.3	-171.1	172.2	0	108.6	Q203 Y207	Q203-K205 PolarHBondContact O-N 2.9Å; K205-Y207 HydrophobicContact CB-CE2 4.22Å; K205-Y207 WeakPolarHBondContact O-CD2 3.44Å; K205-Y207 VanDerWaalsContact O-CE2 3.28Å; K205-Y207 WeakPolarHBondContact O-CE2 3.33Å; K205-Y207 PolarHBondContact O-N 3.23Å
206	L	38.2	Very low	44.9	Very low	55 Å²	55	101 Å²	101	29%	0.288	51%	0.506	S	S	.	.			trans	-65.9	104.5	-177	-85.1	176	0	0	0	110.7	L193 L202 A204	L193-L206 HydrophobicContact CD2-CD1 4.46Å; L193-L206 WeakPolarHBondContact O-CD1 3.5Å; L202-L206 HydrophobicContact CD1-CD1 4.06Å; L202-L206 HydrophobicContact CD1-CD2 3.99Å; L202-L206 HydrophobicContact CD1-CG 4.06Å; A204-L206 PolarHBondContact O-N 3.23Å; A204-L206 VanDerWaalsContact O-N 3.11Å
207	Y	38.4	Very low	44.6	Very low	180 Å²	180	99.7 Å²	99.7	71%	0.706	50%	0.503	S	S	*	.			trans	-80.2	135.1	169.3	-64.7	-85.1	0	0	0	109.6	K205 S209	K205-Y207 HydrophobicContact CB-CE2 4.22Å; K205-Y207 WeakPolarHBondContact O-CD2 3.44Å; K205-Y207 VanDerWaalsContact O-CE2 3.28Å; K205-Y207 WeakPolarHBondContact O-CE2 3.33Å; K205-Y207 PolarHBondContact O-N 3.23Å; Y207-S209 PolarHBondContact O-N 2.9Å
208	L	39.6	Very low	44.4	Very low	73 Å²	73	102.5 Å²	102.5	38%	0.382	52%	0.515	S	S	.	.			trans	-69.8	96.3	168.1	-135.9	118.2	0	0	0	107.3	L190 L193 L210 V215	L190-L208 HydrophobicContact CD1-CD1 4.25Å; L193-L208 HydrophobicContact CD1-CD1 3.43Å; L193-L208 VanDerWaalsContact CD1-CD1 3.43Å; L193-L208 HydrophobicContact CD1-CG 4.31Å; L208-L210 PolarHBondContact O-N 3.32Å; L208-L210 VanDerWaalsContact O-N 3.08Å; L208-V215 HydrophobicContact CD2-CG2 3.75Å
209	S	36.9	Very low	44.1	Very low	70 Å²	70	100.4 Å²	100.4	49%	0.49	50%	0.497	S	S	.	.			trans	-61.2	115.9	177.7	179.5	0	0	0	0	109.1	Y207 N211 S212	Y207-S209 PolarHBondContact O-N 2.9Å; S209-N211 PolarHBondContact O-N 3.37Å; S209-N211 VanDerWaalsContact O-N 3.1Å; S209-S212 VanDerWaalsContact O-CB 3.24Å; S209-S212 WeakPolarHBondContact O-CB 3.47Å; S209-S212 PolarHBondContact O-N 3.28Å
210	L	37.2	Very low	43.9	Very low	91 Å²	91	96.3 Å²	96.3	48%	0.476	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.8	-179.9	-62	165.7	0	0	0	112	L208 S212 W242 L246	L208-L210 PolarHBondContact O-N 3.32Å; L208-L210 VanDerWaalsContact O-N 3.08Å; L210-S212 VanDerWaalsContact C-N 3.33Å; L210-W242 VanDerWaalsContact O-CD1 3.24Å; L210-W242 PolarHBondContact O-NE1 3.48Å; L210-L246 HydrophobicContact CB-CD1 4.03Å; L210-L246 HydrophobicContact CD1-CD1 4.05Å; L210-L246 HydrophobicContact CD2-CD1 3.82Å; L210-L246 HydrophobicContact CD2-CD2 4.45Å; L210-L246 HydrophobicContact CG-CD1 4.16Å
211	N	37.3	Very low	43.4	Very low	109 Å²	109	92.3 Å²	92.3	58%	0.583	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-6.2	172.8	-67.1	-12	0	0	0	113.6	S209 Q213	S209-N211 PolarHBondContact O-N 3.37Å; S209-N211 VanDerWaalsContact O-N 3.1Å; N211-Q213 PolarHBondContact O-N 2.9Å
212	S	41.6	Very low	42.7	Very low	42 Å²	42	87.2 Å²	87.2	29%	0.294	46%	0.458	S	S	.	.			trans	-64.3	127.3	177.6	170.4	0	0	0	0	111.2	S209 L210 S214 V215	S209-S212 VanDerWaalsContact O-CB 3.24Å; S209-S212 WeakPolarHBondContact O-CB 3.47Å; S209-S212 PolarHBondContact O-N 3.28Å; L210-S212 VanDerWaalsContact C-N 3.33Å; S212-S214 PolarHBondContact O-N 2.66Å; S212-S214 WeakPolarHBondContact OG-CB 3.22Å; S212-S214 PolarHBondContact OG-N 2.79Å; S212-S214 PolarHBondContact OG-OG 3.41Å; S212-S214 VanDerWaalsContact OG-OG 3.14Å; S212-V215 PolarHBondContact O-N 3.31Å
213	Q	44.8	Very low	42.6	Very low	126 Å²	126	92.1 Å²	92.1	59%	0.589	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-12	175.8	-59.8	-164.7	49.6	0	0	113.1	N211	N211-Q213 PolarHBondContact O-N 2.9Å
214	S	42.2	Very low	42.3	Very low	96 Å²	96	87.5 Å²	87.5	67%	0.671	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.8	-179.5	-37.7	0	0	0	0	114.3	S212	S212-S214 PolarHBondContact O-N 2.66Å; S212-S214 WeakPolarHBondContact OG-CB 3.22Å; S212-S214 PolarHBondContact OG-N 2.79Å; S212-S214 PolarHBondContact OG-OG 3.41Å; S212-S214 VanDerWaalsContact OG-OG 3.14Å
215	V	46.1	Very low	42.1	Very low	34 Å²	34	88.8 Å²	88.8	21%	0.206	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-86.1	122.3	-175.3	-179.2	0	0	0	0	110.2	L208 S212 P232 W242	L208-V215 HydrophobicContact CD2-CG2 3.75Å; S212-V215 PolarHBondContact O-N 3.31Å; V215-P232 WeakPolarHBondContact O-CD 3.32Å; V215-W242 HydrophobicContact CB-CZ2 4.24Å; V215-W242 HydrophobicContact CG1-CZ2 4.3Å; V215-W242 WeakPolarHBondContact O-CH2 3.5Å; V215-W242 WeakPolarHBondContact O-CZ2 3.48Å
216	Y	50.3	Low	41.7	Very low	169 Å²	169	88.9 Å²	88.9	66%	0.663	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-81.9	123.3	170.8	-64.6	-89.7	0	0	0	110.3	T231	Y216-T231 HydrophobicContact CD1-CG2 3.95Å; Y216-T231 HydrophobicContact CE1-CG2 3.88Å
217	G	46.1	Very low	41.9	Very low	14 Å²	14	88.9 Å²	88.9	14%	0.144	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.4	176.5	0	0	0	0	0	109.2	A230 W242	G217-A230 WeakPolarHBondContact CA-O 3.37Å; G217-A230 PolarHBondContact N-O 2.79Å; G217-A230 PolarHBondContact O-N 3.34Å; G217-W242 VanDerWaalsContact N-CH2 3.34Å
218	M	50.2	Low	42.2	Very low	81 Å²	81	82.6 Å²	82.6	40%	0.399	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	99.1	179.7	-173.8	179	54.8	0	0	109.6	V182 I220 I227	V182-M218 HydrophobicContact CG1-SD 4.19Å; M218-I220 HydrophobicContact CE-CD1 3.71Å; M218-I220 HydrophobicContact CE-CG1 4.17Å; M218-I220 HydrophobicContact CG-CG1 4Å; M218-I220 PolarHBondContact O-N 3.42Å; M218-I220 HydrophobicContact SD-CD1 4.18Å; M218-I220 HydrophobicContact SD-CG1 4.23Å; M218-I227 HydrophobicContact CG-CG2 3.61Å; M218-I227 HydrophobicContact SD-CG2 4.11Å
219	L	48.5	Very low	42.7	Very low	33 Å²	33	85.4 Å²	85.4	17%	0.173	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	120.8	165.3	-78.6	158.8	0	0	0	108.2	I227 A228 A230 L245 L250 L253	L219-I227 CarbonylContact O-C 3.55Å; L219-I227 VanDerWaalsContact O-CA 3.32Å; L219-I227 WeakPolarHBondContact O-CA 3.32Å; L219-A228 HydrophobicContact CB-CB 3.99Å; L219-A228 WeakPolarHBondContact CB-O 3.5Å; L219-A228 HydrophobicContact CD1-CB 4.25Å; L219-A228 PolarHBondContact N-O 3.19Å; L219-A228 PolarHBondContact O-N 3.19Å; L219-A230 HydrophobicContact CD1-CB 4.17Å; L219-L245 HydrophobicContact CD1-CD2 3.96Å; L219-L245 HydrophobicContact CD2-CD2 3.48Å; L219-L245 VanDerWaalsContact CD2-CD2 3.48Å; L219-L245 HydrophobicContact CG-CD2 3.53Å; L219-L250 HydrophobicContact CD2-CD1 4.49Å; L219-L253 HydrophobicContact CD2-CD1 3.83Å
220	I	48.1	Very low	43.3	Very low	51 Å²	51	82.2 Å²	82.2	26%	0.262	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	105.1	170.3	-58	179.4	0	0	0	108.5	M218 S222 L250	M218-I220 HydrophobicContact CE-CD1 3.71Å; M218-I220 HydrophobicContact CE-CG1 4.17Å; M218-I220 HydrophobicContact CG-CG1 4Å; M218-I220 PolarHBondContact O-N 3.42Å; M218-I220 HydrophobicContact SD-CD1 4.18Å; M218-I220 HydrophobicContact SD-CG1 4.23Å; I220-S222 PolarHBondContact O-N 2.91Å; I220-L250 WeakPolarHBondContact O-CD1 3.46Å
221	D	40.1	Very low	44.3	Very low	15 Å²	15	80.2 Å²	80.2	8%	0.08	41%	0.407	C	S	.	.			trans	-71.9	108.8	168.1	-167.2	-30.8	0	0	0	110.3	K223 E224 M225 R226 L250 I254	D221-K223 WeakPolarHBondContact OD1-CA 3.45Å; D221-K223 WeakPolarHBondContact OD1-CB 3.32Å; D221-K223 PolarHBondContact OD1-N 3.07Å; D221-E224 HydrophobicContact CB-CB 4.25Å; D221-E224 PolarHBondContact OD1-N 3.1Å; D221-E224 WeakPolarHBondContact OD2-CB 3.12Å; D221-E224 WeakPolarHBondContact OD2-CG 3.43Å; D221-M225 WeakPolarHBondContact O-CA 3.49Å; D221-M225 PolarHBondContact O-N 2.9Å; D221-R226 HydrophobicContact CB-CB 4.09Å; D221-R226 PolarHBondContact N-O 3.31Å; D221-R226 PolarHBondContact O-N 3.12Å; D221-L250 HydrophobicContact CB-CD1 4.28Å; D221-L250 HydrophobicContact CB-CD2 4.06Å; D221-L250 WeakPolarHBondContact OD1-CD2 3.17Å; D221-I254 VanDerWaalsContact OD2-CD1 3.26Å; D221-I254 WeakPolarHBondContact OD2-CD1 3.44Å
222	S	39.4	Very low	45	Very low	91 Å²	91	75.6 Å²	75.6	64%	0.636	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-14.1	178.1	58.7	0	0	0	0	114.3	I220	I220-S222 PolarHBondContact O-N 2.91Å
223	K	42.1	Very low	45.5	Very low	182 Å²	182	76.7 Å²	76.7	79%	0.791	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-46.9	172	-79.3	-173.6	172.1	-176.2	0	111.3	D221	D221-K223 WeakPolarHBondContact OD1-CA 3.45Å; D221-K223 WeakPolarHBondContact OD1-CB 3.32Å; D221-K223 PolarHBondContact OD1-N 3.07Å
224	E	39.6	Very low	45.9	Very low	107 Å²	107	74.8 Å²	74.8	50%	0.5	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.6	-177.2	-60.9	-163.5	139.2	0	0	114.5	D221 R226	D221-E224 HydrophobicContact CB-CB 4.25Å; D221-E224 PolarHBondContact OD1-N 3.1Å; D221-E224 WeakPolarHBondContact OD2-CB 3.12Å; D221-E224 WeakPolarHBondContact OD2-CG 3.43Å; E224-R226 HydrophobicContact CB-CB 4.45Å; E224-R226 HydrophobicContact CB-CG 3.89Å; E224-R226 PolarHBondContact O-N 3.11Å; E224-R226 IonicContact OE1-CZ 3.57Å; E224-R226 IonicContact OE1-NH1 2.64Å; E224-R226 WeakPolarHBondContact OE2-CD 3.46Å; E224-R226 IonicContact OE2-CZ 3.34Å; E224-R226 IonicContact OE2-NE 2.99Å; E224-R226 PolarHBondContact OE2-NE 2.89Å; E224-R226 IonicContact OE2-NH1 3.9Å; E224-R226 PolarHBondContact OE2-NH1 3Å
225	M	35.9	Very low	46.6	Very low	92 Å²	92	70.2 Å²	70.2	45%	0.453	36%	0.356	S	S	.	.			trans	57.7	26.3	-173.4	-67.6	-76.5	-162.1	0	0	113.7	P172 I175 D221	P172-M225 HydrophobicContact CB-CE 3.45Å; P172-M225 VanDerWaalsContact CB-CE 3.45Å; I175-M225 HydrophobicContact CD1-SD 3.89Å; I175-M225 HydrophobicContact CG1-SD 4.1Å; D221-M225 WeakPolarHBondContact O-CA 3.49Å; D221-M225 PolarHBondContact O-N 2.9Å
226	R	33.9	Very low	47.2	Very low	156 Å²	156	75.7 Å²	75.7	59%	0.589	38%	0.377	S	S	*	.			trans	-95.8	129	-176.8	-67.4	-176.2	-177.6	162.4	-3.5	111.3	D221 E224	D221-R226 HydrophobicContact CB-CB 4.09Å; D221-R226 PolarHBondContact N-O 3.31Å; D221-R226 PolarHBondContact O-N 3.12Å; E224-R226 HydrophobicContact CB-CB 4.45Å; E224-R226 HydrophobicContact CB-CG 3.89Å; E224-R226 PolarHBondContact O-N 3.11Å; E224-R226 IonicContact OE1-CZ 3.57Å; E224-R226 IonicContact OE1-NH1 2.64Å; E224-R226 WeakPolarHBondContact OE2-CD 3.46Å; E224-R226 IonicContact OE2-CZ 3.34Å; E224-R226 IonicContact OE2-NE 2.99Å; E224-R226 PolarHBondContact OE2-NE 2.89Å; E224-R226 IonicContact OE2-NH1 3.9Å; E224-R226 PolarHBondContact OE2-NH1 3Å
227	I	42.6	Very low	47.3	Very low	55 Å²	55	70.9 Å²	70.9	28%	0.282	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	111.3	167.5	-55.9	177.9	0	0	0	107.6	I175 M218 L219	I175-I227 HydrophobicContact CG2-CD1 4.13Å; M218-I227 HydrophobicContact CG-CG2 3.61Å; M218-I227 HydrophobicContact SD-CG2 4.11Å; L219-I227 CarbonylContact O-C 3.55Å; L219-I227 VanDerWaalsContact O-CA 3.32Å; L219-I227 WeakPolarHBondContact O-CA 3.32Å
228	A	43.5	Very low	47.8	Very low	48 Å²	48	74.6 Å²	74.6	40%	0.397	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	131	173.8	0	0	0	0	0	110.1	L219 A230	L219-A228 HydrophobicContact CB-CB 3.99Å; L219-A228 WeakPolarHBondContact CB-O 3.5Å; L219-A228 HydrophobicContact CD1-CB 4.25Å; L219-A228 PolarHBondContact N-O 3.19Å; L219-A228 PolarHBondContact O-N 3.19Å; A228-A230 PolarHBondContact O-N 3.07Å
229	Y	49.8	Very low	47.6	Very low	131 Å²	131	74 Å²	74	51%	0.514	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	104.4	175.1	-64.3	-87.3	0	0	0	108.9
230	A	50.4	Low	47.8	Very low	4 Å²	4	77.5 Å²	77.5	3%	0.033	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.5	167.9	0	0	0	0	0	108.8	G217 L219 A228 W242 L245	G217-A230 WeakPolarHBondContact CA-O 3.37Å; G217-A230 PolarHBondContact N-O 2.79Å; G217-A230 PolarHBondContact O-N 3.34Å; L219-A230 HydrophobicContact CD1-CB 4.17Å; A228-A230 PolarHBondContact O-N 3.07Å; A230-W242 HydrophobicContact CB-CZ3 4.17Å; A230-W242 WeakPolarHBondContact O-CH2 3.5Å; A230-W242 WeakPolarHBondContact O-CZ3 3.29Å; A230-L245 HydrophobicContact CB-CD1 4.27Å; A230-L245 HydrophobicContact CB-CD2 4.33Å
231	T	58.5	Low	48	Very low	48 Å²	48	78 Å²	78	29%	0.294	42%	0.422	S	S	.	.			trans	-79.8	157.2	160	59.4	0	0	0	0	109.2	Y216 A233 L234 A235	Y216-T231 HydrophobicContact CD1-CG2 3.95Å; Y216-T231 HydrophobicContact CE1-CG2 3.88Å; T231-A233 PolarHBondContact O-N 3.47Å; T231-L234 PolarHBondContact O-N 3.06Å; T231-L234 WeakPolarHBondContact OG1-CB 3.36Å; T231-L234 PolarHBondContact OG1-N 3.06Å; T231-A235 PolarHBondContact O-N 3.37Å
232	P	52.2	Low	48.5	Very low	12 Å²	12	78.7 Å²	78.7	8%	0.078	42%	0.423	C	S	.	.	H	α-helix	trans	-56.3	-32.9	171.8	-28.7	38.1	0	0	0	112.5	V215 K236 W242	V215-P232 WeakPolarHBondContact O-CD 3.32Å; P232-K236 WeakPolarHBondContact O-CB 3.46Å; P232-K236 WeakPolarHBondContact O-CG 3.49Å; P232-K236 PolarHBondContact O-N 3.15Å; P232-W242 HydrophobicContact CB-CD2 4.15Å; P232-W242 HydrophobicContact CB-CE3 4.23Å; P232-W242 HydrophobicContact CB-CZ3 4.45Å; P232-W242 HydrophobicContact CG-CD2 3.99Å; P232-W242 HydrophobicContact CG-CE3 4.11Å; P232-W242 HydrophobicContact CG-CH2 3.69Å; P232-W242 HydrophobicContact CG-CZ2 3.64Å; P232-W242 HydrophobicContact CG-CZ3 3.96Å
233	A	51	Low	48.8	Very low	65 Å²	65	80.1 Å²	80.1	54%	0.537	42%	0.422	S	S	.	.	H	α-helix	trans	-67	-45.6	172.1	0	0	0	0	0	112.6	T231 K236 A237	T231-A233 PolarHBondContact O-N 3.47Å; A233-K236 PolarHBondContact O-N 2.82Å; A233-A237 WeakPolarHBondContact O-CB 3.3Å; A233-A237 PolarHBondContact O-N 3.31Å
234	L	53.1	Low	48.8	Very low	86 Å²	86	78.8 Å²	78.8	45%	0.45	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-46.4	176.7	-174.4	65.5	0	0	0	110.8	T231 K236 A237 I238	T231-L234 PolarHBondContact O-N 3.06Å; T231-L234 WeakPolarHBondContact OG1-CB 3.36Å; T231-L234 PolarHBondContact OG1-N 3.06Å; L234-K236 PolarHBondContact O-N 3.21Å; L234-A237 WeakPolarHBondContact O-CB 3.33Å; L234-A237 PolarHBondContact O-N 2.79Å; L234-I238 WeakPolarHBondContact O-CG1 3.37Å; L234-I238 PolarHBondContact O-N 2.9Å
235	A	58	Low	49.1	Very low	0 Å²	0	75 Å²	75	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-57.7	-45.7	177.3	0	0	0	0	0	112	T231 A237 I238 G239 W240 W242 L245	T231-A235 PolarHBondContact O-N 3.37Å; A235-A237 VanDerWaalsContact C-N 3.34Å; A235-A237 PolarHBondContact O-N 3.34Å; A235-I238 WeakPolarHBondContact O-CG1 3.49Å; A235-I238 PolarHBondContact O-N 2.81Å; A235-G239 PolarHBondContact O-N 2.76Å; A235-W240 CarbonylContact C-O 3.4Å; A235-W240 PolarHBondContact O-N 2.78Å; A235-W240 VanDerWaalsContact O-O 3.12Å; A235-W242 HydrophobicContact CB-CE3 3.75Å; A235-W242 HydrophobicContact CB-CZ3 4.32Å; A235-L245 HydrophobicContact CB-CD1 3.82Å
236	K	57.5	Low	49.2	Very low	149 Å²	149	75.2 Å²	75.2	65%	0.648	40%	0.402	S	S	*	.	H	α-helix	trans	-60.1	-41	172.1	-77.2	-180	176.3	-176.4	0	112.3	P232 A233 L234 I238 G239	P232-K236 WeakPolarHBondContact O-CB 3.46Å; P232-K236 WeakPolarHBondContact O-CG 3.49Å; P232-K236 PolarHBondContact O-N 3.15Å; A233-K236 PolarHBondContact O-N 2.82Å; L234-K236 PolarHBondContact O-N 3.21Å; K236-I238 PolarHBondContact O-N 3.25Å; K236-G239 PolarHBondContact O-N 2.96Å
237	A	52.5	Low	49.2	Very low	68 Å²	68	71.3 Å²	71.3	56%	0.562	41%	0.411	S	S	*	.	H	α-helix	trans	-67	-30.4	-179.4	0	0	0	0	0	114	A233 L234 A235 G239	A233-A237 WeakPolarHBondContact O-CB 3.3Å; A233-A237 PolarHBondContact O-N 3.31Å; L234-A237 WeakPolarHBondContact O-CB 3.33Å; L234-A237 PolarHBondContact O-N 2.79Å; A235-A237 VanDerWaalsContact C-N 3.34Å; A235-A237 PolarHBondContact O-N 3.34Å; A237-G239 VanDerWaalsContact C-N 3.31Å
238	I	56.6	Low	48.9	Very low	92 Å²	92	70.4 Å²	70.4	47%	0.472	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	11.2	169.8	56.7	177.1	0	0	0	113.6	L234 A235 K236 W240	L234-I238 WeakPolarHBondContact O-CG1 3.37Å; L234-I238 PolarHBondContact O-N 2.9Å; A235-I238 WeakPolarHBondContact O-CG1 3.49Å; A235-I238 PolarHBondContact O-N 2.81Å; K236-I238 PolarHBondContact O-N 3.25Å; I238-W240 VanDerWaalsContact C-N 3.27Å; I238-W240 HydrophobicContact CD1-CD2 3.59Å; I238-W240 HydrophobicContact CD1-CE3 3.64Å; I238-W240 HydrophobicContact CD1-CG 4Å; I238-W240 HydrophobicContact CD1-CH2 4.47Å; I238-W240 HydrophobicContact CD1-CZ2 4.42Å; I238-W240 HydrophobicContact CD1-CZ3 4.09Å; I238-W240 HydrophobicContact CG1-CB 4.18Å; I238-W240 HydrophobicContact CG1-CD2 4.05Å; I238-W240 HydrophobicContact CG1-CE3 4.5Å; I238-W240 HydrophobicContact CG1-CG 3.9Å; I238-W240 PolarHBondContact O-N 2.78Å
239	G	46.9	Very low	48.6	Very low	69 Å²	69	70.9 Å²	70.9	71%	0.711	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	19.1	177.9	0	0	0	0	0	114.6	A235 K236 A237	A235-G239 PolarHBondContact O-N 2.76Å; K236-G239 PolarHBondContact O-N 2.96Å; A237-G239 VanDerWaalsContact C-N 3.31Å
240	W	51.6	Low	47.9	Very low	107 Å²	107	65.9 Å²	65.9	41%	0.405	39%	0.393	S	S	.	.			trans	-97.4	130.1	-177.9	-70.7	11	0	0	0	110.7	A235 I238 W242	A235-W240 CarbonylContact C-O 3.4Å; A235-W240 PolarHBondContact O-N 2.78Å; A235-W240 VanDerWaalsContact O-O 3.12Å; I238-W240 VanDerWaalsContact C-N 3.27Å; I238-W240 HydrophobicContact CD1-CD2 3.59Å; I238-W240 HydrophobicContact CD1-CE3 3.64Å; I238-W240 HydrophobicContact CD1-CG 4Å; I238-W240 HydrophobicContact CD1-CH2 4.47Å; I238-W240 HydrophobicContact CD1-CZ2 4.42Å; I238-W240 HydrophobicContact CD1-CZ3 4.09Å; I238-W240 HydrophobicContact CG1-CB 4.18Å; I238-W240 HydrophobicContact CG1-CD2 4.05Å; I238-W240 HydrophobicContact CG1-CE3 4.5Å; I238-W240 HydrophobicContact CG1-CG 3.9Å; I238-W240 PolarHBondContact O-N 2.78Å; W240-W242 PolarHBondContact O-N 2.95Å
241	S	52.2	Low	47.7	Very low	61 Å²	61	72 Å²	72	43%	0.427	42%	0.421	S	S	.	.			trans	-71.1	122.9	174.3	81.1	0	0	0	0	110	I243 K244	S241-I243 PolarHBondContact O-N 3.1Å; S241-I243 VanDerWaalsContact O-N 3.15Å; S241-K244 PolarHBondContact O-N 2.85Å; S241-K244 WeakPolarHBondContact OG-CD 3.24Å; S241-K244 VanDerWaalsContact OG-CG 3.29Å; S241-K244 WeakPolarHBondContact OG-CG 3.41Å
242	W	50.8	Low	47	Very low	30 Å²	30	77.4 Å²	77.4	11%	0.114	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-52	-37.8	-178	178.3	-111.3	0	0	0	113.5	L210 V215 G217 A230 P232 A235 W240 K244 L245	L210-W242 VanDerWaalsContact O-CD1 3.24Å; L210-W242 PolarHBondContact O-NE1 3.48Å; V215-W242 HydrophobicContact CB-CZ2 4.24Å; V215-W242 HydrophobicContact CG1-CZ2 4.3Å; V215-W242 WeakPolarHBondContact O-CH2 3.5Å; V215-W242 WeakPolarHBondContact O-CZ2 3.48Å; G217-W242 VanDerWaalsContact N-CH2 3.34Å; A230-W242 HydrophobicContact CB-CZ3 4.17Å; A230-W242 WeakPolarHBondContact O-CH2 3.5Å; A230-W242 WeakPolarHBondContact O-CZ3 3.29Å; P232-W242 HydrophobicContact CB-CD2 4.15Å; P232-W242 HydrophobicContact CB-CE3 4.23Å; P232-W242 HydrophobicContact CB-CZ3 4.45Å; P232-W242 HydrophobicContact CG-CD2 3.99Å; P232-W242 HydrophobicContact CG-CE3 4.11Å; P232-W242 HydrophobicContact CG-CH2 3.69Å; P232-W242 HydrophobicContact CG-CZ2 3.64Å; P232-W242 HydrophobicContact CG-CZ3 3.96Å; A235-W242 HydrophobicContact CB-CE3 3.75Å; A235-W242 HydrophobicContact CB-CZ3 4.32Å; W240-W242 PolarHBondContact O-N 2.95Å; W242-K244 PolarHBondContact O-N 3.05Å; W242-L245 HydrophobicContact CE3-CD1 4.01Å; W242-L245 HydrophobicContact CZ3-CD1 4.35Å; W242-L245 WeakPolarHBondContact O-CB 3.36Å; W242-L245 PolarHBondContact O-N 2.9Å
243	I	46.9	Very low	46.5	Very low	120 Å²	120	78.9 Å²	78.9	62%	0.615	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-62.9	-27.9	179.3	-66.9	163.1	0	0	0	112.1	S241	S241-I243 PolarHBondContact O-N 3.1Å; S241-I243 VanDerWaalsContact O-N 3.15Å
244	K	42	Very low	46	Very low	155 Å²	155	79 Å²	79	67%	0.674	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-80.7	-8.3	178.5	-73.8	177.4	-177.7	177.8	0	114.3	S241 W242 L246 A248	S241-K244 PolarHBondContact O-N 2.85Å; S241-K244 WeakPolarHBondContact OG-CD 3.24Å; S241-K244 VanDerWaalsContact OG-CG 3.29Å; S241-K244 WeakPolarHBondContact OG-CG 3.41Å; W242-K244 PolarHBondContact O-N 3.05Å; K244-L246 VanDerWaalsContact C-N 3.34Å; K244-A248 VanDerWaalsContact O-CB 3.22Å; K244-A248 WeakPolarHBondContact O-CB 3.29Å
245	L	44.9	Very low	45.2	Very low	26 Å²	26	84 Å²	84	14%	0.136	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-77.5	-19.2	178.7	-101.2	142.1	0	0	0	113.5	L219 A230 A235 W242	L219-L245 HydrophobicContact CD1-CD2 3.96Å; L219-L245 HydrophobicContact CD2-CD2 3.48Å; L219-L245 VanDerWaalsContact CD2-CD2 3.48Å; L219-L245 HydrophobicContact CG-CD2 3.53Å; A230-L245 HydrophobicContact CB-CD1 4.27Å; A230-L245 HydrophobicContact CB-CD2 4.33Å; A235-L245 HydrophobicContact CB-CD1 3.82Å; W242-L245 HydrophobicContact CE3-CD1 4.01Å; W242-L245 HydrophobicContact CZ3-CD1 4.35Å; W242-L245 WeakPolarHBondContact O-CB 3.36Å; W242-L245 PolarHBondContact O-N 2.9Å
246	L	39.7	Very low	43.8	Very low	97 Å²	97	88 Å²	88	51%	0.508	48%	0.482	S	S	.	.	S	Bend	trans	-94.9	121.6	-177.2	-71.7	151.1	0	0	0	110.2	L210 K244 A248	L210-L246 HydrophobicContact CB-CD1 4.03Å; L210-L246 HydrophobicContact CD1-CD1 4.05Å; L210-L246 HydrophobicContact CD2-CD1 3.82Å; L210-L246 HydrophobicContact CD2-CD2 4.45Å; L210-L246 HydrophobicContact CG-CD1 4.16Å; K244-L246 VanDerWaalsContact C-N 3.34Å; L246-A248 VanDerWaalsContact C-N 3.27Å; L246-A248 PolarHBondContact O-N 2.62Å
247	G	33.5	Very low	42.5	Very low	75 Å²	75	87.6 Å²	87.6	77%	0.773	49%	0.492	S	S	*	.	S	Bend	trans	79.4	-5	179.5	0	0	0	0	0	115.8	P249	G247-P249 WeakPolarHBondContact O-CD 3.36Å
248	A	36.1	Very low	41.2	Very low	36 Å²	36	92 Å²	92	30%	0.298	50%	0.501	S	S	.	.			trans	-71.4	127	175	0	0	0	0	0	111.7	K244 L246 L250 L253	K244-A248 VanDerWaalsContact O-CB 3.22Å; K244-A248 WeakPolarHBondContact O-CB 3.29Å; L246-A248 VanDerWaalsContact C-N 3.27Å; L246-A248 PolarHBondContact O-N 2.62Å; A248-L250 PolarHBondContact O-N 2.75Å; A248-L253 HydrophobicContact CB-CD1 4.1Å; A248-L253 HydrophobicContact CB-CD2 4.08Å; A248-L253 HydrophobicContact CB-CG 4.1Å
249	P	35.8	Very low	39.8	Very low	58 Å²	58	93.6 Å²	93.6	38%	0.377	52%	0.515	S	S	.	.			trans	-62.2	130.8	170.8	-19.8	31.4	0	0	0	110.2	G247 H251 K252	G247-P249 WeakPolarHBondContact O-CD 3.36Å; P249-H251 WeakPolarHBondContact CB-CE1 3.23Å; P249-H251 PolarHBondContact O-N 3.15Å; P249-H251 VanDerWaalsContact O-N 3.13Å; P249-K252 HydrophobicContact CB-CG 4.46Å; P249-K252 HydrophobicContact CG-CD 4.4Å; P249-K252 WeakPolarHBondContact O-CA 3.29Å; P249-K252 WeakPolarHBondContact O-CB 3.46Å; P249-K252 PolarHBondContact O-N 2.99Å
250	L	37	Very low	38.9	Very low	26 Å²	26	95.5 Å²	95.5	14%	0.136	52%	0.518	C	S	.	.	H	α-helix	trans	-59.1	-30.1	-175.9	-176.6	106.3	0	0	0	113.6	L219 I220 D221 A248 K252 L253 I254	L219-L250 HydrophobicContact CD2-CD1 4.49Å; I220-L250 WeakPolarHBondContact O-CD1 3.46Å; D221-L250 HydrophobicContact CB-CD1 4.28Å; D221-L250 HydrophobicContact CB-CD2 4.06Å; D221-L250 WeakPolarHBondContact OD1-CD2 3.17Å; A248-L250 PolarHBondContact O-N 2.75Å; L250-K252 PolarHBondContact O-N 3.21Å; L250-K252 VanDerWaalsContact O-N 3.12Å; L250-L253 PolarHBondContact O-N 3.48Å; L250-I254 HydrophobicContact CD1-CD1 4.48Å; L250-I254 HydrophobicContact CD2-CD1 3.52Å; L250-I254 HydrophobicContact CD2-CG1 4.33Å; L250-I254 HydrophobicContact CG-CD1 3.9Å; L250-I254 HydrophobicContact CG-CG1 4.19Å; L250-I254 PolarHBondContact O-N 3.35Å
251	H	46	Very low	37.7	Very low	133 Å²	133	98.5 Å²	98.5	62%	0.616	54%	0.536	S	S	*	.	H	α-helix	trans	-65.9	-10.5	173.4	69	-104.5	0	0	0	114.2	P249	P249-H251 WeakPolarHBondContact CB-CE1 3.23Å; P249-H251 PolarHBondContact O-N 3.15Å; P249-H251 VanDerWaalsContact O-N 3.13Å
252	K	42.8	Very low	36.4	Very low	160 Å²	160	102.7 Å²	102.7	70%	0.696	55%	0.554	S	S	*	*	H	α-helix	trans	-96.5	-16.8	168.7	-60.1	-169.6	178.8	-176.5	0	112.9	P249 L250	P249-K252 HydrophobicContact CB-CG 4.46Å; P249-K252 HydrophobicContact CG-CD 4.4Å; P249-K252 WeakPolarHBondContact O-CA 3.29Å; P249-K252 WeakPolarHBondContact O-CB 3.46Å; P249-K252 PolarHBondContact O-N 2.99Å; L250-K252 PolarHBondContact O-N 3.21Å; L250-K252 VanDerWaalsContact O-N 3.12Å
253	L	41.1	Very low	35.3	Very low	43 Å²	43	106.1 Å²	106.1	23%	0.225	58%	0.582	C	S	.	*	H	α-helix	trans	-89	-37.9	176.5	-65.2	173.2	0	0	0	111.3	L219 A248 L250 K255	L219-L253 HydrophobicContact CD2-CD1 3.83Å; A248-L253 HydrophobicContact CB-CD1 4.1Å; A248-L253 HydrophobicContact CB-CD2 4.08Å; A248-L253 HydrophobicContact CB-CG 4.1Å; L250-L253 PolarHBondContact O-N 3.48Å; L253-K255 PolarHBondContact O-N 3.09Å
254	I	40.3	Very low	34.3	Very low	68 Å²	68	106.3 Å²	106.3	35%	0.349	59%	0.589	S	S	.	*	S	Bend	trans	-83.6	96.1	166.5	-57.4	175.6	0	0	0	106.7	D221 L250 P256	D221-I254 VanDerWaalsContact OD2-CD1 3.26Å; D221-I254 WeakPolarHBondContact OD2-CD1 3.44Å; L250-I254 HydrophobicContact CD1-CD1 4.48Å; L250-I254 HydrophobicContact CD2-CD1 3.52Å; L250-I254 HydrophobicContact CD2-CG1 4.33Å; L250-I254 HydrophobicContact CG-CD1 3.9Å; L250-I254 HydrophobicContact CG-CG1 4.19Å; L250-I254 PolarHBondContact O-N 3.35Å; I254-P256 WeakPolarHBondContact O-CD 3.23Å; I254-P256 VanDerWaalsContact O-N 3.16Å
255	K	36.5	Very low	33.6	Very low	190 Å²	190	107.3 Å²	107.3	83%	0.826	60%	0.596	S	S	*	*			trans	-54.4	118.9	151.6	-101.6	-171.3	175.2	-175.6	0	105.4	L253 T257	L253-K255 PolarHBondContact O-N 3.09Å; K255-T257 PolarHBondContact O-N 3.38Å; K255-T257 VanDerWaalsContact O-N 3.07Å
256	P	29.2	Very low	32.8	Very low	84 Å²	84	112.2 Å²	112.2	55%	0.545	63%	0.628	S	S	.	*			trans	-62	120.4	172.5	26.9	-31.8	0	0	0	106.6	I254 E258	I254-P256 WeakPolarHBondContact O-CD 3.23Å; I254-P256 VanDerWaalsContact O-N 3.16Å; P256-E258 HydrophobicContact CB-CG 4.27Å; P256-E258 PolarHBondContact O-N 3.15Å
257	T	29.4	Very low	32.3	Very low	141 Å²	141	115.8 Å²	115.8	87%	0.865	65%	0.645	S	S	*	*			trans	-69.1	66	154.4	24.3	0	0	0	0	107.7	K255 T259	K255-T257 PolarHBondContact O-N 3.38Å; K255-T257 VanDerWaalsContact O-N 3.07Å; T257-T259 PolarHBondContact O-N 3.4Å
258	E	27.2	Very low	32.1	Very low	160 Å²	160	117.4 Å²	117.4	75%	0.748	64%	0.641	S	S	*	*			trans	-58.5	124.9	153.6	-87.3	170.2	-157.2	0	0	106.4	P256 S260	P256-E258 HydrophobicContact CB-CG 4.27Å; P256-E258 PolarHBondContact O-N 3.15Å; E258-S260 VanDerWaalsContact C-N 3.31Å; E258-S260 PolarHBondContact O-N 2.91Å
259	T	26.5	Very low	31.8	Very low	127 Å²	127	124.2 Å²	124.2	78%	0.779	66%	0.663	S	S	*	*			trans	-61.5	88.2	-179	43.5	0	0	0	0	110	T257 E261	T257-T259 PolarHBondContact O-N 3.4Å; T259-E261 PolarHBondContact O-N 3.39Å
260	S	26.6	Very low	31.3	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	69%	0.688	S	S	*	*			trans	-75.1	81.4	158.5	70.5	0	0	0	0	108.1	E258 N262	E258-S260 VanDerWaalsContact C-N 3.31Å; E258-S260 PolarHBondContact O-N 2.91Å; S260-N262 PolarHBondContact O-N 3.31Å
261	E	27.2	Very low	30.8	Very low	170 Å²	170	132.8 Å²	132.8	79%	0.794	71%	0.712	S	S	*	*			trans	-57.4	93.3	154	-65.1	-178.4	153.6	0	0	107.3	T259	T259-E261 PolarHBondContact O-N 3.39Å
262	N	25.6	Very low	29.9	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	72%	0.719	S	S	*	*			trans	-180	142.4	149.4	-90.5	-37.5	0	0	0	112.6	S260	S260-N262 PolarHBondContact O-N 3.31Å
263	S	26.4	Very low	29.1	Very low	101 Å²	101	131.7 Å²	131.7	71%	0.706	72%	0.72	S	S	*	*			trans	59.9	86.6	163	49.3	0	0	0	0	119.9
264	T	25.8	Very low	28.4	Very low	124 Å²	124	135.1 Å²	135.1	76%	0.761	75%	0.747	S	S	*	*				61	123.5	123.6	49.3	0	0	0	0	122.5
265	E	27.2	Very low	27.8	Very low	176 Å²	176	139.5 Å²	139.5	82%	0.822	77%	0.766	S	S	*	*			trans	62.2	97.8	144.6	-58.4	-177.9	164.1	0	0	116.9
266	T	29.1	Very low	27.4	Very low	130 Å²	130	141.2 Å²	141.2	80%	0.798	77%	0.769	S	S	*	*				-162.7	107.1	66.2	22	0	0	0	0	112.5
267	I	29.1	Very low	27.3	Very low	171 Å²	171	142.4 Å²	142.4	88%	0.877	78%	0.779	S	S	*	*			trans	-110.5	113.9	155.9	-64.7	174.3	0	0	0	106.4
268	T	30	Very low	27.5	Very low	110 Å²	110	140.5 Å²	140.5	68%	0.675	77%	0.769	S	S	*	*			trans	-161	132.4	163.6	-3.9	0	0	0	0	113.1
269	K	30.2	Very low	27.5	Very low	179 Å²	179	138.6 Å²	138.6	78%	0.778	76%	0.764	S	S	*	*			trans	73.5	111.9	163.8	-56.8	166.5	-174.8	174.5	0	114.4
270	L	25.3	Very low	27.6	Very low	169 Å²	169	139.8 Å²	139.8	89%	0.885	76%	0.764	S	S	*	*				58.8	146.9	55.8	-70.3	87.1	0	0	0	114.7
271	S	26.6	Very low	27.6	Very low	94 Å²	94	139.8 Å²	139.8	66%	0.657	76%	0.764	S	S	*	*			trans	91.7	97	152.8	-157.2	0	0	0	0	117.1	K273	S271-K273 PolarHBondContact O-N 2.62Å
272	S	26	Very low	27.9	Very low	109 Å²	109	137.4 Å²	137.4	76%	0.762	76%	0.763	S	S	*	*				-9.1	111.8	125	50.6	0	0	0	0	115.6
273	K	26.4	Very low	27.9	Very low	162 Å²	162	135.2 Å²	135.2	70%	0.704	76%	0.76	S	S	*	*			trans	-174.4	116.8	150.9	-102.1	170.7	179.8	-176.5	0	104.1	S271	S271-K273 PolarHBondContact O-N 2.62Å
274	S	25.7	Very low	28.1	Very low	115 Å²	115	138.4 Å²	138.4	80%	0.804	76%	0.763	S	S	*	*			cis	54.4	57.3	34.5	91.5	0	0	0	0	113.1
275	Q	29.1	Very low	28.2	Very low	159 Å²	159	141 Å²	141	74%	0.743	76%	0.764	S	S	*	*			trans	-129.1	89.4	149.3	-74.8	-169.1	-53	0	0	109.1
276	Y	26.9	Very low	28.2	Very low	227 Å²	227	138.7 Å²	138.7	89%	0.89	76%	0.757	S	S	*	*			trans	-62.7	137.3	145.8	-98.3	-93.8	0	0	0	107.9
277	S	28	Very low	28.2	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	75%	0.752	S	S	*	*			trans	-146.1	85.4	163.4	-67.6	0	0	0	0	109.7
278	P	32.4	Very low	28.1	Very low	101 Å²	101	134.9 Å²	134.9	66%	0.656	74%	0.742	S	S	*	*			trans	-84.8	123.6	166.8	32.9	-28.8	0	0	0	109.6
279	L	26.7	Very low	28	Very low	120 Å²	120	136.2 Å²	136.2	63%	0.628	74%	0.742	S	S	*	*			trans	-176.1	140.4	174.5	-123.6	79.8	0	0	0	106.2
280	I	30	Very low	28	Very low	152 Å²	152	135.6 Å²	135.6	78%	0.779	74%	0.739	S	S	*	*			cis	-138.8	158.8	9.4	-66.8	169	0	0	0	109.1
281	S	26.4	Very low	28.1	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	74%	0.735	S	S	*	*			trans	-85.4	-155.5	-178	-41	0	0	0	0	113.7
282	P	33.4	Very low	28.5	Very low	119 Å²	119	134.7 Å²	134.7	77%	0.773	74%	0.739	S	S	*	*			trans	-111.9	-162.9	-136.8	32.6	-9.6	0	0	0	114.9
283	S	26.1	Very low	28.6	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	74%	0.741	S	S	*	*			trans	82.8	143.7	-173.2	84.7	0	0	0	0	114
284	H	30.6	Very low	28.7	Very low	167 Å²	167	133.6 Å²	133.6	77%	0.773	73%	0.734	S	S	*	*			cis	-128.9	165	5.9	-98.7	-93.8	0	0	0	112.3
285	F	26.2	Very low	28.8	Very low	180 Å²	180	136.2 Å²	136.2	79%	0.789	73%	0.734	S	S	*	*			trans	-23	145.8	154.1	-68.1	-101.9	0	0	0	114.7
286	N	27.7	Very low	28.6	Very low	127 Å²	127	132.8 Å²	132.8	68%	0.679	73%	0.727	S	S	*	*			cis	-167.1	149.8	45.8	-136.6	-12.8	0	0	0	113.3
287	T	28.8	Very low	28.7	Very low	112 Å²	112	131.2 Å²	131.2	69%	0.687	73%	0.725	S	S	*	*			trans	50.9	137	149.2	15.9	0	0	0	0	120.9
288	T	27.8	Very low	28.8	Very low	108 Å²	108	136.9 Å²	136.9	66%	0.663	73%	0.732	S	S	*	*			cis	-162.6	158.6	18.9	-29.8	0	0	0	0	111.3
289	M	28	Very low	28.9	Very low	138 Å²	138	137 Å²	137	68%	0.68	73%	0.733	S	S	*	*			trans	68.1	97.8	161.4	-59.6	-49.2	-163.7	0	0	117.7
290	K	29.9	Very low	29.1	Very low	166 Å²	166	139.2 Å²	139.2	72%	0.722	74%	0.743	S	S	*	*				84.7	90.8	87.4	-82.3	-175	-170.6	175.6	0	112.9
291	T	27.8	Very low	29.1	Very low	129 Å²	129	139.8 Å²	139.8	79%	0.791	74%	0.742	S	S	*	*				92.9	143.3	75.6	51.5	0	0	0	0	113.3
292	P	33.6	Very low	29.4	Very low	115 Å²	115	142.8 Å²	142.8	75%	0.747	74%	0.744	S	S	*	*			trans	-111.4	-147	-161	39.1	-22.3	0	0	0	111.8
293	I	29.3	Very low	29	Very low	156 Å²	156	144.7 Å²	144.7	80%	0.8	74%	0.743	S	S	*	*			trans	105.3	139.2	166	-61.8	163.3	0	0	0	115
294	T	28.3	Very low	29.2	Very low	92 Å²	92	144.7 Å²	144.7	56%	0.564	75%	0.749	S	S	*	*			cis	-168.7	165.8	-35.6	-47.2	0	0	0	0	107.1
295	H	26.8	Very low	29	Very low	170 Å²	170	141.4 Å²	141.4	79%	0.787	75%	0.745	S	S	*	*			trans	69.7	154.4	159.9	-56.3	-61.5	0	0	0	117.7
296	S	26.9	Very low	29	Very low	88 Å²	88	137.8 Å²	137.8	62%	0.615	74%	0.74	S	S	*	*			cis	-175	162.3	-20.4	50.8	0	0	0	0	111
297	F	27.9	Very low	28.9	Very low	193 Å²	193	139.4 Å²	139.4	85%	0.846	75%	0.746	S	S	*	*			trans	74	101.9	162.5	-67.5	-71.8	0	0	0	122.3
298	Y	30.8	Very low	28.9	Very low	228 Å²	228	140.3 Å²	140.3	89%	0.894	75%	0.746	S	S	*	*				45.5	155	122.6	-89	-105.8	0	0	0	124.7
299	P	34.6	Very low	28.8	Very low	104 Å²	104	141.5 Å²	141.5	68%	0.675	75%	0.748	S	S	*	*			trans	-120.4	177.3	-154.2	44.8	-33.4	0	0	0	116.2
300	I	31.1	Very low	28.7	Very low	165 Å²	165	141 Å²	141	85%	0.846	75%	0.753	S	S	*	*			trans	-136.6	149.1	165.5	-65	-175.7	0	0	0	111.5
301	H	29.4	Very low	28.7	Very low	164 Å²	164	137.4 Å²	137.4	76%	0.759	75%	0.749	S	S	*	*			trans	-77.1	159.9	-179.6	-78.5	-131.3	0	0	0	115.2
302	H	31.4	Very low	29	Very low	173 Å²	173	137.4 Å²	137.4	80%	0.801	74%	0.744	S	S	*	*				-167.7	121.9	124	-99.2	-71.5	0	0	0	107.4
303	E	27	Very low	29	Very low	160 Å²	160	138.5 Å²	138.5	75%	0.748	74%	0.744	S	S	*	*				79.1	131.5	60.6	-100.1	-168.1	173.9	0	0	116.7
304	A	29.1	Very low	29.3	Very low	103 Å²	103	135.6 Å²	135.6	85%	0.851	74%	0.737	S	S	*	*			trans	66.9	152.7	166.8	0	0	0	0	0	116.4
305	S	27.7	Very low	29.8	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	74%	0.744	S	S	*	*			cis	-158.9	157.3	1.2	82.5	0	0	0	0	112
306	C	24.3	Very low	30.3	Very low	103 Å²	103	135.2 Å²	135.2	70%	0.696	74%	0.737	S	S	*	*			trans	55.1	115.9	138.7	-59.3	0	0	0	0	123.2
307	M	27.4	Very low	30.6	Very low	162 Å²	162	138.6 Å²	138.6	80%	0.798	74%	0.743	S	S	*	*				84.1	142.8	123.9	-72.3	-167.1	173.5	0	0	122.9
308	N	27	Very low	30.8	Very low	130 Å²	130	133.5 Å²	133.5	70%	0.695	73%	0.73	S	S	*	*			trans	69.3	140.8	153	-63.1	-14.2	0	0	0	117.5
309	L	25.7	Very low	31	Very low	133 Å²	133	129.2 Å²	129.2	70%	0.696	72%	0.722	S	S	*	*			cis	165.5	150	-13.9	-114.4	168.9	0	0	0	102.7
310	T	27.4	Very low	30.8	Very low	128 Å²	128	130.4 Å²	130.4	79%	0.785	72%	0.722	S	S	*	*			trans	63.9	145.5	160.5	45	0	0	0	0	118.6
311	S	30.2	Very low	30.8	Very low	90 Å²	90	127.3 Å²	127.3	63%	0.629	71%	0.711	S	S	*	*			cis	-167.2	170.5	-2.4	49.8	0	0	0	0	113.5
312	N	32.3	Very low	30.9	Very low	130 Å²	130	125.3 Å²	125.3	70%	0.695	71%	0.711	S	S	*	*			trans	86.8	119.1	141.6	-72.1	-8.9	0	0	0	122.9
313	N	35.1	Very low	30.9	Very low	138 Å²	138	122.6 Å²	122.6	74%	0.738	71%	0.707	S	S	*	*			trans	79.7	139.1	131.3	-67.5	-4.1	0	0	0	119.1
314	S	35.9	Very low	31.2	Very low	95 Å²	95	120.5 Å²	120.5	66%	0.664	71%	0.705	S	S	*	*			cis	-163.1	142.6	5.9	41	0	0	0	0	114.8
315	N	37.3	Very low	31.4	Very low	134 Å²	134	121.1 Å²	121.1	72%	0.717	70%	0.698	S	S	*	*			trans	86.9	124.5	130.6	-71.5	16.4	0	0	0	123.8
316	N	37.1	Very low	31.4	Very low	120 Å²	120	122.2 Å²	122.2	64%	0.642	70%	0.701	S	S	*	*			trans	80.3	139	141.7	-64.9	31.1	0	0	0	119.1
317	E	34.2	Very low	31.7	Very low	159 Å²	159	123.7 Å²	123.7	74%	0.743	71%	0.707	S	S	*	*			cis	176.7	160.8	-9.1	-107.4	179.7	150.2	0	0	103.1
318	C	31.6	Very low	31.6	Very low	85 Å²	85	122.2 Å²	122.2	57%	0.574	71%	0.707	S	S	*	*			cis	-164.9	151.4	5.2	-129.2	0	0	0	0	109.5
319	I	34.8	Very low	31.5	Very low	138 Å²	138	121.8 Å²	121.8	71%	0.708	71%	0.709	S	S	*	*			trans	63	137.9	136.2	-69.6	171.5	0	0	0	119
320	N	31.1	Very low	31.5	Very low	129 Å²	129	120.3 Å²	120.3	69%	0.69	71%	0.706	S	S	*	*			cis	-174.9	171.7	-9.7	-101.1	-5	0	0	0	106
321	T	30.3	Very low	31.4	Very low	100 Å²	100	120.6 Å²	120.6	61%	0.613	70%	0.703	S	S	*	*			cis	-164.3	159.4	-7.7	17	0	0	0	0	107.7
322	T	32	Very low	31.3	Very low	122 Å²	122	123.1 Å²	123.1	75%	0.748	71%	0.709	S	S	*	*			trans	59.1	137.3	151.9	52.9	0	0	0	0	118.3
323	T	31.4	Very low	31	Very low	117 Å²	117	124.8 Å²	124.8	72%	0.718	71%	0.713	S	S	*	*			cis	-168.6	154.7	5.3	13.2	0	0	0	0	104.6
324	T	32.5	Very low	30.5	Very low	115 Å²	115	127.4 Å²	127.4	71%	0.706	72%	0.718	S	S	*	*			cis	-162.8	165.6	24.8	-12.8	0	0	0	0	109
325	T	33.7	Very low	30	Very low	116 Å²	116	129.2 Å²	129.2	71%	0.712	72%	0.719	S	S	*	*			trans	54.4	91.2	160.5	51.8	0	0	0	0	117.8
326	T	27.2	Very low	29.4	Very low	123 Å²	123	129 Å²	129	76%	0.755	72%	0.717	S	S	*	*				94.2	149.1	67.6	53.1	0	0	0	0	115.1
327	T	30.7	Very low	28.9	Very low	134 Å²	134	128.1 Å²	128.1	82%	0.822	72%	0.718	S	S	*	*			trans	72.1	78.1	173.3	53.8	0	0	0	0	118.2
328	T	25.3	Very low	28.5	Very low	131 Å²	131	126.4 Å²	126.4	80%	0.804	71%	0.71	S	S	*	*			trans	-50.6	145.6	133.9	48	0	0	0	0	113.2
329	T	25.4	Very low	28.3	Very low	120 Å²	120	132 Å²	132	74%	0.736	73%	0.725	S	S	*	*			trans	168.8	123.5	142.1	26.2	0	0	0	0	106.1
330	T	27.1	Very low	27.9	Very low	103 Å²	103	130.8 Å²	130.8	63%	0.632	72%	0.719	S	S	*	*				47.8	142.3	91.9	73.5	0	0	0	0	114.6
331	D	23.9	Very low	27.6	Very low	134 Å²	134	129 Å²	129	72%	0.717	71%	0.712	S	S	*	*			trans	71.4	131.7	162.8	-39.9	-49.7	0	0	0	117
332	N	29.1	Very low	27.4	Very low	143 Å²	143	132.2 Å²	132.2	77%	0.765	73%	0.725	S	S	*	*			trans	-169.2	72	144.6	-97	-55.9	0	0	0	107.6	F334	N332-F334 PolarHBondContact O-N 3.09Å; N332-F334 VanDerWaalsContact O-N 3.17Å
333	E	24.7	Very low	27.1	Very low	165 Å²	165	134.1 Å²	134.1	77%	0.771	73%	0.73	S	S	*	*			trans	-50.3	116.2	149.4	-66.1	-179.4	118.3	0	0	107.8	I335	E333-I335 HydrophobicContact CB-CG1 4.41Å; E333-I335 PolarHBondContact O-N 2.83Å
334	F	25	Very low	26.9	Very low	192 Å²	192	137.3 Å²	137.3	84%	0.842	73%	0.734	S	S	*	*			trans	-78	82.2	168.4	-98.7	-83.7	0	0	0	109.3	N332	N332-F334 PolarHBondContact O-N 3.09Å; N332-F334 VanDerWaalsContact O-N 3.17Å
335	I	24.9	Very low	26.5	Very low	134 Å²	134	137 Å²	137	69%	0.687	74%	0.737	S	S	*	*			trans	-51.3	135.7	165	-65.2	170.3	0	0	0	108.8	E333	E333-I335 HydrophobicContact CB-CG1 4.41Å; E333-I335 PolarHBondContact O-N 2.83Å
336	L	25.7	Very low	26.4	Very low	128 Å²	128	139.1 Å²	139.1	67%	0.67	74%	0.743	S	S	*	*			trans	-61.3	142.5	179	-84	78.6	0	0	0	111.5	E338	L336-E338 PolarHBondContact O-N 2.96Å
337	P	26.8	Very low	26.4	Very low	103 Å²	103	138 Å²	138	67%	0.669	74%	0.738	S	S	*	*			trans	-69	114.8	144.5	-7.3	24.8	0	0	0	108.5	F339	P337-F339 HydrophobicContact CB-CE2 4.36Å; P337-F339 PolarHBondContact O-N 3.23Å; P337-F339 VanDerWaalsContact O-N 3.16Å
338	E	25.6	Very low	26.2	Very low	123 Å²	123	138.1 Å²	138.1	58%	0.575	73%	0.734	S	S	*	*			trans	-58.2	111.8	166.4	-82.2	178.5	154	0	0	110	L336 I340 R400	L336-E338 PolarHBondContact O-N 2.96Å; E338-I340 HydrophobicContact CB-CD1 4.08Å; E338-I340 HydrophobicContact CB-CG1 4.12Å; E338-I340 HydrophobicContact CG-CD1 4.39Å; E338-I340 PolarHBondContact O-N 3.01Å; E338-R400 IonicContact OE1-NH2 3.54Å
339	F	26.9	Very low	26.7	Very low	201 Å²	201	138.8 Å²	138.8	88%	0.882	73%	0.732	S	S	*	*			trans	-97.2	80.1	161.2	-87.5	-79.5	0	0	0	109.4	P337	P337-F339 HydrophobicContact CB-CE2 4.36Å; P337-F339 PolarHBondContact O-N 3.23Å; P337-F339 VanDerWaalsContact O-N 3.16Å
340	I	26.8	Very low	26.7	Very low	113 Å²	113	140.3 Å²	140.3	58%	0.579	73%	0.731	S	S	*	*			trans	-69	128.8	177.5	-75.6	162.4	0	0	0	111	E338 L342	E338-I340 HydrophobicContact CB-CD1 4.08Å; E338-I340 HydrophobicContact CB-CG1 4.12Å; E338-I340 HydrophobicContact CG-CD1 4.39Å; E338-I340 PolarHBondContact O-N 3.01Å; I340-L342 PolarHBondContact O-N 3.18Å
341	T	25.2	Very low	26.9	Very low	91 Å²	91	143.1 Å²	143.1	56%	0.558	74%	0.737	S	S	*	*			trans	-3.6	111.7	145.1	-9.4	0	0	0	0	116.9
342	L	25.5	Very low	27	Very low	169 Å²	169	143.3 Å²	143.3	89%	0.885	74%	0.737	S	S	*	*			trans	-122.3	68	161.2	-87	172.5	0	0	0	111.6	I340	I340-L342 PolarHBondContact O-N 3.18Å
343	L	24.7	Very low	26.9	Very low	161 Å²	161	144.2 Å²	144.2	84%	0.843	74%	0.741	S	S	*	*			trans	-127.7	87.4	149.8	-85	172.7	0	0	0	106.8
344	K	27.3	Very low	26.9	Very low	185 Å²	185	140.6 Å²	140.6	80%	0.804	73%	0.733	S	S	*	*			trans	-143.2	124.6	163.5	-127.4	179.1	-177.5	-173.6	0	109.5
345	S	25.6	Very low	26.9	Very low	109 Å²	109	137.6 Å²	137.6	76%	0.762	73%	0.731	S	S	*	*			trans	-56.8	147.2	171.7	46.5	0	0	0	0	112
346	N	30.3	Very low	26.9	Very low	160 Å²	160	136.9 Å²	136.9	86%	0.856	74%	0.737	S	S	*	*			trans	-140	130.3	151.4	-136.2	34.8	0	0	0	107.7
347	P	28.8	Very low	26.9	Very low	98 Å²	98	139.7 Å²	139.7	64%	0.636	74%	0.744	S	S	*	*			trans	-84.7	169.2	174.3	36.8	-35.1	0	0	0	111.1
348	N	26	Very low	26.9	Very low	137 Å²	137	141.8 Å²	141.8	73%	0.733	75%	0.75	S	S	*	*			trans	63.8	128.3	174	-60.8	20.9	0	0	0	113.6
349	D	34.3	Very low	27	Very low	146 Å²	146	141.2 Å²	141.2	78%	0.781	76%	0.759	S	S	*	*			cis	-157	167.8	39.6	-92.8	-44.6	0	0	0	112.8
350	Q	26.9	Very low	26.9	Very low	151 Å²	151	140.2 Å²	140.2	71%	0.706	76%	0.755	S	S	*	*			trans	-72	141.9	-178.7	-59.1	159.3	-7	0	0	112.7
351	H	31.2	Very low	26.8	Very low	163 Å²	163	141 Å²	141	76%	0.755	76%	0.76	S	S	*	*				174.6	136.2	109.1	-103.3	-84.8	0	0	0	114.2
352	L	25.9	Very low	26.9	Very low	138 Å²	138	142.5 Å²	142.5	72%	0.723	76%	0.764	S	S	*	*			trans	-42.2	149.3	159.4	-67.6	101.6	0	0	0	112.5
353	L	27.5	Very low	26.9	Very low	162 Å²	162	141.8 Å²	141.8	85%	0.848	76%	0.756	S	S	*	*				-161	148	72.9	-154.4	67.5	0	0	0	116.2
354	C	24.9	Very low	27	Very low	89 Å²	89	139.9 Å²	139.9	60%	0.601	75%	0.751	S	S	*	*			trans	-47.9	144.5	177.7	-67.3	0	0	0	0	119.3
355	T	24.4	Very low	27.2	Very low	129 Å²	129	136.9 Å²	136.9	79%	0.791	75%	0.748	S	S	*	*				73.6	148	127.2	60.4	0	0	0	0	123.1
356	S	25.3	Very low	27.3	Very low	118 Å²	118	138.3 Å²	138.3	83%	0.825	75%	0.747	S	S	*	*			trans	106.9	136	141.3	81.6	0	0	0	0	116.8
357	K	25.7	Very low	27.1	Very low	187 Å²	187	137.3 Å²	137.3	81%	0.813	74%	0.741	S	S	*	*			trans	-84	138.2	176.8	-56.5	160.5	178.3	169.8	0	107.7
358	N	25.8	Very low	27.1	Very low	148 Å²	148	138.2 Å²	138.2	79%	0.791	75%	0.75	S	S	*	*				159.5	169.3	122.5	-80.3	-23.4	0	0	0	113
359	S	27.4	Very low	27.4	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	75%	0.748	S	S	*	*			trans	58.4	91.2	156.4	43.8	0	0	0	0	119.2
360	K	24.5	Very low	27.1	Very low	180 Å²	180	136.5 Å²	136.5	78%	0.783	75%	0.748	S	S	*	*				-11.2	142.3	124.2	-117.3	-171.4	169.5	-170.7	0	116.6
361	L	26	Very low	27.2	Very low	130 Å²	130	136.8 Å²	136.8	68%	0.681	75%	0.751	S	S	*	*			trans	67.7	148.1	153.8	-55.9	164.9	0	0	0	114.9
362	D	26.5	Very low	27.1	Very low	121 Å²	121	132.4 Å²	132.4	65%	0.647	74%	0.739	S	S	*	*			cis	-156.6	170.2	-2.2	-125.2	-22.9	0	0	0	111.7
363	E	26	Very low	27.3	Very low	155 Å²	155	131.6 Å²	131.6	72%	0.724	74%	0.735	S	S	*	*			trans	41.1	125.4	145.3	-71.9	-171.1	153.8	0	0	123.8
364	T	27	Very low	27.3	Very low	121 Å²	121	129.1 Å²	129.1	74%	0.742	72%	0.723	S	S	*	*				87	156.7	129.6	65.6	0	0	0	0	122.1
365	V	31.1	Very low	27.5	Very low	121 Å²	121	130.8 Å²	130.8	73%	0.733	73%	0.726	S	S	*	*			trans	74.7	90.1	168.8	-162.7	0	0	0	0	115
366	L	27	Very low	27.8	Very low	140 Å²	140	132.2 Å²	132.2	73%	0.733	73%	0.729	S	S	*	*				74.8	124.2	70.7	-73.5	167.1	0	0	0	116.4
367	N	27.2	Very low	27.8	Very low	138 Å²	138	130.9 Å²	130.9	74%	0.738	72%	0.719	S	S	*	*			trans	91.5	150.1	136.1	-70.5	-15.1	0	0	0	122.6
368	S	29.2	Very low	27.7	Very low	118 Å²	118	127.5 Å²	127.5	83%	0.825	71%	0.714	S	S	*	*			trans	70.3	134.4	177	71.8	0	0	0	0	115.1
369	S	31.8	Very low	27.6	Very low	100 Å²	100	126 Å²	126	70%	0.699	71%	0.711	S	S	*	*			cis	-144.7	126	7	171.1	0	0	0	0	107.7
370	L	28.2	Very low	27.8	Very low	146 Å²	146	130.4 Å²	130.4	76%	0.764	72%	0.716	S	S	*	*				42.4	133	101.7	-81.7	75.4	0	0	0	112.8
371	M	29.4	Very low	27.8	Very low	157 Å²	157	125.6 Å²	125.6	77%	0.773	71%	0.705	S	S	*	*			cis	167.8	165.4	22.7	-96.4	-100.9	106.7	0	0	103.7
372	S	27.3	Very low	27.9	Very low	71 Å²	71	126.8 Å²	126.8	50%	0.497	71%	0.712	S	S	.	*			cis	-167.1	177.6	-20.6	-151.5	0	0	0	0	108.5
373	D	30.3	Very low	28.1	Very low	122 Å²	122	127 Å²	127	65%	0.652	72%	0.718	S	S	*	*			trans	79.2	101.2	139.8	-68.2	1.3	0	0	0	122.4
374	N	29.1	Very low	28.2	Very low	110 Å²	110	124.2 Å²	124.2	59%	0.588	72%	0.715	S	S	*	*				82.5	109.4	105.5	-65.8	-26.8	0	0	0	122
375	N	28.7	Very low	28.3	Very low	124 Å²	124	125 Å²	125	66%	0.663	72%	0.715	S	S	*	*				80.8	151.6	116.2	-61.4	-21.2	0	0	0	121.2
376	N	30.2	Very low	28.4	Very low	159 Å²	159	125.3 Å²	125.3	85%	0.85	71%	0.711	S	S	*	*			trans	75.6	150.7	165.3	-53.3	-29.2	0	0	0	115.9
377	S	24.4	Very low	28.5	Very low	89 Å²	89	125.2 Å²	125.2	62%	0.622	71%	0.712	S	S	*	*			cis	-177.8	151	-22.1	174.5	0	0	0	0	107.4
378	T	24.9	Very low	28.7	Very low	116 Å²	116	129.8 Å²	129.8	71%	0.712	72%	0.718	S	S	*	*			trans	52.6	114.5	151.4	45.9	0	0	0	0	121.3
379	T	24.4	Very low	28.7	Very low	117 Å²	117	131.8 Å²	131.8	72%	0.718	72%	0.72	S	S	*	*				48.6	113.9	113.5	-40.2	0	0	0	0	120.2
380	F	29.8	Very low	28.6	Very low	203 Å²	203	131 Å²	131	89%	0.89	73%	0.728	S	S	*	*			trans	-176	99.8	140.4	-96.1	-74.1	0	0	0	106.3
381	S	25.6	Very low	28.6	Very low	80 Å²	80	133.7 Å²	133.7	56%	0.559	73%	0.734	S	S	*	*				72.4	119.9	65.4	75.8	0	0	0	0	116.3
382	N	27.3	Very low	28.6	Very low	154 Å²	154	133.3 Å²	133.3	82%	0.824	73%	0.733	S	S	*	*			trans	64.4	155.9	168.8	-50.8	-21.4	0	0	0	115
383	V	31	Very low	28.5	Very low	126 Å²	126	132.6 Å²	132.6	76%	0.764	74%	0.737	S	S	*	*			cis	-152.8	134.3	32.9	166.6	0	0	0	0	109.6
384	S	28.7	Very low	28.5	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	75%	0.746	S	S	*	*			trans	23.1	151.8	144.6	86.8	0	0	0	0	121.9
385	D	29.1	Very low	28.5	Very low	139 Å²	139	136 Å²	136	74%	0.743	75%	0.753	S	S	*	*			cis	-175.3	172.8	15.9	-135.1	-24.8	0	0	0	113.5
386	I	32.1	Very low	28.4	Very low	126 Å²	126	135.8 Å²	135.8	65%	0.646	76%	0.757	S	S	*	*			trans	73	98	150.8	-62.6	156.8	0	0	0	120.6
387	N	29.2	Very low	28.4	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	76%	0.755	S	S	*	*				44.9	118.7	127	-54.8	-35.2	0	0	0	122.6
388	R	31.1	Very low	28.5	Very low	233 Å²	233	138.1 Å²	138.1	88%	0.879	76%	0.757	S	S	*	*				-173.8	122.3	91.1	-104.4	178.1	172.4	163.9	-2.7	114.8
389	N	30.3	Very low	28.5	Very low	160 Å²	160	139.8 Å²	139.8	86%	0.856	76%	0.757	S	S	*	*			trans	29.1	126.3	143.9	-56.6	2.2	0	0	0	121.7
390	G	30.2	Very low	28.7	Very low	84 Å²	84	144.1 Å²	144.1	87%	0.866	76%	0.76	S	S	*	*			trans	169.7	61.5	164.5	0	0	0	0	0	114.1
391	F	28.5	Very low	28.5	Very low	203 Å²	203	141.1 Å²	141.1	89%	0.89	75%	0.752	S	S	*	*			trans	-95	151	-165.4	-134.6	-67	0	0	0	113.5
392	I	27.8	Very low	28.8	Very low	149 Å²	149	144.9 Å²	144.9	76%	0.764	76%	0.764	S	S	*	*			trans	91.5	128.4	158.7	-51.6	165.6	0	0	0	115.1
393	G	27	Very low	28.8	Very low	55 Å²	55	143.2 Å²	143.2	57%	0.567	76%	0.755	S	S	*	*			cis	114.4	101.4	-2.4	0	0	0	0	0	114.9
394	N	30	Very low	28.6	Very low	157 Å²	157	141.9 Å²	141.9	84%	0.84	75%	0.751	S	S	*	*			trans	-161.8	114.7	162.6	-90.9	-35.1	0	0	0	106.9
395	I	27.6	Very low	28.5	Very low	147 Å²	147	143.5 Å²	143.5	75%	0.754	75%	0.752	S	S	*	*			cis	75.1	123.7	44.9	-54.3	-177.2	0	0	0	113.6
396	T	27	Very low	28.5	Very low	120 Å²	120	144.7 Å²	144.7	74%	0.736	75%	0.753	S	S	*	*			trans	-91.9	161.7	-173.5	48.6	0	0	0	0	113.5
397	K	31.5	Very low	28.2	Very low	188 Å²	188	143.8 Å²	143.8	82%	0.817	76%	0.758	S	S	*	*			trans	-177.1	137.6	147.9	-93.2	140.3	-170.9	178.1	0	108.1
398	T	25.2	Very low	28.1	Very low	108 Å²	108	143.8 Å²	143.8	66%	0.663	76%	0.756	S	S	*	*			cis	73.9	115.4	33.3	69.2	0	0	0	0	116.7
399	H	25	Very low	27.9	Very low	152 Å²	152	139 Å²	139	70%	0.704	75%	0.748	S	S	*	*			trans	-16.2	146	169	-63.9	-86.8	0	0	0	119.8
400	R	28.7	Very low	27.7	Very low	208 Å²	208	138.8 Å²	138.8	79%	0.785	74%	0.742	S	S	*	*				-156.4	145.6	126.1	-117.9	172.2	-171.2	169.1	4.2	114.2	E338	E338-R400 IonicContact OE1-NH2 3.54Å
401	I	25.1	Very low	27.6	Very low	140 Å²	140	142.9 Å²	142.9	72%	0.718	74%	0.736	S	S	*	*			trans	-108.2	149.2	167.3	-64.2	164.1	0	0	0	106.4
402	I	32.1	Very low	27.5	Very low	158 Å²	158	140.8 Å²	140.8	81%	0.81	73%	0.731	S	S	*	*			trans	-161.4	159	153.2	-100.2	143.3	0	0	0	110.3
403	N	26.9	Very low	27.5	Very low	119 Å²	119	139.6 Å²	139.6	64%	0.636	73%	0.726	S	S	*	*			trans	-104.7	162.6	-157.8	-61.6	-49.7	0	0	0	116.3
404	S	27.2	Very low	27.7	Very low	98 Å²	98	142.8 Å²	142.8	69%	0.685	73%	0.729	S	S	*	*			trans	49.9	120.6	130	-70.1	0	0	0	0	124.5
405	D	26.3	Very low	27.6	Very low	130 Å²	130	142.7 Å²	142.7	70%	0.695	73%	0.727	S	S	*	*				75.5	128.3	118.7	-73.4	-65.7	0	0	0	125.3
406	H	29	Very low	27.6	Very low	164 Å²	164	141.8 Å²	141.8	76%	0.759	72%	0.724	S	S	*	*			trans	97.1	142	130.1	-91.4	55.4	0	0	0	123.2
407	S	27.5	Very low	27.8	Very low	107 Å²	107	144.8 Å²	144.8	75%	0.748	73%	0.726	S	S	*	*			trans	77.2	147.3	161.3	83	0	0	0	0	117.8
408	I	27.1	Very low	27.6	Very low	139 Å²	139	139.9 Å²	139.9	71%	0.713	72%	0.716	S	S	*	*			cis	178.5	151	-27.1	-107.1	158.5	0	0	0	106.1
409	N	25.8	Very low	27.9	Very low	133 Å²	133	142.1 Å²	142.1	71%	0.711	72%	0.722	S	S	*	*			trans	78.2	118.3	159.9	-77.1	-16.4	0	0	0	124.1
410	H	26.8	Very low	28.1	Very low	156 Å²	156	145.4 Å²	145.4	72%	0.722	73%	0.728	S	S	*	*				98.7	121	122.5	-89	-46.4	0	0	0	123.9
411	K	28.1	Very low	28.2	Very low	170 Å²	170	145 Å²	145	74%	0.739	73%	0.732	S	S	*	*			trans	85.8	120.3	134.1	-90.5	-179.3	173.9	175.9	0	120.3
412	M	25.9	Very low	28.5	Very low	158 Å²	158	143 Å²	143	78%	0.778	73%	0.73	S	S	*	*				60	135.8	126.6	-67.8	-80.5	-167.3	0	0	118.6
413	N	28.3	Very low	28.3	Very low	124 Å²	124	140.5 Å²	140.5	66%	0.663	73%	0.727	S	S	*	*			cis	-173.6	-179.6	-7.8	-156.5	-4.1	0	0	0	108.2
414	I	29.8	Very low	28.6	Very low	123 Å²	123	139.9 Å²	139.9	63%	0.631	73%	0.732	S	S	*	*			trans	79.3	107.3	146	-76.5	160.6	0	0	0	119.9
415	I	29.3	Very low	28.8	Very low	154 Å²	154	140.7 Å²	140.7	79%	0.79	73%	0.733	S	S	*	*			trans	72.5	143.2	133.5	-66.2	-177.8	0	0	0	119.9
416	N	27.8	Very low	28.9	Very low	129 Å²	129	140.3 Å²	140.3	69%	0.69	74%	0.738	S	S	*	*			cis	-179.3	163.6	-26.7	-150.7	-24.7	0	0	0	108.2
417	K	29.8	Very low	28.7	Very low	182 Å²	182	139.7 Å²	139.7	79%	0.791	74%	0.739	S	S	*	*			trans	69.4	146.2	166.7	-66.3	176.7	178.9	176	0	116.9
418	S	28.8	Very low	28.6	Very low	85 Å²	85	142 Å²	142	59%	0.594	74%	0.741	S	S	*	*			cis	-168.3	145.8	2.9	-114.4	0	0	0	0	114.4
419	I	30.3	Very low	28.7	Very low	156 Å²	156	140.5 Å²	140.5	80%	0.8	74%	0.743	S	S	*	*			trans	72.2	146.7	141.1	-62.6	165.7	0	0	0	118.5
420	R	30	Very low	28.7	Very low	220 Å²	220	139 Å²	139	83%	0.83	74%	0.743	S	S	*	*			cis	172.6	135.9	-28.7	-179	-169.6	-99.7	-169.8	-5.8	107.8
421	K	31.6	Very low	28.9	Very low	201 Å²	201	140.8 Å²	140.8	87%	0.874	75%	0.749	S	S	*	*			trans	158.5	143.6	150.2	-91	160.7	-176.3	-176.2	0	108.3
422	S	29.9	Very low	29	Very low	96 Å²	96	139.6 Å²	139.6	67%	0.671	75%	0.75	S	S	*	*			cis	-167.9	126.9	-10.8	39.9	0	0	0	0	111.3
423	S	29	Very low	29.1	Very low	106 Å²	106	138 Å²	138	74%	0.741	75%	0.749	S	S	*	*			trans	48	142.5	138.6	59.5	0	0	0	0	121.8
424	S	32.8	Very low	29.1	Very low	106 Å²	106	138.7 Å²	138.7	74%	0.741	75%	0.752	S	S	*	*			cis	-149.9	159.1	25.2	60	0	0	0	0	112.7
425	T	30.1	Very low	28.9	Very low	116 Å²	116	138.8 Å²	138.8	71%	0.712	75%	0.753	S	S	*	*			cis	88.3	144.3	7.4	75.6	0	0	0	0	118.3
426	P	29.6	Very low	28.8	Very low	122 Å²	122	141.4 Å²	141.4	79%	0.792	75%	0.753	S	S	*	*			cis	-154.2	-157	-30.8	43.2	-21.8	0	0	0	114.8
427	L	23.9	Very low	28.7	Very low	151 Å²	151	143.5 Å²	143.5	79%	0.791	76%	0.757	S	S	*	*			trans	-66.1	146.2	165.8	-73.3	143.6	0	0	0	116
428	I	26.8	Very low	28.7	Very low	155 Å²	155	141.5 Å²	141.5	80%	0.795	75%	0.753	S	S	*	*			trans	55.5	119.3	141.1	-56.5	167.3	0	0	0	120.5
429	S	28	Very low	28.7	Very low	107 Å²	107	143.4 Å²	143.4	75%	0.748	76%	0.764	S	S	*	*			trans	-152.2	111.5	146.2	63.5	0	0	0	0	108.9
430	S	26.8	Very low	28.5	Very low	102 Å²	102	139.1 Å²	139.1	71%	0.713	76%	0.757	S	S	*	*				75.2	116.6	89.7	76.1	0	0	0	0	116.9
431	K	30.9	Very low	28.4	Very low	194 Å²	194	135.9 Å²	135.9	84%	0.843	76%	0.757	S	S	*	*			trans	-169.4	119.6	139	-106.3	172.6	-176.5	177.7	0	113.9
432	L	30	Very low	28.1	Very low	144 Å²	144	131.8 Å²	131.8	75%	0.754	75%	0.749	S	S	*	*			trans	73.5	113.3	140.3	-60.2	166.1	0	0	0	122.5
433	V	27.8	Very low	28.1	Very low	126 Å²	126	133.8 Å²	133.8	76%	0.764	75%	0.751	S	S	*	*				77.5	135.4	116.7	167.7	0	0	0	0	118
434	L	27.5	Very low	28	Very low	138 Å²	138	134.8 Å²	134.8	72%	0.723	75%	0.748	S	S	*	*			cis	-149.3	149.2	11.8	-162.1	64.7	0	0	0	112.9
435	N	26.4	Very low	27.8	Very low	124 Å²	124	135.6 Å²	135.6	66%	0.663	74%	0.744	S	S	*	*			trans	0.9	137.3	156.2	-46.4	-29.2	0	0	0	121.2
436	R	26.5	Very low	27.8	Very low	210 Å²	210	136 Å²	136	79%	0.792	74%	0.742	S	S	*	*				171.1	145.7	92.3	-89.6	-158.6	174.8	151.1	4.8	113.9
437	F	27.1	Very low	27.8	Very low	173 Å²	173	137.1 Å²	137.1	76%	0.759	74%	0.741	S	S	*	*			trans	19.4	141.7	145.9	-59.7	-94.9	0	0	0	119.5
438	I	29.6	Very low	28	Very low	140 Å²	140	134.4 Å²	134.4	72%	0.718	73%	0.733	S	S	*	*			cis	-160.8	154.1	11.6	-106.8	154.8	0	0	0	107.5
439	P	27.5	Very low	28.1	Very low	125 Å²	125	134.2 Å²	134.2	81%	0.812	73%	0.734	S	S	*	*			trans	-84.3	150.8	175.5	34.9	-35.3	0	0	0	113.3
440	G	26.4	Very low	28.1	Very low	65 Å²	65	133.1 Å²	133.1	67%	0.67	73%	0.726	S	S	*	*			trans	162.1	133.7	162.6	0	0	0	0	0	115.3
441	N	29.3	Very low	28.4	Very low	152 Å²	152	134.5 Å²	134.5	81%	0.813	73%	0.725	S	S	*	*			trans	63.5	101.3	149.1	-58.7	1.7	0	0	0	117.1
442	T	24.7	Very low	28.5	Very low	115 Å²	115	131.2 Å²	131.2	71%	0.706	72%	0.717	S	S	*	*				68.3	143.3	79.5	63.9	0	0	0	0	114.9
443	I	29.1	Very low	28.5	Very low	139 Å²	139	130.2 Å²	130.2	71%	0.713	71%	0.711	S	S	*	*			trans	90.7	88.5	163.2	-59.1	151.3	0	0	0	115.4
444	D	27.6	Very low	28.6	Very low	127 Å²	127	130.8 Å²	130.8	68%	0.679	71%	0.71	S	S	*	*				63.7	145.4	114.2	-46.7	-18.3	0	0	0	123.9
445	N	28.1	Very low	28.8	Very low	123 Å²	123	129.7 Å²	129.7	66%	0.658	71%	0.705	S	S	*	*			trans	82.9	109.1	139.3	-70.1	-23.7	0	0	0	120.9
446	N	30.9	Very low	29	Very low	125 Å²	125	133.4 Å²	133.4	67%	0.668	71%	0.711	S	S	*	*				50	118.3	111.5	-47.1	-15.6	0	0	0	118.7
447	N	29.1	Very low	29	Very low	145 Å²	145	129 Å²	129	78%	0.775	70%	0.703	S	S	*	*				-179.3	123.9	107.8	-94.3	-12.4	0	0	0	108.6
448	C	28.3	Very low	29.3	Very low	94 Å²	94	126.5 Å²	126.5	64%	0.635	71%	0.705	S	S	*	*				83	137.5	71.5	-72.3	0	0	0	0	112.9
449	N	29	Very low	29.3	Very low	151 Å²	151	125.2 Å²	125.2	81%	0.807	70%	0.699	S	S	*	*			trans	68.8	150.3	154	-60.5	-4.7	0	0	0	116.4
450	S	27	Very low	29.5	Very low	83 Å²	83	124.7 Å²	124.7	58%	0.58	69%	0.689	S	S	*	*			cis	-162.5	-151	-16.1	41.2	0	0	0	0	106.3
451	D	33.3	Very low	29.6	Very low	131 Å²	131	129.2 Å²	129.2	70%	0.701	69%	0.69	S	S	*	*			trans	76.6	142.9	161.2	-39.6	-13	0	0	0	114.8
452	D	33.7	Very low	29.7	Very low	126 Å²	126	130.8 Å²	130.8	67%	0.674	69%	0.69	S	S	*	*			cis	-163.2	143.3	-26.4	-117.9	-6.9	0	0	0	108.7
453	I	30.4	Very low	29.8	Very low	123 Å²	123	129.8 Å²	129.8	63%	0.631	69%	0.687	S	S	*	*				54.5	128.9	127.2	-64.1	174	0	0	0	120.2
454	N	29.9	Very low	29.8	Very low	137 Å²	137	132.2 Å²	132.2	73%	0.733	69%	0.693	S	S	*	*			trans	70.5	153.2	157.2	-66.8	-0	0	0	0	117.5
455	D	30.1	Very low	29.8	Very low	115 Å²	115	132 Å²	132	62%	0.615	70%	0.698	S	S	*	*			cis	-161.3	-179.1	-4.4	-123.2	-38.5	0	0	0	109.5
456	Y	31.8	Very low	29.7	Very low	202 Å²	202	130.9 Å²	130.9	79%	0.792	69%	0.689	S	S	*	*			trans	75.6	87.6	164.4	-66.3	-70.4	0	0	0	120
457	D	27	Very low	29.5	Very low	117 Å²	117	132 Å²	132	63%	0.626	70%	0.695	S	S	*	*			trans	-42.5	136.8	141	-162.7	7.5	0	0	0	112.9	L459	D457-L459 PolarHBondContact OD1-N 3.32Å; D457-L459 WeakPolarHBondContact OD2-CD1 3.38Å; D457-L459 VanDerWaalsContact OD2-CG 3.31Å; D457-L459 WeakPolarHBondContact OD2-CG 3.43Å
458	P	33.4	Very low	29.3	Very low	122 Å²	122	128.5 Å²	128.5	79%	0.792	68%	0.676	S	S	*	*				-134	90.1	125.1	36.7	-27.2	0	0	0	113.9	N460	P458-N460 PolarHBondContact O-N 3.24Å
459	L	28.4	Very low	29.3	Very low	113 Å²	113	131.6 Å²	131.6	59%	0.592	69%	0.687	S	S	*	*				-13	123.5	127.5	-84.6	168.6	0	0	0	112.6	D457	D457-L459 PolarHBondContact OD1-N 3.32Å; D457-L459 WeakPolarHBondContact OD2-CD1 3.38Å; D457-L459 VanDerWaalsContact OD2-CG 3.31Å; D457-L459 WeakPolarHBondContact OD2-CG 3.43Å
460	N	31.3	Very low	29.1	Very low	113 Å²	113	131 Å²	131	60%	0.604	68%	0.683	S	S	*	*				-179.3	121.3	105.6	-89.8	-51.9	0	0	0	113.9	P458	P458-N460 PolarHBondContact O-N 3.24Å
461	K	29.6	Very low	29.1	Very low	161 Å²	161	133.6 Å²	133.6	70%	0.7	69%	0.691	S	S	*	*				52.4	127.7	120.3	-61	175.3	-174.2	129.3	0	117.9
462	K	30.8	Very low	28.7	Very low	185 Å²	185	135.5 Å²	135.5	80%	0.804	70%	0.696	S	S	*	*			cis	-143.4	145	23.6	-69.2	101.7	170	-166.8	0	109
463	S	27.4	Very low	28.2	Very low	94 Å²	94	136.3 Å²	136.3	66%	0.657	70%	0.699	S	S	*	*			cis	75.4	97	34.7	82.3	0	0	0	0	116.2
464	F	28	Very low	27.9	Very low	190 Å²	190	137.1 Å²	137.1	83%	0.833	70%	0.704	S	S	*	*			trans	22.1	142.2	145.5	-66	-84.4	0	0	0	121.4
465	P	27.7	Very low	27.6	Very low	121 Å²	121	135 Å²	135	79%	0.786	70%	0.699	S	S	*	*				-130	153.1	88.7	37.8	-29	0	0	0	112.3
466	Q	25.9	Very low	27.3	Very low	100 Å²	100	139.2 Å²	139.2	47%	0.467	71%	0.707	S	S	.	*			cis	75.7	73.4	33.1	-155.6	171.7	1.9	0	0	114.3	N856	Q466-N856 PolarHBondContact NE2-O 3.3Å
467	N	27.5	Very low	26.9	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	70%	0.698	S	S	*	*			trans	-138.7	119.7	154.9	-104.3	-11.7	0	0	0	104.7
468	N	25.6	Very low	26.7	Very low	72 Å²	72	138.2 Å²	138.2	39%	0.385	71%	0.706	S	S	.	*				45.9	92.5	65.2	-67.2	-28.1	0	0	0	112.5	N857	N468-N857 PolarHBondContact ND2-ND2 2.79Å; N468-N857 PolarHBondContact ND2-OD1 2.96Å; N468-N857 PolarHBondContact OD1-ND2 2.9Å; N468-N857 PolarHBondContact OD1-OD1 3.38Å; N468-N857 VanDerWaalsContact OD1-OD1 3.12Å
469	N	28.5	Very low	26.4	Very low	160 Å²	160	133.5 Å²	133.5	86%	0.856	68%	0.676	S	S	*	*			trans	-150.1	129.8	130.9	-94.6	-26.4	0	0	0	108.1
470	D	24.7	Very low	26.3	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	68%	0.681	S	S	*	*			trans	-64.4	175.9	161.2	-53.8	-74.8	0	0	0	110
471	N	25.9	Very low	26.2	Very low	138 Å²	138	133.8 Å²	133.8	74%	0.738	68%	0.676	S	S	*	*			trans	74.1	144.5	173.8	-35.4	-49.6	0	0	0	112.8
472	E	25.6	Very low	26	Very low	172 Å²	172	131.7 Å²	131.7	80%	0.804	67%	0.67	S	S	*	*			cis	-157.8	167.3	2.2	-131.7	158.2	-161.5	0	0	109.1	I474	E472-I474 PolarHBondContact O-N 3.1Å
473	L	23.2	Very low	25.9	Very low	142 Å²	142	129.2 Å²	129.2	74%	0.743	66%	0.664	S	S	*	*			trans	-64.7	119.5	166.7	-80.9	78	0	0	0	109
474	I	24.7	Very low	25.9	Very low	141 Å²	141	130.2 Å²	130.2	72%	0.723	66%	0.662	S	S	*	*			trans	-104.4	92.3	153.7	-60	-177.2	0	0	0	107.8	E472 Y476	E472-I474 PolarHBondContact O-N 3.1Å; I474-Y476 HydrophobicContact CG2-CD2 3.88Å; I474-Y476 HydrophobicContact CG2-CE2 3.7Å; I474-Y476 PolarHBondContact O-N 3.25Å
475	C	22.8	Very low	25.9	Very low	93 Å²	93	126.6 Å²	126.6	63%	0.628	65%	0.651	S	S	*	*			trans	-65.7	107.8	164.3	-68.9	0	0	0	0	109.2	C477	C475-C477 VanDerWaalsContact C-N 3.35Å; C475-C477 PolarHBondContact O-N 3.46Å
476	Y	23.2	Very low	25.8	Very low	203 Å²	203	129.9 Å²	129.9	80%	0.796	65%	0.653	S	S	*	*			trans	-81.4	91.2	153.6	-88.1	-79.5	0	0	0	108.8	I474 W478	I474-Y476 HydrophobicContact CG2-CD2 3.88Å; I474-Y476 HydrophobicContact CG2-CE2 3.7Å; I474-Y476 PolarHBondContact O-N 3.25Å; Y476-W478 PolarHBondContact O-N 3.01Å
477	C	24.2	Very low	25.9	Very low	89 Å²	89	129.3 Å²	129.3	60%	0.601	66%	0.656	S	S	*	*			trans	-59.8	113.8	163.2	-66.4	0	0	0	0	108.6	C475 S479	C475-C477 VanDerWaalsContact C-N 3.35Å; C475-C477 PolarHBondContact O-N 3.46Å; C477-S479 PolarHBondContact O-N 3.42Å; C477-S479 VanDerWaalsContact O-N 3.09Å
478	W	23	Very low	25.9	Very low	208 Å²	208	127.2 Å²	127.2	79%	0.788	65%	0.645	S	S	*	*			trans	-80.6	79.8	151.7	-89.4	48	0	0	0	107.9	Y476 M482	Y476-W478 PolarHBondContact O-N 3.01Å; W478-M482 HydrophobicContact CE3-CE 3.79Å; W478-M482 HydrophobicContact CE3-CG 4.04Å; W478-M482 HydrophobicContact CH2-CE 4.4Å; W478-M482 HydrophobicContact CZ3-CE 3.45Å; W478-M482 VanDerWaalsContact CZ3-CE 3.45Å; W478-M482 HydrophobicContact CZ3-CG 4.14Å
479	S	25.8	Very low	25.9	Very low	24 Å²	24	131.5 Å²	131.5	17%	0.168	67%	0.668	C	S	.	*			trans	-48.6	137.7	163.4	32.5	0	0	0	0	112.7	C477 S481 P1265 V1266	C477-S479 PolarHBondContact O-N 3.42Å; C477-S479 VanDerWaalsContact O-N 3.09Å; S479-S481 PolarHBondContact O-N 2.98Å; S479-P1265 WeakPolarHBondContact CB-O 3.35Å; S479-P1265 PolarHBondContact OG-O 3.35Å; S479-V1266 VanDerWaalsContact CB-C 3.46Å; S479-V1266 WeakPolarHBondContact CB-OXT 3.48Å
480	K	27.4	Very low	25.9	Very low	159 Å²	159	129.2 Å²	129.2	69%	0.691	66%	0.664	S	S	*	*	S	Bend	trans	38.3	-12.9	150.8	-100	172.6	178.8	169.6	0	124.1
481	S	28.5	Very low	26.2	Very low	73 Å²	73	126.5 Å²	126.5	51%	0.51	65%	0.653	S	S	.	*	S	Bend	trans	-104.3	-11.7	-170.8	-61.3	0	0	0	0	114.9	S479 I485	S479-S481 PolarHBondContact O-N 2.98Å; S481-I485 WeakPolarHBondContact O-CD1 3.23Å
482	M	25.5	Very low	26.4	Very low	116 Å²	116	121.9 Å²	121.9	57%	0.571	64%	0.638	S	S	*	*	S	Bend	trans	-92.3	-15	169.6	-93.6	-142.4	-155.4	0	0	114.2	W478 N484 I485	W478-M482 HydrophobicContact CE3-CE 3.79Å; W478-M482 HydrophobicContact CE3-CG 4.04Å; W478-M482 HydrophobicContact CH2-CE 4.4Å; W478-M482 HydrophobicContact CZ3-CE 3.45Å; W478-M482 VanDerWaalsContact CZ3-CE 3.45Å; W478-M482 HydrophobicContact CZ3-CG 4.14Å; M482-N484 PolarHBondContact O-N 3.08Å; M482-I485 PolarHBondContact O-N 3.4Å
483	I	29.1	Very low	26.6	Very low	133 Å²	133	120 Å²	120	68%	0.682	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-10.7	179.8	-70.6	174.7	0	0	0	112	T487	I483-T487 PolarHBondContact O-OG1 3.03Å
484	N	27.9	Very low	26.9	Very low	115 Å²	115	116.3 Å²	116.3	62%	0.615	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	23	171.1	-75.5	18.7	0	0	0	113.4	M482	M482-N484 PolarHBondContact O-N 3.08Å
485	I	27.1	Very low	27.4	Very low	114 Å²	114	116.5 Å²	116.5	59%	0.585	62%	0.617	S	S	*	*	S	Bend	trans	-119.4	-9.5	178.1	-63.6	179.4	0	0	0	112.6	S481 M482	S481-I485 WeakPolarHBondContact O-CD1 3.23Å; M482-I485 PolarHBondContact O-N 3.4Å
486	F	26.6	Very low	27.7	Very low	191 Å²	191	116.4 Å²	116.4	84%	0.838	61%	0.609	S	S	*	*	S	Bend	trans	-121.8	23.7	170.8	-82	-81.4	0	0	0	113.3
487	T	28	Very low	28	Very low	87 Å²	87	113 Å²	113	53%	0.534	60%	0.604	S	S	.	*	S	Bend	trans	-120.3	25.5	175.5	53.3	0	0	0	0	113.1	I483	I483-T487 PolarHBondContact O-OG1 3.03Å
488	D	26.9	Very low	28.3	Very low	104 Å²	104	115 Å²	115	56%	0.556	61%	0.608	S	S	*	*			trans	-131.9	8.3	-178.4	-78.6	-53.4	0	0	0	115.5	S490	D488-S490 PolarHBondContact O-N 3.23Å
489	N	26	Very low	28.8	Very low	162 Å²	162	108.8 Å²	108.8	87%	0.866	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	32.2	174.7	-81.6	19.5	0	0	0	113.8
490	S	28.8	Very low	28.9	Very low	112 Å²	112	114.9 Å²	114.9	78%	0.783	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	11.3	171.9	62.9	0	0	0	0	114.9	D488	D488-S490 PolarHBondContact O-N 3.23Å
491	T	30.5	Very low	29	Very low	80 Å²	80	115.7 Å²	115.7	49%	0.491	63%	0.633	S	S	.	*	S	Bend	trans	-111.5	-19.8	168.8	40.7	0	0	0	0	112.8	L493 S494	T491-L493 PolarHBondContact O-N 3.25Å; T491-L493 VanDerWaalsContact O-N 3.1Å; T491-S494 PolarHBondContact O-N 3.48Å; T491-S494 VanDerWaalsContact O-N 3.12Å; T491-S494 PolarHBondContact O-OG 3.09Å
492	G	30.2	Very low	28.9	Very low	41 Å²	41	120.9 Å²	120.9	42%	0.423	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.9	-5.3	-178	0	0	0	0	0	117.3
493	L	28.2	Very low	29	Very low	134 Å²	134	121.5 Å²	121.5	70%	0.702	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-8.1	172	-97.4	166.3	0	0	0	113.8	T491	T491-L493 PolarHBondContact O-N 3.25Å; T491-L493 VanDerWaalsContact O-N 3.1Å
494	S	31.1	Very low	28.9	Very low	64 Å²	64	121.6 Å²	121.6	45%	0.448	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	-9	171.9	40	0	0	0	0	113.9	T491 N498	T491-S494 PolarHBondContact O-N 3.48Å; T491-S494 VanDerWaalsContact O-N 3.12Å; T491-S494 PolarHBondContact O-OG 3.09Å; S494-N498 PolarHBondContact O-ND2 3.35Å
495	E	33.5	Very low	29	Very low	144 Å²	144	123 Å²	123	67%	0.673	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-26.6	174	-71.4	-178.3	143.5	0	0	112.8	S499	E495-S499 WeakPolarHBondContact O-CB 3.41Å; E495-S499 PolarHBondContact O-N 2.83Å; E495-S499 PolarHBondContact O-OG 3.11Å
496	I	30.1	Very low	29.2	Very low	91 Å²	91	124.2 Å²	124.2	47%	0.467	69%	0.685	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-25.6	174.5	-64.4	176.9	0	0	0	112.2
497	L	30.4	Very low	29.2	Very low	131 Å²	131	122.1 Å²	122.1	69%	0.686	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-4.2	174.5	-81.4	164	0	0	0	114.4
498	N	30.5	Very low	29.2	Very low	131 Å²	131	125.8 Å²	125.8	70%	0.701	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-0.9	170	-75.2	-44.1	0	0	0	113	S494	S494-N498 PolarHBondContact O-ND2 3.35Å
499	S	31.9	Very low	29.3	Very low	78 Å²	78	125 Å²	125	55%	0.545	70%	0.7	S	S	.	*	S	Bend	trans	-99.4	25.8	174.9	80.2	0	0	0	0	113.9	E495	E495-S499 WeakPolarHBondContact O-CB 3.41Å; E495-S499 PolarHBondContact O-N 2.83Å; E495-S499 PolarHBondContact O-OG 3.11Å
500	L	28.3	Very low	29.4	Very low	153 Å²	153	122.2 Å²	122.2	80%	0.801	69%	0.689	S	S	*	*	S	Bend	trans	-125.3	16.1	177.2	-107.8	169.1	0	0	0	112.7
501	H	28.9	Very low	29.3	Very low	175 Å²	175	123.7 Å²	123.7	81%	0.81	69%	0.688	S	S	*	*	S	Bend	trans	-137.8	38.1	-178.6	-151.7	-61.9	0	0	0	113.8
502	E	27.7	Very low	29.5	Very low	183 Å²	183	127.2 Å²	127.2	86%	0.855	70%	0.704	S	S	*	*			trans	-160.6	104.4	162.4	-123.2	170.9	-165.1	0	0	110.4
503	C	27.1	Very low	29.4	Very low	128 Å²	128	129.3 Å²	129.3	87%	0.865	71%	0.712	S	S	*	*			trans	-168.7	91.7	157.8	-99.3	0	0	0	0	109.3
504	D	28	Very low	29.6	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	71%	0.709	S	S	*	*			trans	-21.8	122	170.2	-55	-53.3	0	0	0	117.7
505	V	29.1	Very low	29.7	Very low	145 Å²	145	134.6 Å²	134.6	88%	0.879	72%	0.723	S	S	*	*			trans	-85.9	101.8	149.1	179	0	0	0	0	107.2
506	N	31.5	Very low	29.6	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	72%	0.721	S	S	*	*			trans	-65.6	137.1	176.6	-80.6	-68.8	0	0	0	111.5
507	N	26.2	Very low	29.6	Very low	147 Å²	147	136.6 Å²	136.6	79%	0.786	74%	0.738	S	S	*	*			trans	-66.1	176	166.7	-80.4	-53.8	0	0	0	111.8
508	I	28.2	Very low	29.5	Very low	164 Å²	164	133.8 Å²	133.8	84%	0.841	74%	0.741	S	S	*	*			trans	85.8	121.1	167.3	-51.7	167.4	0	0	0	112.5
509	S	28.7	Very low	29.6	Very low	88 Å²	88	134.5 Å²	134.5	62%	0.615	74%	0.744	S	S	*	*			cis	-166.7	155.5	-3.2	51.2	0	0	0	0	113.2
510	T	27.9	Very low	29.7	Very low	104 Å²	104	137 Å²	137	64%	0.638	75%	0.752	S	S	*	*			trans	51.5	126.4	141.4	55.1	0	0	0	0	121.3
511	D	27	Very low	29.9	Very low	142 Å²	142	137.2 Å²	137.2	76%	0.759	75%	0.754	S	S	*	*			trans	58.5	112.7	131.8	-46	-19.7	0	0	0	118.2
512	D	34.3	Very low	30.1	Very low	155 Å²	155	135.5 Å²	135.5	83%	0.829	75%	0.75	S	S	*	*				-157.7	161.6	80.6	-131.7	-37.1	0	0	0	113.8
513	S	28.8	Very low	30.4	Very low	85 Å²	85	136.3 Å²	136.3	59%	0.594	75%	0.747	S	S	*	*			trans	-75.4	163.1	-171.6	58.1	0	0	0	0	115.1
514	N	32	Very low	30.6	Very low	118 Å²	118	137.3 Å²	137.3	63%	0.631	74%	0.744	S	S	*	*				134.9	140.1	104.6	-120.4	-26.3	0	0	0	117.6
515	Y	32.9	Very low	30.8	Very low	190 Å²	190	137.4 Å²	137.4	75%	0.745	74%	0.744	S	S	*	*			trans	65.4	141.8	169.1	-62.9	-84.7	0	0	0	121.3
516	I	31.2	Very low	30.9	Very low	124 Å²	124	138.8 Å²	138.8	64%	0.636	74%	0.738	S	S	*	*			cis	-167	146.4	-38.2	-125.7	173.5	0	0	0	109.5
517	N	30.3	Very low	30.7	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	74%	0.742	S	S	*	*			trans	45	130.7	160.6	-57.6	-5.3	0	0	0	121.4
518	G	28.7	Very low	30.8	Very low	71 Å²	71	139.2 Å²	139.2	73%	0.732	75%	0.749	S	S	*	*			trans	169.5	61	162.2	0	0	0	0	0	117
519	D	32.5	Very low	30.7	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	75%	0.746	S	S	*	*			trans	64.2	115	153.6	-59.2	-8.4	0	0	0	122
520	N	33.7	Very low	30.9	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	75%	0.752	S	S	*	*			trans	88.8	109.1	138.8	-55.5	-16.9	0	0	0	121.2
521	D	34.2	Very low	31.1	Very low	156 Å²	156	141.7 Å²	141.7	83%	0.834	75%	0.753	S	S	*	*			trans	69	88.5	135.1	-50.5	-20.2	0	0	0	118.7
522	D	32.2	Very low	31.6	Very low	139 Å²	139	143 Å²	143	74%	0.743	75%	0.754	S	S	*	*			trans	-127.5	167.5	164	-150.7	-13.2	0	0	0	109.2
523	Y	33	Very low	31.5	Very low	200 Å²	200	142.3 Å²	142.3	78%	0.784	75%	0.75	S	S	*	*			trans	72.3	108.8	-174.1	-48	-79.6	0	0	0	114.6
524	D	32.8	Very low	31.8	Very low	150 Å²	150	143.7 Å²	143.7	80%	0.802	75%	0.75	S	S	*	*				-150.2	158.8	58.9	-87.6	-36.1	0	0	0	115.7
525	D	32.6	Very low	32	Very low	136 Å²	136	141.8 Å²	141.8	73%	0.727	74%	0.739	S	S	*	*			trans	59.9	78.7	157.9	-70.9	-21.8	0	0	0	122
526	K	30.1	Very low	32.2	Very low	174 Å²	174	138.2 Å²	138.2	76%	0.757	73%	0.732	S	S	*	*				38	100.9	114.8	-68	175.2	-178.5	165.2	0	118.2	L528	K526-L528 PolarHBondContact O-N 3.34Å; K526-L528 VanDerWaalsContact O-N 3.09Å
527	S	26.7	Very low	32.2	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	73%	0.727	S	S	*	*			trans	0.3	93.4	133	60.2	0	0	0	0	117.5
528	L	28.9	Very low	32.4	Very low	179 Å²	179	136 Å²	136	94%	0.937	72%	0.719	S	S	*	*			trans	-106.7	65	162.2	-91.5	162.2	0	0	0	110.1	K526	K526-L528 PolarHBondContact O-N 3.34Å; K526-L528 VanDerWaalsContact O-N 3.09Å
529	L	26.7	Very low	32.8	Very low	147 Å²	147	139.5 Å²	139.5	77%	0.77	71%	0.713	S	S	*	*			trans	-111.2	136	164	-136.1	88.2	0	0	0	107.9
530	N	31.5	Very low	32.8	Very low	138 Å²	138	139.6 Å²	139.6	74%	0.738	71%	0.714	S	S	*	*	S	Bend	trans	72.3	106	-176	-45.3	-43.6	0	0	0	114.9
531	N	32.9	Very low	32.6	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	70%	0.698	S	S	*	*			trans	-179.6	-25.3	132.3	-90.5	-26	0	0	0	113.8	L533 L534 D535	N531-L533 VanDerWaalsContact C-N 3.32Å; N531-L533 PolarHBondContact O-N 2.9Å; N531-L533 VanDerWaalsContact O-N 3.14Å; N531-L534 PolarHBondContact O-N 2.61Å; N531-D535 PolarHBondContact O-N 3.22Å
532	E	37.2	Very low	32.3	Very low	168 Å²	168	137.6 Å²	137.6	79%	0.785	70%	0.701	S	S	*	*	H	α-helix	trans	-57.7	-34.9	-170.8	-67.3	-170.4	130.9	0	0	115.4	L534 D535 I536	E532-L534 VanDerWaalsContact C-N 3.35Å; E532-D535 PolarHBondContact O-N 3.45Å; E532-I536 WeakPolarHBondContact O-CG1 3.34Å; E532-I536 PolarHBondContact O-N 2.78Å; E532-I536 VanDerWaalsContact O-N 3.09Å
533	L	32.9	Very low	32	Very low	142 Å²	142	136 Å²	136	74%	0.743	70%	0.7	S	S	*	*	H	α-helix	trans	-78.2	-21.3	-178.3	-142.3	141.1	0	0	0	112.9	N531 L537	N531-L533 VanDerWaalsContact C-N 3.32Å; N531-L533 PolarHBondContact O-N 2.9Å; N531-L533 VanDerWaalsContact O-N 3.14Å; L533-L537 HydrophobicContact CD2-CD1 4.35Å
534	L	34.7	Very low	31.7	Very low	113 Å²	113	131.8 Å²	131.8	59%	0.592	70%	0.697	S	S	*	*	H	α-helix	trans	-83.4	-35.8	171.5	-163.4	65.2	0	0	0	110.5	N531 E532 L537 M538	N531-L534 PolarHBondContact O-N 2.61Å; E532-L534 VanDerWaalsContact C-N 3.35Å; L534-L537 PolarHBondContact O-N 3.26Å; L534-M538 HydrophobicContact CG-CG 4.41Å; L534-M538 WeakPolarHBondContact O-CB 3.28Å; L534-M538 WeakPolarHBondContact O-CG 3.43Å; L534-M538 PolarHBondContact O-N 3.41Å
535	D	36.6	Very low	31.4	Very low	78 Å²	78	131.1 Å²	131.1	42%	0.417	69%	0.694	S	S	.	*	H	α-helix	trans	-66.2	-37.2	177.9	-133.9	38.8	0	0	0	112.3	N531 E532 M538 K539	N531-D535 PolarHBondContact O-N 3.22Å; E532-D535 PolarHBondContact O-N 3.45Å; D535-M538 PolarHBondContact O-N 2.83Å; D535-K539 VanDerWaalsContact O-CB 3.28Å; D535-K539 WeakPolarHBondContact O-CB 3.47Å; D535-K539 VanDerWaalsContact O-CG 3.31Å; D535-K539 WeakPolarHBondContact O-CG 3.47Å; D535-K539 PolarHBondContact O-N 3.2Å; D535-K539 WeakPolarHBondContact OD2-CE 3.45Å; D535-K539 IonicContact OD2-NZ 3.84Å; D535-K539 PolarHBondContact OD2-NZ 3.41Å
536	I	36.3	Very low	31.1	Very low	116 Å²	116	130.1 Å²	130.1	60%	0.595	70%	0.697	S	S	*	*	H	α-helix	trans	-68.4	-35.6	172.8	-67.6	165.8	0	0	0	111.7	E532	E532-I536 WeakPolarHBondContact O-CG1 3.34Å; E532-I536 PolarHBondContact O-N 2.78Å; E532-I536 VanDerWaalsContact O-N 3.09Å
537	L	31.7	Very low	30.9	Very low	100 Å²	100	129.2 Å²	129.2	52%	0.524	70%	0.7	S	S	.	*	H	α-helix	trans	-77.3	-20.1	176.9	-85.3	165.2	0	0	0	113.7	L533 L534	L533-L537 HydrophobicContact CD2-CD1 4.35Å; L534-L537 PolarHBondContact O-N 3.26Å
538	M	34.8	Very low	31	Very low	132 Å²	132	130.2 Å²	130.2	65%	0.65	70%	0.701	S	S	*	*	H	α-helix	trans	-98	-19.1	177.9	-67.6	-72.8	-75.1	0	0	113.6	L534 D535	L534-M538 HydrophobicContact CG-CG 4.41Å; L534-M538 WeakPolarHBondContact O-CB 3.28Å; L534-M538 WeakPolarHBondContact O-CG 3.43Å; L534-M538 PolarHBondContact O-N 3.41Å; D535-M538 PolarHBondContact O-N 2.83Å
539	K	37.2	Very low	30.7	Very low	143 Å²	143	130 Å²	130	62%	0.622	69%	0.693	S	S	*	*	H	α-helix	trans	-86.2	-25.2	176.2	-78	168.6	172.7	165.1	0	114.6	D535 A541	D535-K539 VanDerWaalsContact O-CB 3.28Å; D535-K539 WeakPolarHBondContact O-CB 3.47Å; D535-K539 VanDerWaalsContact O-CG 3.31Å; D535-K539 WeakPolarHBondContact O-CG 3.47Å; D535-K539 PolarHBondContact O-N 3.2Å; D535-K539 WeakPolarHBondContact OD2-CE 3.45Å; D535-K539 IonicContact OD2-NZ 3.84Å; D535-K539 PolarHBondContact OD2-NZ 3.41Å; K539-A541 VanDerWaalsContact C-N 3.26Å; K539-A541 PolarHBondContact O-N 2.8Å
540	D	32.2	Very low	30.8	Very low	149 Å²	149	132.1 Å²	132.1	80%	0.797	70%	0.699	S	S	*	*	S	Bend	trans	-84.4	6	176.9	-90.8	-9.3	0	0	0	114.2
541	A	29.3	Very low	30.5	Very low	45 Å²	45	129.7 Å²	129.7	37%	0.372	69%	0.693	S	S	.	*	S	Bend	trans	-133	128.8	165.5	0	0	0	0	0	108.2	K539	K539-A541 VanDerWaalsContact C-N 3.26Å; K539-A541 PolarHBondContact O-N 2.8Å
542	F	27.1	Very low	30.2	Very low	201 Å²	201	129.2 Å²	129.2	88%	0.882	70%	0.7	S	S	*	*			trans	77.6	77.9	-170.2	-49.2	-76.3	0	0	0	115.9
543	S	27.5	Very low	29.7	Very low	106 Å²	106	132 Å²	132	74%	0.741	70%	0.703	S	S	*	*			trans	-93.7	121.6	146.9	172.6	0	0	0	0	108.6
544	P	26	Very low	29.5	Very low	110 Å²	110	128.9 Å²	128.9	71%	0.714	71%	0.705	S	S	*	*			trans	-112.4	36.4	-177.2	40.9	-31.9	0	0	0	114.1
545	D	26.3	Very low	29	Very low	136 Å²	136	130.4 Å²	130.4	73%	0.727	71%	0.714	S	S	*	*			trans	-110.5	97.1	-173.5	-69.8	-57.7	0	0	0	114.4
546	S	27.6	Very low	28.7	Very low	115 Å²	115	132.3 Å²	132.3	80%	0.804	73%	0.733	S	S	*	*			trans	169.5	50.7	145.6	40.4	0	0	0	0	111.5
547	L	25.3	Very low	28.3	Very low	156 Å²	156	134.6 Å²	134.6	82%	0.817	75%	0.746	S	S	*	*			trans	-95	72.2	162.7	-86	170.2	0	0	0	109.7	F549	L547-F549 PolarHBondContact O-N 3.17Å
548	T	27.9	Very low	28.3	Very low	138 Å²	138	135.2 Å²	135.2	85%	0.847	76%	0.756	S	S	*	*			trans	-79.7	105.7	158.4	33.8	0	0	0	0	108.8	E550	T548-E550 PolarHBondContact O-N 3.11Å
549	F	24.1	Very low	28	Very low	174 Å²	174	134.3 Å²	134.3	76%	0.763	76%	0.763	S	S	*	*			trans	-57.1	130	163.1	-101.1	-115.2	0	0	0	109.7	L547	L547-F549 PolarHBondContact O-N 3.17Å
550	E	28.7	Very low	27.5	Very low	191 Å²	191	131.9 Å²	131.9	89%	0.893	76%	0.764	S	S	*	*			trans	-137.1	93.6	144.7	-124.4	-177.9	-166.2	0	0	109.1	T548	T548-E550 PolarHBondContact O-N 3.11Å
551	S	24	Very low	27.2	Very low	87 Å²	87	130.9 Å²	130.9	61%	0.608	76%	0.764	S	S	*	*			trans	-86.3	100.9	170.7	52.4	0	0	0	0	109.2
552	S	28	Very low	27.2	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	78%	0.78	S	S	*	*			trans	-101.3	112.9	163.8	46.9	0	0	0	0	109.6
553	W	25.5	Very low	27.3	Very low	227 Å²	227	133.1 Å²	133.1	86%	0.86	78%	0.777	S	S	*	*			trans	-70.3	146.3	177.8	-72.1	2.7	0	0	0	111.6
554	G	28.2	Very low	27.1	Very low	76 Å²	76	135.5 Å²	135.5	78%	0.784	78%	0.782	S	S	*	*			trans	-141.6	79.8	172.1	0	0	0	0	0	110.3
555	N	25.6	Very low	27.4	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	78%	0.781	S	S	*	*			trans	-60	134.6	-179.3	-78.9	-27.3	0	0	0	112.5
556	S	30.1	Very low	27.4	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	78%	0.782	S	S	*	*			trans	-153.6	125.9	141.7	43.9	0	0	0	0	109.8
557	N	27.3	Very low	27.3	Very low	164 Å²	164	136.1 Å²	136.1	88%	0.877	78%	0.783	S	S	*	*			trans	-88.9	164.4	-167	-110.3	-17.1	0	0	0	113
558	P	31.7	Very low	27.6	Very low	113 Å²	113	134 Å²	134	73%	0.734	78%	0.781	S	S	*	*			trans	-93.4	165.2	-172.3	37.9	-36.2	0	0	0	113.8
559	S	27.9	Very low	27.4	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	78%	0.775	S	S	*	*			trans	-149.4	148.5	159.9	52.5	0	0	0	0	107.7
560	S	27.1	Very low	27.6	Very low	92 Å²	92	132 Å²	132	64%	0.643	78%	0.78	S	S	*	*			cis	169.5	137.5	-20.3	49.3	0	0	0	0	104
561	T	26	Very low	27.6	Very low	129 Å²	129	126.5 Å²	126.5	79%	0.791	78%	0.775	S	S	*	*			trans	60.3	155.1	164	58.8	0	0	0	0	115.6
562	I	28.4	Very low	27.7	Very low	141 Å²	141	132.5 Å²	132.5	72%	0.723	79%	0.786	S	S	*	*			cis	-152.8	131.8	39.8	-77.1	178.2	0	0	0	110.7
563	N	29.2	Very low	27.7	Very low	152 Å²	152	133.2 Å²	133.2	81%	0.813	78%	0.781	S	S	*	*			trans	55.4	116.9	145.6	-54.1	-5.4	0	0	0	124.9
564	N	23.2	Very low	27.8	Very low	156 Å²	156	132 Å²	132	83%	0.834	79%	0.785	S	S	*	*			trans	-47.4	-176	136.6	-103.1	-14	0	0	0	114.3
565	P	33	Very low	27.6	Very low	109 Å²	109	136.1 Å²	136.1	71%	0.708	79%	0.788	S	S	*	*			cis	-137.8	-156.2	-0.1	28.7	-2.3	0	0	0	114.3
566	C	27	Very low	27.5	Very low	109 Å²	109	134.2 Å²	134.2	74%	0.736	79%	0.786	S	S	*	*			trans	104.2	108.7	156.7	-55.7	0	0	0	0	115.7
567	N	26	Very low	27.3	Very low	155 Å²	155	133.7 Å²	133.7	83%	0.829	78%	0.782	S	S	*	*				78.1	92.4	60.5	-76.3	3.4	0	0	0	114.9
568	S	30	Very low	27.3	Very low	111 Å²	111	133 Å²	133	78%	0.776	78%	0.784	S	S	*	*			trans	-177.8	108.6	140.8	49.6	0	0	0	0	105.8
569	C	24.9	Very low	27	Very low	106 Å²	106	136.2 Å²	136.2	72%	0.716	79%	0.794	S	S	*	*				52	96.2	68	-58.9	0	0	0	0	111.3
570	D	28.6	Very low	26.9	Very low	165 Å²	165	135.9 Å²	135.9	88%	0.882	79%	0.792	S	S	*	*				159.5	157.5	114.9	-77.4	-16.2	0	0	0	112.2
571	G	27.7	Very low	26.9	Very low	76 Å²	76	138.2 Å²	138.2	78%	0.784	80%	0.803	S	S	*	*			trans	111.5	70.3	164.8	0	0	0	0	0	116.1
572	Y	27	Very low	26.9	Very low	212 Å²	212	135.7 Å²	135.7	83%	0.831	80%	0.802	S	S	*	*			trans	-66.8	161.5	170.4	-94.2	-100.4	0	0	0	114
573	N	26.6	Very low	26.7	Very low	129 Å²	129	137.3 Å²	137.3	69%	0.69	81%	0.811	S	S	*	*			trans	68.4	102.4	151.5	-63	-18	0	0	0	120.2
574	E	27.5	Very low	26.5	Very low	203 Å²	203	139.8 Å²	139.8	95%	0.949	81%	0.811	S	S	*	*				-142.8	100.8	124.9	-129.1	173	-161.7	0	0	110.3
575	L	24.8	Very low	26.7	Very low	162 Å²	162	138.2 Å²	138.2	85%	0.848	80%	0.801	S	S	*	*			trans	-94.8	112.7	174.5	-95.1	158.7	0	0	0	109
576	S	24.5	Very low	26.3	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	81%	0.807	S	S	*	*			trans	-171.2	131.2	146.6	58.2	0	0	0	0	114.2
577	S	25.6	Very low	26.1	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	81%	0.807	S	S	*	*			trans	54.2	86.5	147.4	66.4	0	0	0	0	120.8
578	T	27.2	Very low	26.2	Very low	150 Å²	150	141.4 Å²	141.4	92%	0.92	81%	0.812	S	S	*	*				-144.6	66.8	120	53.3	0	0	0	0	110.6
579	L	24.7	Very low	25.9	Very low	180 Å²	180	143.5 Å²	143.5	94%	0.942	81%	0.809	S	S	*	*			trans	-115.3	97.8	165	-159	95.7	0	0	0	106.4
580	S	26.5	Very low	26.1	Very low	106 Å²	106	144 Å²	144	74%	0.741	81%	0.812	S	S	*	*			trans	-161	144.2	-178.4	-167.4	0	0	0	0	113.5
581	T	27.1	Very low	26	Very low	141 Å²	141	141.9 Å²	141.9	87%	0.865	80%	0.804	S	S	*	*	S	Bend	trans	63.9	107.9	177.9	64.7	0	0	0	0	116.6
582	G	25.2	Very low	25.8	Very low	75 Å²	75	143.5 Å²	143.5	77%	0.773	80%	0.802	S	S	*	*			cis	-166.5	106.9	-4.3	0	0	0	0	0	114.2
583	L	24.2	Very low	25.7	Very low	175 Å²	175	140.9 Å²	140.9	92%	0.916	80%	0.802	S	S	*	*			trans	-82.2	118.3	146.6	-94.5	162.1	0	0	0	106.6
584	Y	25.6	Very low	25.7	Very low	205 Å²	205	144 Å²	144	80%	0.804	81%	0.81	S	S	*	*			trans	-145.4	115.5	171.3	-123.3	-100	0	0	0	112.8
585	L	26.3	Very low	25.5	Very low	123 Å²	123	142.2 Å²	142.2	64%	0.644	81%	0.805	S	S	*	*			trans	51	105.5	165.4	-83.1	85.6	0	0	0	121.5	L587	L585-L587 HydrophobicContact CD2-CD1 4.12Å; L585-L587 HydrophobicContact CD2-CG 4.41Å
586	C	24.7	Very low	25.5	Very low	123 Å²	123	139.7 Å²	139.7	83%	0.831	80%	0.801	S	S	*	*				-67.1	151.8	122	-58.6	0	0	0	0	109.9
587	L	24.7	Very low	25.8	Very low	139 Å²	139	140.3 Å²	140.3	73%	0.728	81%	0.806	S	S	*	*			trans	-169.9	115.3	141.6	-100.3	-174.9	0	0	0	109.5	L585	L585-L587 HydrophobicContact CD2-CD1 4.12Å; L585-L587 HydrophobicContact CD2-CG 4.41Å
588	L	26.1	Very low	26	Very low	177 Å²	177	144.4 Å²	144.4	93%	0.927	81%	0.81	S	S	*	*			trans	178.8	97	136.6	-96.9	167.5	0	0	0	109.3
589	Q	24.9	Very low	26.4	Very low	155 Å²	155	144.4 Å²	144.4	72%	0.724	80%	0.8	S	S	*	*			trans	-72.4	160.1	166.1	-122.4	158.5	-46.3	0	0	109.6
590	P	28.5	Very low	26.9	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	79%	0.792	S	S	*	*				-141.9	137.6	79.2	23.8	-1	0	0	0	115.1
591	V	26.9	Very low	27.4	Very low	119 Å²	119	142.7 Å²	142.7	72%	0.721	78%	0.783	S	S	*	*				67.2	112.3	93.6	-176.5	0	0	0	0	114.4
592	C	24.3	Very low	27.9	Very low	110 Å²	110	139.9 Å²	139.9	74%	0.743	77%	0.765	S	S	*	*			trans	-77.8	154.3	176.8	-47.8	0	0	0	0	113
593	N	24.8	Very low	28.4	Very low	157 Å²	157	141.8 Å²	141.8	84%	0.84	76%	0.758	S	S	*	*				178.3	144.9	126.2	-94.4	-28.7	0	0	0	114.3
594	K	24.9	Very low	29	Very low	194 Å²	194	142.8 Å²	142.8	84%	0.843	75%	0.749	S	S	*	*			trans	67.1	115.2	173.4	-57.2	178.3	178.8	-175.6	0	114.8
595	I	24.2	Very low	29.6	Very low	166 Å²	166	136.5 Å²	136.5	85%	0.851	73%	0.733	S	S	*	*			cis	72.4	90.1	40.9	-48.8	174.5	0	0	0	114
596	S	25	Very low	29.9	Very low	109 Å²	109	134.8 Å²	134.8	76%	0.762	72%	0.724	S	S	*	*			trans	-179	153.3	139.7	54.5	0	0	0	0	112
597	S	31.4	Very low	30.5	Very low	119 Å²	119	132 Å²	132	83%	0.832	71%	0.706	S	S	*	*			trans	67.3	112	173.8	64.9	0	0	0	0	118.8
598	F	28.7	Very low	31	Very low	192 Å²	192	131.7 Å²	131.7	84%	0.842	70%	0.703	S	S	*	*			trans	-138.8	39.1	-177	-169.5	-99	0	0	0	111
599	E	35.8	Very low	31.5	Very low	150 Å²	150	128.6 Å²	128.6	70%	0.701	69%	0.687	S	S	*	*			trans	-108.8	-25.9	-165.9	-129.9	99.3	-153.3	0	0	115.3
600	D	36	Very low	31.9	Very low	147 Å²	147	126.7 Å²	126.7	79%	0.786	68%	0.682	S	S	*	*	S	Bend	trans	-89	-17.1	-167.8	-79.8	-35.3	0	0	0	115.9
601	L	35.9	Very low	32.1	Very low	103 Å²	103	127.5 Å²	127.5	54%	0.539	68%	0.679	S	S	.	*	H	α-helix	trans	-79.7	-34.6	-172.1	-158.1	69.5	0	0	0	112.9	N603 R604 V605 E665	L601-N603 VanDerWaalsContact C-N 3.29Å; L601-N603 PolarHBondContact O-N 3.45Å; L601-R604 PolarHBondContact O-N 2.81Å; L601-V605 PolarHBondContact O-N 2.83Å; L601-E665 WeakPolarHBondContact CD2-OE2 3.31Å
602	T	38.7	Very low	32.2	Very low	81 Å²	81	127.9 Å²	127.9	50%	0.497	68%	0.682	S	S	.	*	H	α-helix	trans	-59.9	-37.4	-177.9	-45.1	0	0	0	0	112.4	R604 N606	T602-R604 VanDerWaalsContact C-N 3.33Å; T602-R604 PolarHBondContact O-N 3.27Å; T602-N606 PolarHBondContact O-N 2.81Å; T602-N606 PolarHBondContact O-ND2 2.9Å
603	N	35.3	Very low	32.4	Very low	116 Å²	116	130.9 Å²	130.9	62%	0.62	69%	0.685	S	S	*	*	H	α-helix	trans	-72.6	-25	-177.5	-67	-30.4	0	0	0	113.2	L601	L601-N603 VanDerWaalsContact C-N 3.29Å; L601-N603 PolarHBondContact O-N 3.45Å
604	R	36.4	Very low	32.6	Very low	195 Å²	195	133.8 Å²	133.8	74%	0.736	69%	0.686	S	S	*	*	H	α-helix	trans	-89.2	-27.6	-175.7	-151.2	172.2	-173.5	-175.1	0.9	113.3	L601 T602	L601-R604 PolarHBondContact O-N 2.81Å; T602-R604 VanDerWaalsContact C-N 3.33Å; T602-R604 PolarHBondContact O-N 3.27Å
605	V	37.3	Very low	32.8	Very low	74 Å²	74	131 Å²	131	45%	0.448	68%	0.68	S	S	.	*	H	α-helix	trans	-73	-39.1	172.6	178.5	0	0	0	0	110.7	L601 S607 I608 I609	L601-V605 PolarHBondContact O-N 2.83Å; V605-S607 VanDerWaalsContact C-N 3.26Å; V605-S607 PolarHBondContact O-N 2.93Å; V605-I608 PolarHBondContact O-N 3.29Å; V605-I608 VanDerWaalsContact O-N 3.16Å; V605-I609 HydrophobicContact CG1-CD1 3.87Å; V605-I609 PolarHBondContact O-N 3.37Å
606	N	34.4	Very low	33.3	Very low	86 Å²	86	131.5 Å²	131.5	46%	0.46	68%	0.679	S	S	.	*	H	α-helix	trans	-64.7	-26.3	175.6	-70	-10.6	0	0	0	113.4	T602 N610	T602-N606 PolarHBondContact O-N 2.81Å; T602-N606 PolarHBondContact O-ND2 2.9Å; N606-N610 PolarHBondContact O-ND2 3Å
607	S	36.8	Very low	33.6	Very low	64 Å²	64	133.6 Å²	133.6	45%	0.448	68%	0.681	S	S	.	*	H	α-helix	trans	-71.6	-29.8	174.1	-175.8	0	0	0	0	113.4	V605	V605-S607 VanDerWaalsContact C-N 3.26Å; V605-S607 PolarHBondContact O-N 2.93Å
608	I	34.6	Very low	33.5	Very low	133 Å²	133	134.6 Å²	134.6	68%	0.682	68%	0.678	S	S	*	*	H	α-helix	trans	-87.1	-20.4	-176.2	-64.5	170	0	0	0	111.3	V605	V605-I608 PolarHBondContact O-N 3.29Å; V605-I608 VanDerWaalsContact O-N 3.16Å
609	I	36.4	Very low	33.5	Very low	112 Å²	112	131.5 Å²	131.5	57%	0.574	68%	0.675	S	S	*	*	H	α-helix	trans	-88.5	-18.9	179.7	-66.1	174.5	0	0	0	112.1	V605	V605-I609 HydrophobicContact CG1-CD1 3.87Å; V605-I609 PolarHBondContact O-N 3.37Å
610	N	33.7	Very low	33.1	Very low	116 Å²	116	130.8 Å²	130.8	62%	0.62	67%	0.674	S	S	*	*	S	Bend	trans	-100.8	-5.7	-175.9	-71.3	-5.9	0	0	0	115.4	N606 T612	N606-N610 PolarHBondContact O-ND2 3Å; N610-T612 VanDerWaalsContact C-N 3.32Å; N610-T612 PolarHBondContact O-N 3.07Å
611	D	31.7	Very low	32.7	Very low	134 Å²	134	128.6 Å²	128.6	72%	0.717	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	14.8	-174.5	-83.7	-11.9	0	0	0	114.7
612	T	29.8	Very low	32.5	Very low	128 Å²	128	130.7 Å²	130.7	79%	0.785	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	34.9	176.2	58.9	0	0	0	0	114.4	N610	N610-T612 VanDerWaalsContact C-N 3.32Å; N610-T612 PolarHBondContact O-N 3.07Å
613	E	27.4	Very low	32	Very low	173 Å²	173	133.9 Å²	133.9	81%	0.808	70%	0.696	S	S	*	*			trans	-153.3	78.2	169.8	-132.6	169.8	-135	0	0	113.1
614	Y	30.1	Very low	32	Very low	217 Å²	217	133.6 Å²	133.6	85%	0.851	70%	0.703	S	S	*	*			trans	-134.8	102.9	162.5	-111.4	-82	0	0	0	112.4
615	N	28.8	Very low	31.7	Very low	136 Å²	136	131.3 Å²	131.3	73%	0.727	71%	0.705	S	S	*	*			trans	-61.1	135.2	164.5	-78	-60.6	0	0	0	110.4
616	H	34.6	Very low	31.6	Very low	176 Å²	176	133.6 Å²	133.6	82%	0.815	72%	0.715	S	S	*	*			trans	-148.7	120.1	142.1	-94.4	-61.8	0	0	0	111.1
617	N	32.6	Very low	31.5	Very low	153 Å²	153	135.5 Å²	135.5	82%	0.818	73%	0.726	S	S	*	*			trans	-77.9	155.6	175.9	-80.1	-44.2	0	0	0	112.1
618	N	29.1	Very low	31.3	Very low	141 Å²	141	138.9 Å²	138.9	75%	0.754	74%	0.738	S	S	*	*			trans	-47.7	156.1	177.2	-60.8	-44.5	0	0	0	115.8
619	T	29	Very low	31.1	Very low	127 Å²	127	138.9 Å²	138.9	78%	0.779	74%	0.738	S	S	*	*				176.4	96.2	117.2	-66.8	0	0	0	0	107.4
620	I	27.3	Very low	30.8	Very low	135 Å²	135	141.2 Å²	141.2	69%	0.692	75%	0.752	S	S	*	*				71.5	118.5	91.2	-65.2	168.3	0	0	0	114.5
621	S	27.6	Very low	30.6	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	76%	0.763	S	S	*	*			trans	66.4	154.4	156	85	0	0	0	0	118.6
622	N	31.6	Very low	30.5	Very low	148 Å²	148	142.1 Å²	142.1	79%	0.791	77%	0.77	S	S	*	*			cis	-146.9	160.5	11.8	-128.5	-10.7	0	0	0	111.9
623	D	28.2	Very low	30.4	Very low	147 Å²	147	141.1 Å²	141.1	79%	0.786	76%	0.764	S	S	*	*			trans	-63.1	145.9	175.5	-59.4	-69	0	0	0	113.4
624	S	34.1	Very low	30.5	Very low	111 Å²	111	138.9 Å²	138.9	78%	0.776	76%	0.757	S	S	*	*				171.6	120.3	110.7	41.7	0	0	0	0	114
625	N	31.1	Very low	30.5	Very low	146 Å²	146	135.2 Å²	135.2	78%	0.781	75%	0.748	S	S	*	*			trans	39.4	146.8	136.1	-76.5	8.7	0	0	0	124.8
626	D	33.9	Very low	30.6	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	74%	0.744	S	S	*	*			trans	85.3	91.4	145.1	-64.2	-29.3	0	0	0	121
627	N	32.1	Very low	30.6	Very low	127 Å²	127	132.7 Å²	132.7	68%	0.679	74%	0.74	S	S	*	*				74.5	144.2	117.7	-59.4	-41.9	0	0	0	121.6
628	N	32.8	Very low	30.4	Very low	134 Å²	134	131.8 Å²	131.8	72%	0.717	74%	0.735	S	S	*	*			trans	76.9	106.5	152.7	-63.3	-18.3	0	0	0	116.9
629	I	31.5	Very low	30.4	Very low	133 Å²	133	131.9 Å²	131.9	68%	0.682	74%	0.735	S	S	*	*				95	120.9	81.3	-80.4	165	0	0	0	110.9
630	N	28.8	Very low	30.4	Very low	162 Å²	162	132.1 Å²	132.1	87%	0.866	73%	0.731	S	S	*	*			trans	43.4	122.3	156.3	-57.2	-4.4	0	0	0	119.9
631	G	31	Very low	30.5	Very low	82 Å²	82	131 Å²	131	85%	0.845	73%	0.733	S	S	*	*			trans	-164.8	94.9	166	0	0	0	0	0	111.5
632	E	28.1	Very low	30.4	Very low	186 Å²	186	131.2 Å²	131.2	87%	0.869	73%	0.734	S	S	*	*			trans	-75.8	147.7	179.6	-99	-175	145.1	0	0	113.4
633	V	28	Very low	30.1	Very low	107 Å²	107	130.1 Å²	130.1	65%	0.648	73%	0.727	S	S	*	*			trans	78.6	143.7	135.4	166.1	0	0	0	0	119.9
634	N	29.5	Very low	30.4	Very low	126 Å²	126	131.2 Å²	131.2	67%	0.674	73%	0.727	S	S	*	*			trans	72.8	141.5	163	-76.8	-12.9	0	0	0	117.1
635	Q	29.7	Very low	30.2	Very low	140 Å²	140	132 Å²	132	65%	0.654	72%	0.721	S	S	*	*			cis	-170.6	173.4	-6.4	-131.4	167.9	30.7	0	0	110.4
636	N	31.7	Very low	30	Very low	121 Å²	121	132.1 Å²	132.1	65%	0.647	72%	0.721	S	S	*	*			trans	88.2	124.2	150.4	-60	-25.3	0	0	0	121.8
637	N	34.9	Very low	29.7	Very low	138 Å²	138	134 Å²	134	74%	0.738	73%	0.726	S	S	*	*			trans	88.2	141.4	146.6	-56.9	-17.1	0	0	0	120.4
638	L	28.1	Very low	29.7	Very low	135 Å²	135	134.5 Å²	134.5	71%	0.707	73%	0.729	S	S	*	*			cis	-175.3	136.1	-37.1	-139.5	75	0	0	0	106.7
639	L	30.2	Very low	29.5	Very low	142 Å²	142	134.4 Å²	134.4	74%	0.743	73%	0.727	S	S	*	*			trans	63.5	151.5	162.9	-53.1	168.2	0	0	0	116.1
640	D	28.9	Very low	29.3	Very low	133 Å²	133	136.1 Å²	136.1	71%	0.711	73%	0.732	S	S	*	*			cis	-155.8	144.5	-3.4	-131.8	-21.6	0	0	0	110.1
641	P	29.3	Very low	29.3	Very low	112 Å²	112	138.7 Å²	138.7	73%	0.727	74%	0.736	S	S	*	*			trans	-124.5	110.3	168.8	35	-20.4	0	0	0	112.8
642	S	25.3	Very low	29.1	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	73%	0.734	S	S	*	*			trans	-170.3	139.2	168	-96.9	0	0	0	0	118.5
643	I	25.8	Very low	29.1	Very low	126 Å²	126	135.3 Å²	135.3	65%	0.646	73%	0.725	S	S	*	*			trans	70.4	115.3	138.9	-57.7	162.4	0	0	0	119.8	I645	I643-I645 HydrophobicContact CG2-CD1 3.87Å; I643-I645 HydrophobicContact CG2-CG1 4.28Å
644	H	34.3	Very low	29.1	Very low	170 Å²	170	133.9 Å²	133.9	79%	0.787	72%	0.717	S	S	*	*				-175.5	105.7	113.3	-98.1	-77.4	0	0	0	107.6
645	I	30	Very low	29.1	Very low	127 Å²	127	134.6 Å²	134.6	65%	0.651	72%	0.721	S	S	*	*				67.5	98.9	87.2	-65.3	170.7	0	0	0	110.4	I643	I643-I645 HydrophobicContact CG2-CD1 3.87Å; I643-I645 HydrophobicContact CG2-CG1 4.28Å
646	L	25.5	Very low	29	Very low	149 Å²	149	134.3 Å²	134.3	78%	0.78	72%	0.723	S	S	*	*				86.9	148.3	73.6	-161.6	77.9	0	0	0	112.1
647	E	28.9	Very low	29	Very low	162 Å²	162	138.1 Å²	138.1	76%	0.757	73%	0.734	S	S	*	*			trans	78.7	133.1	177.7	-54	171.7	175.5	0	0	113.2
648	D	31.9	Very low	28.6	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	74%	0.739	S	S	*	*			cis	-132.4	141.4	8.8	-86	-47.5	0	0	0	111.8
649	L	28.7	Very low	28.6	Very low	132 Å²	132	140.2 Å²	140.2	69%	0.691	74%	0.74	S	S	*	*				73.8	93.8	70.9	-112.5	148.2	0	0	0	115.9
650	Q	26.1	Very low	28.4	Very low	169 Å²	169	138.2 Å²	138.2	79%	0.79	74%	0.738	S	S	*	*			trans	44.4	109.6	145.8	-60.8	176.9	-6.8	0	0	120
651	K	29.8	Very low	28.2	Very low	217 Å²	217	137.5 Å²	137.5	94%	0.943	74%	0.743	S	S	*	*				-163.9	147	119.6	-106	150.5	-169	170.6	0	114.4
652	S	25.3	Very low	28	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	74%	0.741	S	S	*	*			trans	-94	144	-176.7	53.2	0	0	0	0	113.5
653	A	28.1	Very low	28.1	Very low	83 Å²	83	136.9 Å²	136.9	69%	0.686	73%	0.731	S	S	*	*			trans	167.4	102.4	141.4	0	0	0	0	0	108.9
654	T	28.1	Very low	28.2	Very low	77 Å²	77	138 Å²	138	47%	0.472	73%	0.731	S	S	.	*				61.3	109.9	88.8	59.4	0	0	0	0	115
655	N	30.1	Very low	27.9	Very low	141 Å²	141	135.5 Å²	135.5	75%	0.754	72%	0.719	S	S	*	*				173	105.4	119.2	-79.4	-7.9	0	0	0	106.9
656	D	28.7	Very low	27.8	Very low	134 Å²	134	134 Å²	134	72%	0.717	71%	0.712	S	S	*	*				74.6	103.7	80.1	-72.8	-8.8	0	0	0	113.1
657	K	31.3	Very low	28.1	Very low	200 Å²	200	131.7 Å²	131.7	87%	0.87	70%	0.697	S	S	*	*			trans	-159.3	114.9	138.4	-109.2	170.3	-175.2	-175.1	0	109.9
658	Q	27.2	Very low	28.2	Very low	182 Å²	182	128 Å²	128	85%	0.85	68%	0.683	S	S	*	*			trans	-79.1	173.1	168	-64.3	174.6	-88.1	0	0	109.8
659	D	26.6	Very low	27.9	Very low	135 Å²	135	128.5 Å²	128.5	72%	0.722	69%	0.686	S	S	*	*			trans	119.1	132.3	161.3	-62.4	-21.8	0	0	0	114.1
660	S	25.4	Very low	27.9	Very low	101 Å²	101	129.7 Å²	129.7	71%	0.706	69%	0.691	S	S	*	*			cis	-161.1	85.8	-15.5	57.4	0	0	0	0	109.7	I662	S660-I662 PolarHBondContact O-N 3.18Å
661	S	26	Very low	27.9	Very low	117 Å²	117	129 Å²	129	82%	0.818	69%	0.693	S	S	*	*			trans	-96.2	87.9	-177.7	37.1	0	0	0	0	112.3	S663	S661-S663 PolarHBondContact O-N 3.37Å
662	I	25.1	Very low	27.9	Very low	131 Å²	131	125.8 Å²	125.8	67%	0.672	68%	0.684	S	S	*	*			trans	-84.6	87.9	172.8	-63.7	178.6	0	0	0	109.5	S660 F664	S660-I662 PolarHBondContact O-N 3.18Å; I662-F664 HydrophobicContact CG2-CD2 3.65Å; I662-F664 HydrophobicContact CG2-CE2 3.37Å; I662-F664 HydrophobicContact CG2-CZ 4.3Å
663	S	26.2	Very low	27.8	Very low	72 Å²	72	128.2 Å²	128.2	50%	0.503	69%	0.685	S	S	.	*			trans	-94.2	117.3	166.2	50.9	0	0	0	0	110.5	S661	S661-S663 PolarHBondContact O-N 3.37Å
664	F	28.3	Very low	27.7	Very low	149 Å²	149	133 Å²	133	65%	0.654	69%	0.693	S	S	*	*			trans	-95.6	111.6	170.5	-83.5	-73.7	0	0	0	110.7	I662 I817	I662-F664 HydrophobicContact CG2-CD2 3.65Å; I662-F664 HydrophobicContact CG2-CE2 3.37Å; I662-F664 HydrophobicContact CG2-CZ 4.3Å; F664-I817 WeakPolarHBondContact O-CD1 3.49Å
665	E	28.3	Very low	27.7	Very low	117 Å²	117	134.8 Å²	134.8	55%	0.547	71%	0.709	S	S	.	*			trans	-118.6	122.5	178.1	-168	156.5	-119.1	0	0	107.6	L601	L601-E665 WeakPolarHBondContact CD2-OE2 3.31Å
666	L	28.4	Very low	27.4	Very low	95 Å²	95	137 Å²	137	50%	0.497	72%	0.715	S	S	.	*			trans	-133.7	45.5	-165.9	-115.2	177.1	0	0	0	112.8	Y721 Q732	L666-Y721 PolarHBondContact N-OH 2.9Å; L666-Q732 VanDerWaalsContact C-OE1 3.3Å; L666-Q732 PolarHBondContact O-OE1 2.99Å; L666-Q732 VanDerWaalsContact O-OE1 3.07Å
667	H	31.7	Very low	27.5	Very low	102 Å²	102	139.4 Å²	139.4	47%	0.472	72%	0.722	S	S	.	*			trans	-88.3	126.9	177.4	-144.1	-32.1	0	0	0	112.1	Q732	H667-Q732 VanDerWaalsContact CA-OE1 3.25Å; H667-Q732 PolarHBondContact CD2-NE2 3.16Å; H667-Q732 WeakPolarHBondContact NE2-CG 3.36Å
668	N	29.9	Very low	27.4	Very low	84 Å²	84	134.5 Å²	134.5	45%	0.449	71%	0.713	S	S	.	*			trans	-48.8	141.4	165.2	-69.5	-7.4	0	0	0	112.2	G733	N668-G733 WeakPolarHBondContact ND2-CA 3.38Å
669	N	27.5	Very low	27.3	Very low	147 Å²	147	133.7 Å²	133.7	79%	0.786	71%	0.713	S	S	*	*				-172.5	115.3	118.2	-89.1	-24.6	0	0	0	111
670	I	28.3	Very low	27.4	Very low	156 Å²	156	135 Å²	135	80%	0.8	72%	0.717	S	S	*	*			trans	-118.5	102.4	159.6	-64.5	-179.2	0	0	0	107.4	I672	I670-I672 HydrophobicContact CG2-CG1 4.12Å; I670-I672 PolarHBondContact O-N 3.48Å
671	N	25.4	Very low	27.4	Very low	155 Å²	155	138 Å²	138	83%	0.829	72%	0.72	S	S	*	*			trans	-64.9	120.4	157.7	-78.2	-30.7	0	0	0	107.8
672	I	29	Very low	27.5	Very low	149 Å²	149	141 Å²	141	76%	0.764	73%	0.726	S	S	*	*			trans	-92.1	115.9	158.3	-65.2	-178.5	0	0	0	106.2	I670	I670-I672 HydrophobicContact CG2-CG1 4.12Å; I670-I672 PolarHBondContact O-N 3.48Å
673	M	25.1	Very low	27.6	Very low	166 Å²	166	138.8 Å²	138.8	82%	0.818	72%	0.722	S	S	*	*			trans	-53	143.8	-179.2	-75.6	179.2	59.9	0	0	112.3	S675	M673-S675 PolarHBondContact O-N 3.41Å
674	Q	24.2	Very low	27.7	Very low	182 Å²	182	142 Å²	142	85%	0.85	73%	0.733	S	S	*	*			trans	-62.7	122.1	153.2	-67.5	165.4	-43.3	0	0	108.1
675	S	28.5	Very low	27.7	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	74%	0.74	S	S	*	*			trans	-101.9	108.2	154.7	55.6	0	0	0	0	106.9	M673	M673-S675 PolarHBondContact O-N 3.41Å
676	E	24.5	Very low	27.6	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	76%	0.755	S	S	*	*			trans	-64.7	130.1	168.9	-58	176.5	133.2	0	0	109.1
677	E	30.8	Very low	27.7	Very low	184 Å²	184	146.2 Å²	146.2	86%	0.86	77%	0.771	S	S	*	*			trans	-159.6	124.9	151.3	-122.9	168.4	-171.6	0	0	111.7
678	S	29.1	Very low	27.5	Very low	98 Å²	98	147.5 Å²	147.5	69%	0.685	79%	0.786	S	S	*	*			trans	42.4	110.1	163.6	54.5	0	0	0	0	118.5
679	L	24.9	Very low	27.4	Very low	165 Å²	165	148.5 Å²	148.5	86%	0.864	80%	0.8	S	S	*	*				49.3	104.1	84.7	-65.2	169.9	0	0	0	113.4
680	M	28.4	Very low	27.4	Very low	162 Å²	162	146.6 Å²	146.6	80%	0.798	80%	0.797	S	S	*	*				-164.2	145.5	88.5	-158.1	64.6	-179.5	0	0	110.4
681	E	25.4	Very low	27.3	Very low	165 Å²	165	143.6 Å²	143.6	77%	0.771	79%	0.791	S	S	*	*			trans	-61.5	150.4	167	-59.6	159	133.3	0	0	110.6
682	L	29.5	Very low	27.5	Very low	178 Å²	178	143 Å²	143	93%	0.932	79%	0.787	S	S	*	*				-164.6	140.9	124.3	-101.4	163.8	0	0	0	108.8
683	S	26	Very low	27.5	Very low	86 Å²	86	142.4 Å²	142.4	60%	0.601	78%	0.784	S	S	*	*			trans	-114.1	171.6	-156.5	59.8	0	0	0	0	113.4
684	D	27.6	Very low	27.7	Very low	138 Å²	138	141.3 Å²	141.3	74%	0.738	78%	0.782	S	S	*	*			trans	64.9	126.9	153.7	-44.8	-44.2	0	0	0	119.3
685	I	30	Very low	27.8	Very low	155 Å²	155	136.1 Å²	136.1	80%	0.795	78%	0.777	S	S	*	*				173.9	120.6	93.4	-81.2	170.8	0	0	0	107.7
686	D	25.4	Very low	27.9	Very low	161 Å²	161	136.6 Å²	136.6	86%	0.861	78%	0.78	S	S	*	*			trans	-81.9	145.6	161.9	-86.6	-44.3	0	0	0	110
687	T	30.8	Very low	28	Very low	135 Å²	135	134.9 Å²	134.9	83%	0.828	78%	0.783	S	S	*	*			trans	-161.9	142.6	139.4	1.2	0	0	0	0	113.2
688	T	27.9	Very low	27.8	Very low	128 Å²	128	130.7 Å²	130.7	79%	0.785	77%	0.774	S	S	*	*			trans	-95.3	155.1	-179.8	47.1	0	0	0	0	111.7
689	S	27.4	Very low	27.6	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	79%	0.786	S	S	*	*				163.3	143.1	121.3	52.7	0	0	0	0	113.9
690	S	27.4	Very low	27.7	Very low	106 Å²	106	136.2 Å²	136.2	74%	0.741	78%	0.784	S	S	*	*			trans	39.6	143.7	143.1	60.7	0	0	0	0	122.5
691	S	27.1	Very low	27.6	Very low	94 Å²	94	134.4 Å²	134.4	66%	0.657	78%	0.776	S	S	*	*			cis	-178.6	179	-7	53.6	0	0	0	0	109.6
692	L	28.6	Very low	27.6	Very low	142 Å²	142	132.5 Å²	132.5	74%	0.743	78%	0.778	S	S	*	*			trans	77.3	106.4	154.6	-64.9	172	0	0	0	120.5
693	L	28.4	Very low	27.4	Very low	136 Å²	136	128.7 Å²	128.7	71%	0.712	77%	0.767	S	S	*	*				101.7	126.1	122.8	-69.7	167.4	0	0	0	121.3
694	N	29.4	Very low	27.5	Very low	144 Å²	144	132.6 Å²	132.6	77%	0.77	78%	0.78	S	S	*	*			trans	80.6	74.2	144.3	-60.9	-12.2	0	0	0	120.2
695	G	27.6	Very low	27.6	Very low	73 Å²	73	134.3 Å²	134.3	75%	0.753	78%	0.783	S	S	*	*				76.1	101	94.3	0	0	0	0	0	118.8
696	S	29.3	Very low	27.4	Very low	125 Å²	125	135.8 Å²	135.8	87%	0.874	79%	0.787	S	S	*	*			trans	-155	136	148.1	-73.2	0	0	0	0	109.3	S698	S696-S698 PolarHBondContact O-N 3Å
697	T	26.3	Very low	27.6	Very low	151 Å²	151	137.8 Å²	137.8	93%	0.926	79%	0.788	S	S	*	*			trans	-77.9	116.1	-168.7	35.1	0	0	0	0	113.1
698	S	28	Very low	27.4	Very low	96 Å²	96	140.9 Å²	140.9	67%	0.671	79%	0.79	S	S	*	*			trans	-138.1	136.1	163.5	174.1	0	0	0	0	107.3	S696 K700	S696-S698 PolarHBondContact O-N 3Å; S698-K700 PolarHBondContact O-N 3.27Å
699	M	24.9	Very low	27.4	Very low	192 Å²	192	142.8 Å²	142.8	95%	0.946	79%	0.79	S	S	*	*			trans	-66	87.4	168.2	-79.3	-178.7	67.6	0	0	108.6	I701	M699-I701 PolarHBondContact O-N 2.68Å
700	K	27	Very low	27.1	Very low	187 Å²	187	143.7 Å²	143.7	81%	0.813	80%	0.795	S	S	*	*			trans	-69.4	113.5	171.2	-89.2	-174.7	172.2	-177.8	0	108.1	S698	S698-K700 PolarHBondContact O-N 3.27Å
701	I	26.2	Very low	27.3	Very low	124 Å²	124	144.9 Å²	144.9	64%	0.636	79%	0.792	S	S	*	*			trans	-37.9	135.1	153.4	-61.1	159	0	0	0	108.3	M699 S703	M699-I701 PolarHBondContact O-N 2.68Å; I701-S703 PolarHBondContact O-N 2.95Å
702	P	24.6	Very low	27.4	Very low	126 Å²	126	149 Å²	149	82%	0.818	80%	0.798	S	S	*	*			trans	-67.4	88.3	168.7	28.9	-33	0	0	0	108.6	L704	P702-L704 PolarHBondContact O-N 2.99Å
703	S	25.5	Very low	27.5	Very low	98 Å²	98	148.1 Å²	148.1	69%	0.685	80%	0.803	S	S	*	*			trans	-71.3	76.1	165.2	56.3	0	0	0	0	108.1	I701 E705	I701-S703 PolarHBondContact O-N 2.95Å; S703-E705 PolarHBondContact O-N 3.37Å
704	L	29.4	Very low	28.2	Very low	168 Å²	168	148 Å²	148	88%	0.88	80%	0.797	S	S	*	*			trans	-67.1	129.6	168.4	-162.7	72.2	0	0	0	107.9	P702	P702-L704 PolarHBondContact O-N 2.99Å
705	E	27.9	Very low	29.3	Very low	174 Å²	174	144.3 Å²	144.3	81%	0.813	78%	0.782	S	S	*	*			trans	-71.5	165.9	-158.5	-65.8	162.9	138.8	0	0	113.7	S703 K707	S703-E705 PolarHBondContact O-N 3.37Å; E705-K707 VanDerWaalsContact C-N 3.31Å; E705-K707 PolarHBondContact O-N 2.94Å
706	Q	26.9	Very low	31.2	Very low	185 Å²	185	145.1 Å²	145.1	86%	0.864	77%	0.765	S	S	*	*			trans	-67.5	76.9	-176.4	-62.7	175.6	-2.8	0	0	112.9	K708	Q706-K708 PolarHBondContact O-N 3.21Å
707	K	29.5	Very low	33.6	Very low	204 Å²	204	143.7 Å²	143.7	89%	0.887	75%	0.745	S	S	*	*			trans	-80.9	103.6	155	-83.8	-169.8	173.1	-177.4	0	109.6	E705 E709	E705-K707 VanDerWaalsContact C-N 3.31Å; E705-K707 PolarHBondContact O-N 2.94Å; K707-E709 PolarHBondContact O-N 3.2Å
708	K	26.3	Very low	36.5	Very low	199 Å²	199	136.5 Å²	136.5	87%	0.865	70%	0.701	S	S	*	*			trans	-64.6	90.3	174.6	-68.8	174.8	178.9	172.2	0	110.4	Q706	Q706-K708 PolarHBondContact O-N 3.21Å
709	E	26.9	Very low	39.3	Very low	168 Å²	168	133 Å²	133	79%	0.785	67%	0.673	S	S	*	*			trans	-138.9	109.3	153.9	-112.4	175.8	-158.6	0	0	109.6	K707 I711	K707-E709 PolarHBondContact O-N 3.2Å; E709-I711 VanDerWaalsContact C-N 3.27Å; E709-I711 PolarHBondContact O-N 2.97Å
710	C	23.1	Very low	42.4	Very low	126 Å²	126	123.8 Å²	123.8	85%	0.851	63%	0.628	S	S	*	*			trans	-72.7	90.2	165.8	-175.5	0	0	0	0	106.8	K712	C710-K712 PolarHBondContact O-N 3.21Å
711	I	30	Very low	45.5	Very low	131 Å²	131	115.8 Å²	115.8	67%	0.672	59%	0.593	S	S	*	*			trans	-55.3	105	174.6	-60.9	176.1	0	0	0	107.3	E709 S713	E709-I711 VanDerWaalsContact C-N 3.27Å; E709-I711 PolarHBondContact O-N 2.97Å; I711-S713 PolarHBondContact O-N 3.49Å
712	K	30.6	Very low	48.6	Very low	181 Å²	181	109.9 Å²	109.9	79%	0.787	56%	0.563	S	S	*	*			trans	-49.1	130.5	170.5	-68.2	176.5	178.3	176.1	0	106.9	C710 K714	C710-K712 PolarHBondContact O-N 3.21Å; K712-K714 PolarHBondContact O-N 3.03Å
713	S	29.7	Very low	51.7	Low	122 Å²	122	105.8 Å²	105.8	85%	0.853	53%	0.534	S	S	*	.			trans	-53.8	91.5	-171.2	51.8	0	0	0	0	112.3	I711 S715	I711-S713 PolarHBondContact O-N 3.49Å; S713-S715 PolarHBondContact O-N 2.83Å
714	K	44.2	Very low	54.4	Low	133 Å²	133	104.4 Å²	104.4	58%	0.578	52%	0.524	S	S	*	.			trans	-63.2	118.3	171	-76	-172.2	174.3	-173.5	0	107	K712 F716	K712-K714 PolarHBondContact O-N 3.03Å; K714-F716 WeakPolarHBondContact O-CD2 3.4Å; K714-F716 PolarHBondContact O-N 3.28Å; K714-F716 VanDerWaalsContact O-N 3.12Å
715	S	52.2	Low	57.1	Low	67 Å²	67	99.8 Å²	99.8	47%	0.469	51%	0.51	S	S	.	.			trans	-66.8	111.3	171.5	42.3	0	0	0	0	108.3	S713 Q717 N734	S713-S715 PolarHBondContact O-N 2.83Å; S715-Q717 PolarHBondContact O-N 3.48Å; S715-N734 VanDerWaalsContact O-CB 3.25Å; S715-N734 WeakPolarHBondContact O-CB 3.33Å; S715-N734 PolarHBondContact O-ND2 2.88Å
716	F	66.5	Low	60	Low	90 Å²	90	92.6 Å²	92.6	40%	0.395	48%	0.477	S	S	.	.			trans	-73.6	44	172.5	-65.8	-74.3	0	0	0	111.5	K714 D737 Q821 F822	K714-F716 WeakPolarHBondContact O-CD2 3.4Å; K714-F716 PolarHBondContact O-N 3.28Å; K714-F716 VanDerWaalsContact O-N 3.12Å; F716-D737 HydrophobicContact CD1-CB 4.42Å; F716-D737 WeakPolarHBondContact CD1-OD2 3.4Å; F716-Q821 WeakPolarHBondContact O-CA 3.32Å; F716-F822 HydrophobicContact CB-CB 4.34Å; F716-F822 HydrophobicContact CD1-CD1 4.24Å; F716-F822 PolarHBondContact O-N 3.01Å
717	Q	80.6	Confident	63	Low	95 Å²	95	85.2 Å²	85.2	44%	0.444	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	138.9	-173.5	-66.5	-179.7	-0.6	0	0	110.5	S715 N734 N820 Q821	S715-Q717 PolarHBondContact O-N 3.48Å; Q717-N734 PolarHBondContact O-N 3.29Å; Q717-N734 VanDerWaalsContact O-N 3.11Å; Q717-N820 VanDerWaalsContact CA-O 3.23Å; Q717-N820 WeakPolarHBondContact CA-O 3.39Å; Q717-Q821 HydrophobicContact CG-CB 4.25Å; Q717-Q821 HydrophobicContact CG-CG 4.33Å
718	C	86	Confident	65.8	Low	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	149.9	170.4	74.6	0	0	0	0	110.7	Q732 C738 N820	C718-Q732 CarbonylContact C-O 3.56Å; C718-Q732 VanDerWaalsContact CA-O 3.22Å; C718-Q732 WeakPolarHBondContact CA-O 3.45Å; C718-Q732 VanDerWaalsContact CB-O 3.31Å; C718-Q732 WeakPolarHBondContact CB-O 3.4Å; C718-C738 WeakPolarHBondContact SG-CB 3.37Å; C718-N820 PolarHBondContact N-O 2.86Å; C718-N820 PolarHBondContact O-N 2.83Å; C718-N820 PolarHBondContact SG-ND2 3.22Å
719	H	88.2	Confident	68.8	Low	22 Å²	22	71.1 Å²	71.1	10%	0.102	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.4	177.6	-64.4	91	0	0	0	109.3	Y721 V731 Q732 C818 S819	H719-Y721 HydrophobicContact CB-CE2 3.86Å; H719-V731 CarbonylContact O-C 3.46Å; H719-V731 WeakPolarHBondContact O-CA 3.47Å; H719-Q732 HydrophobicContact CB-CB 4.25Å; H719-Q732 PolarHBondContact N-O 3.3Å; H719-Q732 PolarHBondContact O-N 3.2Å; H719-C818 CarbonylContact C-O 3.47Å; H719-C818 WeakPolarHBondContact CA-O 3.47Å; H719-S819 PolarHBondContact CD2-OG 2.91Å; H719-S819 PolarHBondContact NE2-OG 3.47Å
720	T	90.3	Very high	71.6	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.6	175.1	-52.1	0	0	0	0	109.6	L722 I728 V731 Y752 C818 N820	T720-L722 HydrophobicContact CG2-CD2 3.55Å; T720-L722 HydrophobicContact CG2-CG 4.39Å; T720-I728 HydrophobicContact CG2-CB 4.39Å; T720-I728 HydrophobicContact CG2-CD1 4.37Å; T720-I728 HydrophobicContact CG2-CG1 3.95Å; T720-I728 HydrophobicContact CG2-CG2 3.72Å; T720-V731 HydrophobicContact CG2-CG2 4.35Å; T720-Y752 HydrophobicContact CG2-CD2 4.05Å; T720-Y752 HydrophobicContact CG2-CE2 4.01Å; T720-C818 PolarHBondContact N-O 3.4Å; T720-C818 PolarHBondContact O-N 3.45Å; T720-N820 PolarHBondContact OG1-ND2 3.44Å
721	Y	90.4	Very high	74.6	Confident	19 Å²	19	60.1 Å²	60.1	8%	0.075	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.9	177.7	-66.6	-107.8	0	0	0	108.4	L666 H719 K729 M730 Q732 I815 F816 I817	L666-Y721 PolarHBondContact N-OH 2.9Å; H719-Y721 HydrophobicContact CB-CE2 3.86Å; Y721-K729 PolarHBondContact O-N 2.97Å; Y721-M730 HydrophobicContact CD1-CE 4.2Å; Y721-M730 HydrophobicContact CD2-CB 4.49Å; Y721-M730 HydrophobicContact CD2-CE 3.99Å; Y721-M730 HydrophobicContact CE1-CE 4.46Å; Y721-M730 HydrophobicContact CE2-CE 4.31Å; Y721-M730 HydrophobicContact CG-CE 3.95Å; Y721-M730 PolarHBondContact N-O 3.49Å; Y721-M730 PolarHBondContact O-N 2.91Å; Y721-Q732 HydrophobicContact CD2-CG 4.08Å; Y721-Q732 HydrophobicContact CE2-CB 4.49Å; Y721-Q732 HydrophobicContact CE2-CG 3.62Å; Y721-Q732 VanDerWaalsContact CE2-NE2 3.28Å; Y721-Q732 PolarHBondContact OH-OE1 3.34Å; Y721-I815 HydrophobicContact CD1-CG2 4.15Å; Y721-F816 WeakPolarHBondContact CA-O 3.02Å; Y721-I817 HydrophobicContact CD1-CG1 4Å; Y721-I817 HydrophobicContact CE1-CD1 4.02Å; Y721-I817 HydrophobicContact CE1-CG1 3.92Å; Y721-I817 HydrophobicContact CE1-CG2 4.12Å
722	L	92.6	Very high	77.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	143.1	-176.9	-47.1	178.5	0	0	0	110.2	T720 L726 T727 I728 Y752 F768 I815 F816	T720-L722 HydrophobicContact CG2-CD2 3.55Å; T720-L722 HydrophobicContact CG2-CG 4.39Å; L722-L726 HydrophobicContact CD1-CD2 3.93Å; L722-T727 WeakPolarHBondContact CA-O 3.28Å; L722-I728 HydrophobicContact CD2-CB 4.2Å; L722-I728 HydrophobicContact CD2-CG1 3.53Å; L722-Y752 HydrophobicContact CD1-CD1 3.84Å; L722-Y752 HydrophobicContact CD1-CD2 4.18Å; L722-Y752 HydrophobicContact CD1-CE1 4.4Å; L722-Y752 HydrophobicContact CD1-CG 3.7Å; L722-Y752 HydrophobicContact CD2-CD2 3.78Å; L722-Y752 HydrophobicContact CD2-CG 3.9Å; L722-Y752 HydrophobicContact CG-CG 4.46Å; L722-F768 HydrophobicContact CD1-CE1 3.84Å; L722-F768 HydrophobicContact CD1-CZ 3.78Å; L722-I815 CarbonylContact O-C 3.58Å; L722-I815 WeakPolarHBondContact O-CA 3.15Å; L722-I815 WeakPolarHBondContact O-CG2 3.22Å; L722-F816 HydrophobicContact CB-CB 4.16Å; L722-F816 HydrophobicContact CB-CD2 4.34Å; L722-F816 HydrophobicContact CD1-CB 4.49Å; L722-F816 PolarHBondContact N-O 3.02Å; L722-F816 PolarHBondContact O-N 3.05Å
723	N	88.9	Confident	79.6	Confident	40 Å²	40	46.5 Å²	46.5	21%	0.214	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	177.6	166.5	66.3	9.4	0	0	0	111.7	A725 L726 T727 K729	N723-A725 PolarHBondContact O-N 3.36Å; N723-A725 VanDerWaalsContact O-N 3.11Å; N723-A725 WeakPolarHBondContact OD1-CA 3.32Å; N723-A725 WeakPolarHBondContact OD1-CB 3.32Å; N723-A725 PolarHBondContact OD1-N 3.01Å; N723-L726 WeakPolarHBondContact O-CA 3.17Å; N723-L726 PolarHBondContact O-N 3.49Å; N723-L726 PolarHBondContact OD1-N 2.98Å; N723-L726 VanDerWaalsContact OD1-N 3.12Å; N723-T727 PolarHBondContact N-O 2.92Å; N723-T727 VanDerWaalsContact N-O 3.13Å; N723-T727 PolarHBondContact ND2-OG1 3.46Å; N723-T727 PolarHBondContact OD1-N 3.11Å; N723-T727 PolarHBondContact OD1-O 3.43Å; N723-T727 PolarHBondContact OD1-OG1 3.1Å; N723-K729 HydrophobicContact CB-CG 4.42Å
724	C	83.5	Confident	82	Confident	69 Å²	69	42 Å²	42	47%	0.466	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-21.9	172.8	-71.6	0	0	0	0	115.3	L726 Y809 N814	C724-L726 VanDerWaalsContact C-N 3.27Å; C724-Y809 PolarHBondContact SG-OH 3.5Å; C724-N814 PolarHBondContact N-O 3.28Å; C724-N814 VanDerWaalsContact SG-CB 3.59Å; C724-N814 PolarHBondContact SG-O 3.22Å
725	A	85.2	Confident	83.7	Confident	71 Å²	71	38 Å²	38	59%	0.587	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	5	174.7	0	0	0	0	0	113.3	N723 T727	N723-A725 PolarHBondContact O-N 3.36Å; N723-A725 VanDerWaalsContact O-N 3.11Å; N723-A725 WeakPolarHBondContact OD1-CA 3.32Å; N723-A725 WeakPolarHBondContact OD1-CB 3.32Å; N723-A725 PolarHBondContact OD1-N 3.01Å; A725-T727 HydrophobicContact CB-CG2 4.3Å; A725-T727 PolarHBondContact O-N 2.98Å
726	L	88.5	Confident	84.9	Confident	23 Å²	23	37.4 Å²	37.4	12%	0.12	20%	0.204	C	C	.	.			trans	57.7	27.4	-174.7	-55.6	173.9	0	0	0	113.6	L722 N723 C724 Y752 L753 F768 F816	L722-L726 HydrophobicContact CD1-CD2 3.93Å; N723-L726 WeakPolarHBondContact O-CA 3.17Å; N723-L726 PolarHBondContact O-N 3.49Å; N723-L726 PolarHBondContact OD1-N 2.98Å; N723-L726 VanDerWaalsContact OD1-N 3.12Å; C724-L726 VanDerWaalsContact C-N 3.27Å; L726-Y752 VanDerWaalsContact O-CB 3.3Å; L726-Y752 WeakPolarHBondContact O-CB 3.36Å; L726-Y752 PolarHBondContact O-N 2.99Å; L726-L753 HydrophobicContact CD1-CD1 4Å; L726-L753 HydrophobicContact CD1-CD2 4.08Å; L726-L753 HydrophobicContact CD1-CG 4.1Å; L726-F768 HydrophobicContact CD1-CG 4.48Å; L726-F768 HydrophobicContact CD2-CD1 3.6Å; L726-F768 HydrophobicContact CD2-CE1 3.72Å; L726-F768 HydrophobicContact CD2-CG 4.16Å; L726-F768 HydrophobicContact CD2-CZ 4.36Å; L726-F816 HydrophobicContact CD2-CD2 3.65Å; L726-F816 HydrophobicContact CD2-CE2 3.52Å; L726-F816 HydrophobicContact CD2-CG 4.35Å; L726-F816 HydrophobicContact CD2-CZ 4.15Å
727	T	89.3	Confident	85.4	Confident	30 Å²	30	34.6 Å²	34.6	18%	0.184	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-87.9	141.5	168	78.3	0	0	0	0	110.2	L722 N723 A725 K729 Y750	L722-T727 WeakPolarHBondContact CA-O 3.28Å; N723-T727 PolarHBondContact N-O 2.92Å; N723-T727 VanDerWaalsContact N-O 3.13Å; N723-T727 PolarHBondContact ND2-OG1 3.46Å; N723-T727 PolarHBondContact OD1-N 3.11Å; N723-T727 PolarHBondContact OD1-O 3.43Å; N723-T727 PolarHBondContact OD1-OG1 3.1Å; A725-T727 HydrophobicContact CB-CG2 4.3Å; A725-T727 PolarHBondContact O-N 2.98Å; T727-K729 PolarHBondContact O-N 2.69Å; T727-Y750 WeakPolarHBondContact CA-O 3.42Å
728	I	89.7	Confident	85.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	116.3	-173.4	-60.3	168.2	0	0	0	108.9	T720 L722 V731 I747 V748 D749 Y750 Y752 F755	T720-I728 HydrophobicContact CG2-CB 4.39Å; T720-I728 HydrophobicContact CG2-CD1 4.37Å; T720-I728 HydrophobicContact CG2-CG1 3.95Å; T720-I728 HydrophobicContact CG2-CG2 3.72Å; L722-I728 HydrophobicContact CD2-CB 4.2Å; L722-I728 HydrophobicContact CD2-CG1 3.53Å; I728-V731 HydrophobicContact CG2-CG2 3.57Å; I728-I747 HydrophobicContact CB-CG2 4.37Å; I728-I747 HydrophobicContact CD1-CG2 3.34Å; I728-I747 HydrophobicContact CG1-CG2 4.41Å; I728-I747 HydrophobicContact CG2-CG2 4.01Å; I728-V748 WeakPolarHBondContact O-CA 3.29Å; I728-D749 PolarHBondContact O-N 3.35Å; I728-Y750 PolarHBondContact N-O 3.45Å; I728-Y752 HydrophobicContact CD1-CD2 3.94Å; I728-Y752 HydrophobicContact CG1-CD2 4.03Å; I728-F755 HydrophobicContact CD1-CD2 4.09Å; I728-F755 HydrophobicContact CD1-CE2 3.58Å; I728-F755 HydrophobicContact CD1-CZ 4.3Å
729	K	88.6	Confident	84.8	Confident	106 Å²	106	30.1 Å²	30.1	46%	0.461	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-30.1	178	-78.5	-70.4	170.7	-158.7	0	113.4	Y721 N723 T727 D749	Y721-K729 PolarHBondContact O-N 2.97Å; N723-K729 HydrophobicContact CB-CG 4.42Å; T727-K729 PolarHBondContact O-N 2.69Å; K729-D749 IonicContact NZ-OD1 4Å; K729-D749 PolarHBondContact NZ-OD1 3.38Å; K729-D749 IonicContact NZ-OD2 2.83Å
730	M	86.6	Confident	84.2	Confident	61 Å²	61	32 Å²	32	30%	0.3	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	148.1	179.8	175.4	171.7	46.9	0	0	109.9	Y721 Q732	Y721-M730 HydrophobicContact CD1-CE 4.2Å; Y721-M730 HydrophobicContact CD2-CB 4.49Å; Y721-M730 HydrophobicContact CD2-CE 3.99Å; Y721-M730 HydrophobicContact CE1-CE 4.46Å; Y721-M730 HydrophobicContact CE2-CE 4.31Å; Y721-M730 HydrophobicContact CG-CE 3.95Å; Y721-M730 PolarHBondContact N-O 3.49Å; Y721-M730 PolarHBondContact O-N 2.91Å; M730-Q732 HydrophobicContact CG-CG 3.91Å; M730-Q732 HydrophobicContact SD-CG 4.12Å; M730-Q732 PolarHBondContact SD-NE2 3.39Å
731	V	85	Confident	83.5	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.4	171.7	-160.7	0	0	0	0	108.5	H719 T720 I728 Y735 F739 Q744 I747	H719-V731 CarbonylContact O-C 3.46Å; H719-V731 WeakPolarHBondContact O-CA 3.47Å; T720-V731 HydrophobicContact CG2-CG2 4.35Å; I728-V731 HydrophobicContact CG2-CG2 3.57Å; V731-Y735 HydrophobicContact CG1-CG 4.32Å; V731-F739 HydrophobicContact CG1-CE2 4.39Å; V731-Q744 HydrophobicContact CB-CG 4.49Å; V731-Q744 PolarHBondContact O-NE2 3.11Å; V731-I747 HydrophobicContact CG2-CB 4.37Å; V731-I747 HydrophobicContact CG2-CD1 4.49Å; V731-I747 HydrophobicContact CG2-CG2 4.04Å
732	Q	83.5	Confident	82.5	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.028	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	148.8	-174.8	-45.6	-178	-21.3	0	0	109.7	L666 H667 C718 H719 Y721 M730	L666-Q732 VanDerWaalsContact C-OE1 3.3Å; L666-Q732 PolarHBondContact O-OE1 2.99Å; L666-Q732 VanDerWaalsContact O-OE1 3.07Å; H667-Q732 VanDerWaalsContact CA-OE1 3.25Å; H667-Q732 PolarHBondContact CD2-NE2 3.16Å; H667-Q732 WeakPolarHBondContact NE2-CG 3.36Å; C718-Q732 CarbonylContact C-O 3.56Å; C718-Q732 VanDerWaalsContact CA-O 3.22Å; C718-Q732 WeakPolarHBondContact CA-O 3.45Å; C718-Q732 VanDerWaalsContact CB-O 3.31Å; C718-Q732 WeakPolarHBondContact CB-O 3.4Å; H719-Q732 HydrophobicContact CB-CB 4.25Å; H719-Q732 PolarHBondContact N-O 3.3Å; H719-Q732 PolarHBondContact O-N 3.2Å; Y721-Q732 HydrophobicContact CD2-CG 4.08Å; Y721-Q732 HydrophobicContact CE2-CB 4.49Å; Y721-Q732 HydrophobicContact CE2-CG 3.62Å; Y721-Q732 VanDerWaalsContact CE2-NE2 3.28Å; Y721-Q732 PolarHBondContact OH-OE1 3.34Å; M730-Q732 HydrophobicContact CG-CG 3.91Å; M730-Q732 HydrophobicContact SD-CG 4.12Å; M730-Q732 PolarHBondContact SD-NE2 3.39Å
733	G	82.2	Confident	81.4	Confident	20 Å²	20	43.2 Å²	43.2	21%	0.206	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.8	-156.7	-177.9	0	0	0	0	0	113.4	N668 Y735	N668-G733 WeakPolarHBondContact ND2-CA 3.38Å; G733-Y735 VanDerWaalsContact C-N 3.29Å; G733-Y735 WeakPolarHBondContact O-CD1 3.24Å; G733-Y735 PolarHBondContact O-N 3.26Å
734	N	79.4	Confident	80.6	Confident	29 Å²	29	44.9 Å²	44.9	16%	0.155	25%	0.245	C	C	.	.			trans	-84.5	70.1	-166.3	-169.9	-1.7	0	0	0	111.5	S715 Q717 T736 D737	S715-N734 VanDerWaalsContact O-CB 3.25Å; S715-N734 WeakPolarHBondContact O-CB 3.33Å; S715-N734 PolarHBondContact O-ND2 2.88Å; Q717-N734 PolarHBondContact O-N 3.29Å; Q717-N734 VanDerWaalsContact O-N 3.11Å; N734-T736 VanDerWaalsContact C-N 3.3Å; N734-T736 PolarHBondContact O-N 2.64Å; N734-T736 PolarHBondContact OD1-OG1 2.71Å; N734-D737 VanDerWaalsContact ND2-CG 3.33Å; N734-D737 PolarHBondContact ND2-OD2 3.12Å; N734-D737 PolarHBondContact O-N 3.34Å
735	Y	80.1	Confident	80	Confident	47 Å²	47	45.8 Å²	45.8	18%	0.184	25%	0.252	C	S	.	.	H	α-helix	trans	-71.4	-24.3	-177	62.2	-100.4	0	0	0	113	V731 G733 D737 C738 F739 I741 E742 Q744 I747	V731-Y735 HydrophobicContact CG1-CG 4.32Å; G733-Y735 VanDerWaalsContact C-N 3.29Å; G733-Y735 WeakPolarHBondContact O-CD1 3.24Å; G733-Y735 PolarHBondContact O-N 3.26Å; Y735-D737 VanDerWaalsContact C-N 3.27Å; Y735-D737 PolarHBondContact O-N 2.85Å; Y735-C738 PolarHBondContact O-N 2.98Å; Y735-F739 PolarHBondContact O-N 3.14Å; Y735-I741 WeakPolarHBondContact CE2-O 3.37Å; Y735-E742 WeakPolarHBondContact CE2-O 3.49Å; Y735-E742 PolarHBondContact OH-O 2.88Å; Y735-Q744 HydrophobicContact CE1-CB 4.09Å; Y735-Q744 PolarHBondContact OH-N 3.08Å; Y735-I747 HydrophobicContact CD2-CD1 4.22Å
736	T	78.6	Confident	79.3	Confident	56 Å²	56	43.8 Å²	43.8	34%	0.344	23%	0.232	S	C	.	.	H	α-helix	trans	-58.4	-40.5	175.3	63.9	0	0	0	0	110.9	N734 D740 I741 R801	N734-T736 VanDerWaalsContact C-N 3.3Å; N734-T736 PolarHBondContact O-N 2.64Å; N734-T736 PolarHBondContact OD1-OG1 2.71Å; T736-D740 WeakPolarHBondContact O-CA 3.38Å; T736-D740 PolarHBondContact O-N 3.38Å; T736-I741 WeakPolarHBondContact CG2-O 3.37Å; T736-R801 PolarHBondContact O-NH1 2.98Å
737	D	75.3	Confident	78.8	Confident	31 Å²	31	42.7 Å²	42.7	17%	0.166	23%	0.226	C	C	.	.	H	α-helix	trans	-74.2	-34.4	179.2	-72	-1.5	0	0	0	112.3	F716 N734 Y735 R801 F822	F716-D737 HydrophobicContact CD1-CB 4.42Å; F716-D737 WeakPolarHBondContact CD1-OD2 3.4Å; N734-D737 VanDerWaalsContact ND2-CG 3.33Å; N734-D737 PolarHBondContact ND2-OD2 3.12Å; N734-D737 PolarHBondContact O-N 3.34Å; Y735-D737 VanDerWaalsContact C-N 3.27Å; Y735-D737 PolarHBondContact O-N 2.85Å; D737-R801 VanDerWaalsContact C-NH1 3.31Å; D737-R801 WeakPolarHBondContact O-CD 3.49Å; D737-R801 PolarHBondContact O-NH1 3.32Å; D737-F822 VanDerWaalsContact O-CD2 3.27Å; D737-F822 WeakPolarHBondContact O-CD2 3.42Å
738	C	77.5	Confident	78.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-82.1	-37.6	-178.6	-70.3	0	0	0	0	114.2	C718 Y735	C718-C738 WeakPolarHBondContact SG-CB 3.37Å; Y735-C738 PolarHBondContact O-N 2.98Å
739	F	77.7	Confident	78.2	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-117	-9	-171.2	-63.8	-77.1	0	0	0	115.2	V731 Y735 I741 I747 Y752 V785 A787	V731-F739 HydrophobicContact CG1-CE2 4.39Å; Y735-F739 PolarHBondContact O-N 3.14Å; F739-I741 HydrophobicContact CB-CD1 3.92Å; F739-I741 HydrophobicContact CB-CG1 4.36Å; F739-I741 WeakPolarHBondContact O-CG1 3.37Å; F739-I747 HydrophobicContact CB-CD1 4.14Å; F739-I747 HydrophobicContact CD2-CD1 4.3Å; F739-I747 HydrophobicContact CG-CD1 4.33Å; F739-Y752 HydrophobicContact CE1-CE2 4.31Å; F739-Y752 HydrophobicContact CZ-CE2 4.01Å; F739-V785 HydrophobicContact CD1-CG1 3.62Å; F739-V785 HydrophobicContact CE1-CG1 3.91Å; F739-A787 WeakPolarHBondContact O-CA 3.27Å
740	D	75.7	Confident	77.9	Confident	60 Å²	60	47.5 Å²	47.5	32%	0.321	25%	0.25	S	S	.	.			trans	63	44.3	-178.3	-146.4	-2.1	0	0	0	114.5	T736 A787 R801	T736-D740 WeakPolarHBondContact O-CA 3.38Å; T736-D740 PolarHBondContact O-N 3.38Å; D740-A787 HydrophobicContact CB-CB 3.46Å; D740-A787 VanDerWaalsContact CB-CB 3.46Å; D740-R801 VanDerWaalsContact CB-CZ 3.5Å; D740-R801 IonicContact OD1-CZ 2.66Å; D740-R801 IonicContact OD1-NH2 3.3Å; D740-R801 PolarHBondContact OD1-NH2 3.38Å; D740-R801 IonicContact OD2-CZ 2.63Å; D740-R801 VanDerWaalsContact OD2-CZ 3.3Å; D740-R801 IonicContact OD2-NE 3.96Å; D740-R801 PolarHBondContact OD2-NE 3.28Å; D740-R801 IonicContact OD2-NH2 3.52Å; D740-R801 PolarHBondContact OD2-NH2 2.85Å
741	I	74.4	Confident	78	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.041	25%	0.249	C	C	.	.			trans	-135.5	130.6	-171.9	-66	166	0	0	0	108.4	Y735 T736 F739 D743 D746 I747 F755 H788	Y735-I741 WeakPolarHBondContact CE2-O 3.37Å; T736-I741 WeakPolarHBondContact CG2-O 3.37Å; F739-I741 HydrophobicContact CB-CD1 3.92Å; F739-I741 HydrophobicContact CB-CG1 4.36Å; F739-I741 WeakPolarHBondContact O-CG1 3.37Å; I741-D743 VanDerWaalsContact CG2-O 3.32Å; I741-D743 WeakPolarHBondContact CG2-O 3.46Å; I741-D746 HydrophobicContact CG2-CB 3.65Å; I741-I747 HydrophobicContact CB-CD1 4.06Å; I741-I747 HydrophobicContact CB-CG1 4.29Å; I741-I747 HydrophobicContact CD1-CD1 3.72Å; I741-I747 HydrophobicContact CD1-CG1 3.55Å; I741-I747 HydrophobicContact CG1-CD1 4.49Å; I741-I747 HydrophobicContact CG1-CG1 4.5Å; I741-I747 HydrophobicContact CG2-CD1 4.03Å; I741-I747 HydrophobicContact CG2-CG1 3.84Å; I741-F755 HydrophobicContact CD1-CE1 4.14Å; I741-H788 HydrophobicContact CD1-CB 3.65Å; I741-H788 HydrophobicContact CG1-CB 4.15Å
742	E	69.7	Low	78.1	Confident	165 Å²	165	46.4 Å²	46.4	77%	0.771	25%	0.249	S	C	*	.	S	Bend	trans	-74.2	-49.4	-176	-60.1	-179.3	159.2	0	0	111.2	Y735	Y735-E742 WeakPolarHBondContact CE2-O 3.49Å; Y735-E742 PolarHBondContact OH-O 2.88Å
743	D	71	Confident	78.4	Confident	82 Å²	82	48.4 Å²	48.4	44%	0.439	26%	0.259	S	S	.	.			trans	-102.9	130	-175	-67.5	-40	0	0	0	112.8	I741 S745 D746	I741-D743 VanDerWaalsContact CG2-O 3.32Å; I741-D743 WeakPolarHBondContact CG2-O 3.46Å; D743-S745 PolarHBondContact O-N 2.84Å; D743-S745 VanDerWaalsContact O-N 3.16Å; D743-D746 WeakPolarHBondContact O-CB 3.4Å; D743-D746 PolarHBondContact O-N 3.42Å; D743-D746 VanDerWaalsContact O-N 3.1Å
744	Q	71.5	Confident	78.5	Confident	75 Å²	75	52.6 Å²	52.6	35%	0.35	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-55.2	-34.4	174.6	-173.6	-170.3	-5.4	0	0	112.4	V731 Y735 D746 I747 V748	V731-Q744 HydrophobicContact CB-CG 4.49Å; V731-Q744 PolarHBondContact O-NE2 3.11Å; Y735-Q744 HydrophobicContact CE1-CB 4.09Å; Y735-Q744 PolarHBondContact OH-N 3.08Å; Q744-D746 PolarHBondContact O-N 2.95Å; Q744-I747 PolarHBondContact O-N 3.14Å; Q744-I747 VanDerWaalsContact O-N 3.16Å; Q744-V748 HydrophobicContact CG-CG2 4.43Å; Q744-V748 PolarHBondContact O-N 2.85Å
745	S	71.4	Confident	78.8	Confident	88 Å²	88	51.4 Å²	51.4	62%	0.615	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-63.5	-21.4	-179.8	49.7	0	0	0	0	114.2	D743 I747	D743-S745 PolarHBondContact O-N 2.84Å; D743-S745 VanDerWaalsContact O-N 3.16Å; S745-I747 PolarHBondContact O-N 3.05Å
746	D	70.1	Confident	79.2	Confident	30 Å²	30	49.7 Å²	49.7	16%	0.16	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-74	-13.8	177.4	-66.6	-19.4	0	0	0	112.9	I741 D743 Q744 Y750 K790	I741-D746 HydrophobicContact CG2-CB 3.65Å; D743-D746 WeakPolarHBondContact O-CB 3.4Å; D743-D746 PolarHBondContact O-N 3.42Å; D743-D746 VanDerWaalsContact O-N 3.1Å; Q744-D746 PolarHBondContact O-N 2.95Å; D746-Y750 WeakPolarHBondContact O-CD2 3.39Å; D746-Y750 VanDerWaalsContact O-CE2 3.29Å; D746-Y750 WeakPolarHBondContact O-CE2 3.47Å; D746-K790 VanDerWaalsContact CG-CE 3.42Å; D746-K790 WeakPolarHBondContact OD1-CE 3.28Å; D746-K790 IonicContact OD1-NZ 2.66Å; D746-K790 PolarHBondContact OD1-NZ 3.29Å; D746-K790 WeakPolarHBondContact OD2-CE 3.34Å; D746-K790 IonicContact OD2-NZ 3.2Å; D746-K790 PolarHBondContact OD2-NZ 3.18Å
747	I	78.3	Confident	79.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-30.1	-174.6	-49.7	-178.3	0	0	0	111.9	I728 V731 Y735 F739 I741 Q744 S745 Y750 F755	I728-I747 HydrophobicContact CB-CG2 4.37Å; I728-I747 HydrophobicContact CD1-CG2 3.34Å; I728-I747 HydrophobicContact CG1-CG2 4.41Å; I728-I747 HydrophobicContact CG2-CG2 4.01Å; V731-I747 HydrophobicContact CG2-CB 4.37Å; V731-I747 HydrophobicContact CG2-CD1 4.49Å; V731-I747 HydrophobicContact CG2-CG2 4.04Å; Y735-I747 HydrophobicContact CD2-CD1 4.22Å; F739-I747 HydrophobicContact CB-CD1 4.14Å; F739-I747 HydrophobicContact CD2-CD1 4.3Å; F739-I747 HydrophobicContact CG-CD1 4.33Å; I741-I747 HydrophobicContact CB-CD1 4.06Å; I741-I747 HydrophobicContact CB-CG1 4.29Å; I741-I747 HydrophobicContact CD1-CD1 3.72Å; I741-I747 HydrophobicContact CD1-CG1 3.55Å; I741-I747 HydrophobicContact CG1-CD1 4.49Å; I741-I747 HydrophobicContact CG1-CG1 4.5Å; I741-I747 HydrophobicContact CG2-CD1 4.03Å; I741-I747 HydrophobicContact CG2-CG1 3.84Å; Q744-I747 PolarHBondContact O-N 3.14Å; Q744-I747 VanDerWaalsContact O-N 3.16Å; S745-I747 PolarHBondContact O-N 3.05Å; I747-Y750 WeakPolarHBondContact O-CB 3.22Å; I747-Y750 PolarHBondContact O-N 2.92Å; I747-F755 HydrophobicContact CG2-CE2 4.44Å; I747-F755 HydrophobicContact CG2-CZ 4.03Å
748	V	82.1	Confident	80.1	Confident	41 Å²	41	51.1 Å²	51.1	25%	0.248	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	142.6	-175	176.6	0	0	0	0	110.8	I728 Q744 Y750	I728-V748 WeakPolarHBondContact O-CA 3.29Å; Q744-V748 HydrophobicContact CG-CG2 4.43Å; Q744-V748 PolarHBondContact O-N 2.85Å; V748-Y750 WeakPolarHBondContact O-CD2 3.38Å; V748-Y750 PolarHBondContact O-N 2.98Å; V748-Y750 VanDerWaalsContact O-N 3.09Å
749	D	82.6	Confident	80.4	Confident	98 Å²	98	56.1 Å²	56.1	52%	0.524	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	-3.4	-174.3	-67.6	-46.9	0	0	0	117.2	I728 K729	I728-D749 PolarHBondContact O-N 3.35Å; K729-D749 IonicContact NZ-OD1 4Å; K729-D749 PolarHBondContact NZ-OD1 3.38Å; K729-D749 IonicContact NZ-OD2 2.83Å
750	Y	84.1	Confident	80.9	Confident	98 Å²	98	57.1 Å²	57.1	38%	0.384	30%	0.302	S	S	.	.	S	Bend	trans	-71.2	154.6	164.8	-73.2	-93.7	0	0	0	112.1	T727 I728 D746 I747 V748 F755	T727-Y750 WeakPolarHBondContact CA-O 3.42Å; I728-Y750 PolarHBondContact N-O 3.45Å; D746-Y750 WeakPolarHBondContact O-CD2 3.39Å; D746-Y750 VanDerWaalsContact O-CE2 3.29Å; D746-Y750 WeakPolarHBondContact O-CE2 3.47Å; I747-Y750 WeakPolarHBondContact O-CB 3.22Å; I747-Y750 PolarHBondContact O-N 2.92Å; V748-Y750 WeakPolarHBondContact O-CD2 3.38Å; V748-Y750 PolarHBondContact O-N 2.98Å; V748-Y750 VanDerWaalsContact O-N 3.09Å; Y750-F755 HydrophobicContact CG-CZ 4.33Å
751	S	88	Confident	81.5	Confident	39 Å²	39	56.8 Å²	56.8	27%	0.273	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-76.4	127.7	174.2	-173.2	0	0	0	0	110.6	L753 E754 F755	S751-L753 PolarHBondContact O-N 2.93Å; S751-L753 VanDerWaalsContact O-N 3.09Å; S751-E754 WeakPolarHBondContact O-CB 3.48Å; S751-E754 PolarHBondContact O-N 2.96Å; S751-F755 VanDerWaalsContact O-CD2 3.32Å; S751-F755 WeakPolarHBondContact O-CD2 3.43Å; S751-F755 WeakPolarHBondContact O-CE2 3.36Å
752	Y	87.9	Confident	82.1	Confident	1 Å²	1	60.9 Å²	60.9	0%	0.004	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.3	174.9	-168.6	-107.4	0	0	0	112.9	T720 L722 L726 I728 F739 E754 I756 F768 Y783 N820	T720-Y752 HydrophobicContact CG2-CD2 4.05Å; T720-Y752 HydrophobicContact CG2-CE2 4.01Å; L722-Y752 HydrophobicContact CD1-CD1 3.84Å; L722-Y752 HydrophobicContact CD1-CD2 4.18Å; L722-Y752 HydrophobicContact CD1-CE1 4.4Å; L722-Y752 HydrophobicContact CD1-CG 3.7Å; L722-Y752 HydrophobicContact CD2-CD2 3.78Å; L722-Y752 HydrophobicContact CD2-CG 3.9Å; L722-Y752 HydrophobicContact CG-CG 4.46Å; L726-Y752 VanDerWaalsContact O-CB 3.3Å; L726-Y752 WeakPolarHBondContact O-CB 3.36Å; L726-Y752 PolarHBondContact O-N 2.99Å; I728-Y752 HydrophobicContact CD1-CD2 3.94Å; I728-Y752 HydrophobicContact CG1-CD2 4.03Å; F739-Y752 HydrophobicContact CE1-CE2 4.31Å; F739-Y752 HydrophobicContact CZ-CE2 4.01Å; Y752-E754 VanDerWaalsContact C-N 3.32Å; Y752-E754 PolarHBondContact O-N 3.37Å; Y752-I756 HydrophobicContact CD1-CD1 4.13Å; Y752-I756 HydrophobicContact CE1-CD1 4.21Å; Y752-I756 WeakPolarHBondContact O-CG1 3.47Å; Y752-F768 HydrophobicContact CD1-CE2 4.18Å; Y752-F768 HydrophobicContact CD1-CZ 4.09Å; Y752-F768 HydrophobicContact CE1-CE2 4.05Å; Y752-F768 AromaticContact CE1-CZ 3.97Å; Y752-F768 HydrophobicContact CE1-CZ 3.97Å; Y752-Y783 PolarHBondContact OH-OH 2.97Å; Y752-N820 PolarHBondContact OH-OD1 3.26Å
753	L	87.8	Confident	82.9	Confident	47 Å²	47	58 Å²	58	25%	0.246	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.8	178.4	-59.5	-175.3	0	0	0	113.7	L726 S751 F755 I756 L761 I765	L726-L753 HydrophobicContact CD1-CD1 4Å; L726-L753 HydrophobicContact CD1-CD2 4.08Å; L726-L753 HydrophobicContact CD1-CG 4.1Å; S751-L753 PolarHBondContact O-N 2.93Å; S751-L753 VanDerWaalsContact O-N 3.09Å; L753-F755 VanDerWaalsContact C-N 3.33Å; L753-I756 HydrophobicContact CD2-CD1 4.03Å; L753-I756 PolarHBondContact O-N 3.43Å; L753-L761 HydrophobicContact CB-CD1 4Å; L753-L761 HydrophobicContact CD2-CD1 3.91Å; L753-L761 HydrophobicContact CG-CD1 4.37Å; L753-I765 HydrophobicContact CD1-CD1 4.21Å; L753-I765 HydrophobicContact CD1-CG1 4.24Å; L753-I765 HydrophobicContact CD2-CG1 4.07Å
754	E	85.7	Confident	83.8	Confident	108 Å²	108	54.2 Å²	54.2	51%	0.505	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.5	179.8	-174.3	162.6	-160.6	0	0	112.2	S751 Y752 I756	S751-E754 WeakPolarHBondContact O-CB 3.48Å; S751-E754 PolarHBondContact O-N 2.96Å; Y752-E754 VanDerWaalsContact C-N 3.32Å; Y752-E754 PolarHBondContact O-N 3.37Å; E754-I756 VanDerWaalsContact C-N 3.31Å; E754-I756 PolarHBondContact O-N 2.83Å
755	F	85.5	Confident	84.6	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.018	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-11.8	177.6	-55.9	-92.1	0	0	0	113.3	I728 I741 I747 Y750 S751 L753 V785 S786 H788	I728-F755 HydrophobicContact CD1-CD2 4.09Å; I728-F755 HydrophobicContact CD1-CE2 3.58Å; I728-F755 HydrophobicContact CD1-CZ 4.3Å; I741-F755 HydrophobicContact CD1-CE1 4.14Å; I747-F755 HydrophobicContact CG2-CE2 4.44Å; I747-F755 HydrophobicContact CG2-CZ 4.03Å; Y750-F755 HydrophobicContact CG-CZ 4.33Å; S751-F755 VanDerWaalsContact O-CD2 3.32Å; S751-F755 WeakPolarHBondContact O-CD2 3.43Å; S751-F755 WeakPolarHBondContact O-CE2 3.36Å; L753-F755 VanDerWaalsContact C-N 3.33Å; F755-V785 HydrophobicContact CB-CG1 4.14Å; F755-V785 CarbonylContact O-C 3.57Å; F755-V785 VanDerWaalsContact O-CA 3.22Å; F755-V785 WeakPolarHBondContact O-CA 3.35Å; F755-S786 PolarHBondContact O-N 3.06Å; F755-S786 PolarHBondContact O-OG 2.9Å; F755-H788 HydrophobicContact CD1-CB 4.36Å; F755-H788 HydrophobicContact CE1-CB 3.92Å
756	I	88.5	Confident	85.4	Confident	11 Å²	11	51.9 Å²	51.9	6%	0.056	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-90	136.6	-172	-58.7	175.9	0	0	0	110.9	Y752 L753 E754 D760 L761 V764 Y783	Y752-I756 HydrophobicContact CD1-CD1 4.13Å; Y752-I756 HydrophobicContact CE1-CD1 4.21Å; Y752-I756 WeakPolarHBondContact O-CG1 3.47Å; L753-I756 HydrophobicContact CD2-CD1 4.03Å; L753-I756 PolarHBondContact O-N 3.43Å; E754-I756 VanDerWaalsContact C-N 3.31Å; E754-I756 PolarHBondContact O-N 2.83Å; I756-D760 HydrophobicContact CG2-CB 4.3Å; I756-L761 HydrophobicContact CB-CD1 4.41Å; I756-L761 HydrophobicContact CG2-CB 4.42Å; I756-V764 HydrophobicContact CD1-CB 4.12Å; I756-V764 HydrophobicContact CD1-CG1 3.63Å; I756-V764 HydrophobicContact CD1-CG2 4.22Å; I756-V764 HydrophobicContact CG2-CG2 4.25Å; I756-Y783 HydrophobicContact CD1-CE2 4.12Å; I756-Y783 HydrophobicContact CG1-CD2 4.35Å; I756-Y783 HydrophobicContact CG1-CE2 4.02Å; I756-Y783 HydrophobicContact CG2-CD2 4.14Å
757	H	87.3	Confident	86.3	Confident	25 Å²	25	52 Å²	52	12%	0.116	28%	0.275	C	S	.	.			trans	-60	133.8	174.9	-172	-70.8	0	0	0	111.4	D759 D760 L761 R784 Y800	H757-D759 VanDerWaalsContact C-N 3.33Å; H757-D759 IonicContact CE1-OD1 2.81Å; H757-D759 IonicContact CE1-OD2 2.96Å; H757-D759 PolarHBondContact CE1-OD2 3.34Å; H757-D759 PolarHBondContact ND1-N 2.96Å; H757-D759 IonicContact ND1-OD1 2.83Å; H757-D759 IonicContact ND1-OD2 2.75Å; H757-D759 PolarHBondContact ND1-OD2 2.87Å; H757-D759 PolarHBondContact O-N 2.66Å; H757-D759 VanDerWaalsContact O-N 3.16Å; H757-D760 PolarHBondContact O-N 2.98Å; H757-L761 PolarHBondContact O-N 3.11Å; H757-R784 HydrophobicContact CB-CB 3.65Å; H757-R784 PolarHBondContact CD2-NH1 3.02Å; H757-R784 PolarHBondContact CE1-NH1 3.05Å; H757-R784 VanDerWaalsContact CE1-NH1 3.3Å; H757-R784 VanDerWaalsContact CG-CZ 3.48Å; H757-R784 PolarHBondContact N-O 2.77Å; H757-R784 PolarHBondContact ND1-NH2 3.04Å; H757-R784 PolarHBondContact NE2-NH1 2.91Å; H757-R784 VanDerWaalsContact NE2-NH1 3.2Å; H757-Y800 HydrophobicContact CB-CD1 4.2Å; H757-Y800 HydrophobicContact CB-CE1 3.89Å; H757-Y800 AromaticContact CD2-CE1 3.52Å; H757-Y800 AromaticContact CD2-CE2 3.84Å; H757-Y800 AromaticContact CD2-CZ 3.43Å; H757-Y800 VanDerWaalsContact CD2-CZ 3.43Å
758	P	84.6	Confident	86.9	Confident	93 Å²	93	52.2 Å²	52.2	60%	0.604	28%	0.276	S	S	*	.	H	α-helix	trans	-56.2	-36.5	-171.6	18.3	-32.7	0	0	0	115.4	D760 L761	P758-D760 VanDerWaalsContact C-N 3.27Å; P758-D760 PolarHBondContact O-N 3.49Å; P758-L761 WeakPolarHBondContact O-CB 3.46Å
759	D	85.5	Confident	87.1	Confident	105 Å²	105	51.9 Å²	51.9	56%	0.561	27%	0.274	S	S	*	.	H	α-helix	trans	-61.6	-33.5	174.9	-44.1	-28	0	0	0	113.4	H757 R784	H757-D759 VanDerWaalsContact C-N 3.33Å; H757-D759 IonicContact CE1-OD1 2.81Å; H757-D759 IonicContact CE1-OD2 2.96Å; H757-D759 PolarHBondContact CE1-OD2 3.34Å; H757-D759 PolarHBondContact ND1-N 2.96Å; H757-D759 IonicContact ND1-OD1 2.83Å; H757-D759 IonicContact ND1-OD2 2.75Å; H757-D759 PolarHBondContact ND1-OD2 2.87Å; H757-D759 PolarHBondContact O-N 2.66Å; H757-D759 VanDerWaalsContact O-N 3.16Å; D759-R784 IonicContact OD2-CZ 2.62Å; D759-R784 IonicContact OD2-NH1 3.45Å; D759-R784 PolarHBondContact OD2-NH1 2.97Å; D759-R784 IonicContact OD2-NH2 3.58Å; D759-R784 PolarHBondContact OD2-NH2 3.4Å
760	D	87.6	Confident	87.3	Confident	21 Å²	21	55.2 Å²	55.2	11%	0.112	28%	0.279	C	S	.	.	H	α-helix	trans	-89.4	-22.5	-171.7	-54.8	-17	0	0	0	110.8	I756 H757 P758 Q762 N763 V764 R784	I756-D760 HydrophobicContact CG2-CB 4.3Å; H757-D760 PolarHBondContact O-N 2.98Å; P758-D760 VanDerWaalsContact C-N 3.27Å; P758-D760 PolarHBondContact O-N 3.49Å; D760-Q762 VanDerWaalsContact C-N 3.32Å; D760-Q762 PolarHBondContact O-N 3.12Å; D760-N763 WeakPolarHBondContact O-CB 3.39Å; D760-N763 PolarHBondContact O-N 3.16Å; D760-V764 PolarHBondContact O-N 3.24Å; D760-V764 VanDerWaalsContact O-N 3.15Å; D760-R784 IonicContact OD1-CZ 2.76Å; D760-R784 IonicContact OD1-NE 3.62Å; D760-R784 IonicContact OD1-NH2 2.61Å; D760-R784 PolarHBondContact OD1-NH2 2.91Å; D760-R784 WeakPolarHBondContact OD2-CB 3.37Å; D760-R784 IonicContact OD2-CZ 2.78Å; D760-R784 PolarHBondContact OD2-N 3.49Å; D760-R784 IonicContact OD2-NE 3.67Å; D760-R784 PolarHBondContact OD2-NE 3.24Å; D760-R784 IonicContact OD2-NH2 2.75Å; D760-R784 PolarHBondContact OD2-NH2 2.82Å
761	L	88.5	Confident	87.5	Confident	53 Å²	53	50.5 Å²	50.5	28%	0.277	26%	0.261	S	S	.	.	H	α-helix	trans	-49.1	-44.8	-177.9	-176.5	65.3	0	0	0	113.6	L753 I756 H757 P758 N763 V764 I765	L753-L761 HydrophobicContact CB-CD1 4Å; L753-L761 HydrophobicContact CD2-CD1 3.91Å; L753-L761 HydrophobicContact CG-CD1 4.37Å; I756-L761 HydrophobicContact CB-CD1 4.41Å; I756-L761 HydrophobicContact CG2-CB 4.42Å; H757-L761 PolarHBondContact O-N 3.11Å; P758-L761 WeakPolarHBondContact O-CB 3.46Å; L761-N763 VanDerWaalsContact C-N 3.31Å; L761-N763 PolarHBondContact O-N 3.27Å; L761-V764 PolarHBondContact O-N 2.85Å; L761-I765 HydrophobicContact CD1-CD1 3.86Å; L761-I765 HydrophobicContact CD1-CG1 4.16Å; L761-I765 HydrophobicContact CD2-CD1 4.39Å; L761-I765 HydrophobicContact CG-CD1 3.75Å; L761-I765 HydrophobicContact CG-CG1 4.38Å; L761-I765 WeakPolarHBondContact O-CB 3.44Å; L761-I765 WeakPolarHBondContact O-CG1 3.49Å; L761-I765 PolarHBondContact O-N 3.21Å
762	Q	87.2	Confident	87.3	Confident	95 Å²	95	50.8 Å²	50.8	44%	0.444	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-36	-179.5	-177.3	60.6	59.9	0	0	112.3	D760 T766	D760-Q762 VanDerWaalsContact C-N 3.32Å; D760-Q762 PolarHBondContact O-N 3.12Å; Q762-T766 PolarHBondContact NE2-OG1 2.97Å; Q762-T766 WeakPolarHBondContact O-CB 3.43Å; Q762-T766 PolarHBondContact O-N 3.37Å; Q762-T766 VanDerWaalsContact O-N 3.15Å; Q762-T766 PolarHBondContact O-OG1 2.78Å
763	N	85.4	Confident	87.1	Confident	105 Å²	105	56.2 Å²	56.2	56%	0.561	29%	0.286	S	S	*	.	H	α-helix	trans	-69.9	-43.9	177.8	-64.9	-34.4	0	0	0	110.3	D760 L761 T766 I767	D760-N763 WeakPolarHBondContact O-CB 3.39Å; D760-N763 PolarHBondContact O-N 3.16Å; L761-N763 VanDerWaalsContact C-N 3.31Å; L761-N763 PolarHBondContact O-N 3.27Å; N763-T766 PolarHBondContact O-N 3.24Å; N763-I767 WeakPolarHBondContact O-CG1 3.41Å; N763-I767 PolarHBondContact O-N 2.73Å
764	V	89.6	Confident	86.9	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-51.6	178.6	177.6	0	0	0	0	111.2	I756 D760 L761 T766 I767 F768 I780 Y783	I756-V764 HydrophobicContact CD1-CB 4.12Å; I756-V764 HydrophobicContact CD1-CG1 3.63Å; I756-V764 HydrophobicContact CD1-CG2 4.22Å; I756-V764 HydrophobicContact CG2-CG2 4.25Å; D760-V764 PolarHBondContact O-N 3.24Å; D760-V764 VanDerWaalsContact O-N 3.15Å; L761-V764 PolarHBondContact O-N 2.85Å; V764-T766 VanDerWaalsContact C-N 3.29Å; V764-T766 PolarHBondContact O-N 3.04Å; V764-I767 PolarHBondContact O-N 2.75Å; V764-F768 HydrophobicContact CG1-CD2 3.6Å; V764-F768 HydrophobicContact CG1-CE2 3.5Å; V764-F768 VanDerWaalsContact CG1-CE2 3.5Å; V764-F768 WeakPolarHBondContact O-CD2 3.41Å; V764-F768 PolarHBondContact O-N 2.93Å; V764-I780 HydrophobicContact CG1-CD1 4.12Å; V764-I780 HydrophobicContact CG2-CG2 3.96Å; V764-Y783 HydrophobicContact CG2-CD1 4.14Å; V764-Y783 HydrophobicContact CG2-CD2 4Å; V764-Y783 HydrophobicContact CG2-CE1 4.4Å; V764-Y783 HydrophobicContact CG2-CE2 4.27Å; V764-Y783 HydrophobicContact CG2-CG 3.9Å
765	I	89.8	Confident	86.7	Confident	39 Å²	39	56 Å²	56	20%	0.2	29%	0.291	C	S	.	.	H	α-helix	trans	-56.3	-44.5	177.6	-68.9	172.9	0	0	0	111	L753 L761 I767 F768 T769	L753-I765 HydrophobicContact CD1-CD1 4.21Å; L753-I765 HydrophobicContact CD1-CG1 4.24Å; L753-I765 HydrophobicContact CD2-CG1 4.07Å; L761-I765 HydrophobicContact CD1-CD1 3.86Å; L761-I765 HydrophobicContact CD1-CG1 4.16Å; L761-I765 HydrophobicContact CD2-CD1 4.39Å; L761-I765 HydrophobicContact CG-CD1 3.75Å; L761-I765 HydrophobicContact CG-CG1 4.38Å; L761-I765 WeakPolarHBondContact O-CB 3.44Å; L761-I765 WeakPolarHBondContact O-CG1 3.49Å; L761-I765 PolarHBondContact O-N 3.21Å; I765-I767 PolarHBondContact O-N 2.97Å; I765-F768 PolarHBondContact O-N 3.15Å; I765-T769 PolarHBondContact O-N 2.93Å; I765-T769 PolarHBondContact O-OG1 2.96Å; I765-T769 VanDerWaalsContact O-OG1 3.1Å
766	T	88.4	Confident	86.4	Confident	75 Å²	75	58 Å²	58	46%	0.46	31%	0.306	S	S	.	.	H	α-helix	trans	-59.6	-33.6	179.9	-56.2	0	0	0	0	112	Q762 N763 V764 R770	Q762-T766 PolarHBondContact NE2-OG1 2.97Å; Q762-T766 WeakPolarHBondContact O-CB 3.43Å; Q762-T766 PolarHBondContact O-N 3.37Å; Q762-T766 VanDerWaalsContact O-N 3.15Å; Q762-T766 PolarHBondContact O-OG1 2.78Å; N763-T766 PolarHBondContact O-N 3.24Å; V764-T766 VanDerWaalsContact C-N 3.29Å; V764-T766 PolarHBondContact O-N 3.04Å; T766-R770 WeakPolarHBondContact O-CB 3.44Å; T766-R770 PolarHBondContact O-N 3.14Å
767	I	88.8	Confident	86.3	Confident	32 Å²	32	62.8 Å²	62.8	16%	0.164	33%	0.331	C	S	.	.	H	α-helix	trans	-77.9	-42.8	177.5	-64.2	172.5	0	0	0	111.1	N763 V764 I765 T769 R770 I771 A778 I780	N763-I767 WeakPolarHBondContact O-CG1 3.41Å; N763-I767 PolarHBondContact O-N 2.73Å; V764-I767 PolarHBondContact O-N 2.75Å; I765-I767 PolarHBondContact O-N 2.97Å; I767-T769 PolarHBondContact O-N 3.4Å; I767-R770 WeakPolarHBondContact O-CB 3.49Å; I767-R770 PolarHBondContact O-N 3.22Å; I767-R770 VanDerWaalsContact O-N 3.09Å; I767-I771 HydrophobicContact CG2-CD1 3.72Å; I767-I771 HydrophobicContact CG2-CG1 4.24Å; I767-I771 VanDerWaalsContact O-CG1 3.25Å; I767-I771 WeakPolarHBondContact O-CG1 3.38Å; I767-I771 PolarHBondContact O-N 3.15Å; I767-A778 HydrophobicContact CG2-CB 4.26Å; I767-I780 HydrophobicContact CB-CG1 4.16Å; I767-I780 HydrophobicContact CD1-CB 4.28Å; I767-I780 HydrophobicContact CD1-CG1 4.18Å; I767-I780 HydrophobicContact CD1-CG2 4.19Å; I767-I780 HydrophobicContact CG2-CD1 4.49Å; I767-I780 HydrophobicContact CG2-CG1 3.72Å
768	F	90.2	Very high	86.3	Confident	5 Å²	5	62.6 Å²	62.6	2%	0.022	33%	0.333	C	S	.	.	H	α-helix	trans	-56.3	-46.8	172.4	-85	-78.2	0	0	0	112.2	L722 L726 Y752 V764 I765 R770 I771 T772 I780 V807 F816	L722-F768 HydrophobicContact CD1-CE1 3.84Å; L722-F768 HydrophobicContact CD1-CZ 3.78Å; L726-F768 HydrophobicContact CD1-CG 4.48Å; L726-F768 HydrophobicContact CD2-CD1 3.6Å; L726-F768 HydrophobicContact CD2-CE1 3.72Å; L726-F768 HydrophobicContact CD2-CG 4.16Å; L726-F768 HydrophobicContact CD2-CZ 4.36Å; Y752-F768 HydrophobicContact CD1-CE2 4.18Å; Y752-F768 HydrophobicContact CD1-CZ 4.09Å; Y752-F768 HydrophobicContact CE1-CE2 4.05Å; Y752-F768 AromaticContact CE1-CZ 3.97Å; Y752-F768 HydrophobicContact CE1-CZ 3.97Å; V764-F768 HydrophobicContact CG1-CD2 3.6Å; V764-F768 HydrophobicContact CG1-CE2 3.5Å; V764-F768 VanDerWaalsContact CG1-CE2 3.5Å; V764-F768 WeakPolarHBondContact O-CD2 3.41Å; V764-F768 PolarHBondContact O-N 2.93Å; I765-F768 PolarHBondContact O-N 3.15Å; F768-R770 VanDerWaalsContact C-N 3.31Å; F768-R770 PolarHBondContact O-N 3.38Å; F768-I771 PolarHBondContact O-N 3.2Å; F768-T772 PolarHBondContact O-N 3.37Å; F768-T772 VanDerWaalsContact O-N 3.12Å; F768-I780 HydrophobicContact CD2-CD1 4.38Å; F768-I780 HydrophobicContact CE2-CD1 3.93Å; F768-I780 HydrophobicContact CZ-CD1 4.47Å; F768-V807 HydrophobicContact CD1-CG1 4.1Å; F768-V807 HydrophobicContact CE1-CG1 3.63Å; F768-V807 HydrophobicContact CE1-CG2 4.47Å; F768-V807 HydrophobicContact CZ-CG1 4.19Å; F768-V807 HydrophobicContact CZ-CG2 4.2Å; F768-F816 AromaticContact CD1-CD1 3.67Å; F768-F816 HydrophobicContact CD1-CD1 3.67Å; F768-F816 AromaticContact CD1-CE1 3.74Å; F768-F816 HydrophobicContact CD1-CE1 3.74Å; F768-F816 HydrophobicContact CD1-CG 4.06Å; F768-F816 HydrophobicContact CD1-CZ 4.18Å; F768-F816 HydrophobicContact CE1-CB 4.13Å; F768-F816 AromaticContact CE1-CD1 3.93Å; F768-F816 HydrophobicContact CE1-CD1 3.93Å; F768-F816 HydrophobicContact CE1-CE1 4.45Å; F768-F816 AromaticContact CE1-CG 3.97Å; F768-F816 HydrophobicContact CE1-CG 3.97Å
769	T	86.9	Confident	86.4	Confident	34 Å²	34	64.1 Å²	64.1	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-35.6	174.8	-52.7	0	0	0	0	112.4	I765 I767 T772 H773	I765-T769 PolarHBondContact O-N 2.93Å; I765-T769 PolarHBondContact O-OG1 2.96Å; I765-T769 VanDerWaalsContact O-OG1 3.1Å; I767-T769 PolarHBondContact O-N 3.4Å; T769-T772 PolarHBondContact O-OG1 2.9Å; T769-H773 PolarHBondContact O-CD2 3.1Å; T769-H773 PolarHBondContact O-N 3.08Å
770	R	86.9	Confident	86.6	Confident	168 Å²	168	59.3 Å²	59.3	63%	0.634	30%	0.302	S	S	*	.	H	α-helix	trans	-64.7	-44.1	174.6	-177.1	177.1	176.6	179.2	-2	111.3	T766 I767 F768 H773 T774	T766-R770 WeakPolarHBondContact O-CB 3.44Å; T766-R770 PolarHBondContact O-N 3.14Å; I767-R770 WeakPolarHBondContact O-CB 3.49Å; I767-R770 PolarHBondContact O-N 3.22Å; I767-R770 VanDerWaalsContact O-N 3.09Å; F768-R770 VanDerWaalsContact C-N 3.31Å; F768-R770 PolarHBondContact O-N 3.38Å; R770-H773 PolarHBondContact O-N 3.03Å; R770-T774 HydrophobicContact CG-CG2 4.2Å; R770-T774 WeakPolarHBondContact O-CG2 3.18Å; R770-T774 PolarHBondContact O-N 3.39Å; R770-T774 PolarHBondContact O-OG1 2.73Å
771	I	86.9	Confident	86.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-41.9	-177.3	-67.3	165.1	0	0	0	111.6	I767 F768 H773 T774 N775 A778 V807	I767-I771 HydrophobicContact CG2-CD1 3.72Å; I767-I771 HydrophobicContact CG2-CG1 4.24Å; I767-I771 VanDerWaalsContact O-CG1 3.25Å; I767-I771 WeakPolarHBondContact O-CG1 3.38Å; I767-I771 PolarHBondContact O-N 3.15Å; F768-I771 PolarHBondContact O-N 3.2Å; I771-H773 VanDerWaalsContact C-N 3.3Å; I771-H773 PolarHBondContact O-N 2.89Å; I771-T774 PolarHBondContact O-N 3.5Å; I771-N775 WeakPolarHBondContact O-CA 3.09Å; I771-N775 PolarHBondContact O-N 3.32Å; I771-A778 HydrophobicContact CD1-CB 4.01Å; I771-A778 HydrophobicContact CG1-CB 3.88Å; I771-V807 HydrophobicContact CD1-CB 3.54Å; I771-V807 HydrophobicContact CD1-CG1 3.59Å
772	T	85.4	Confident	86.4	Confident	45 Å²	45	63.5 Å²	63.5	28%	0.276	34%	0.335	S	S	.	.	H	α-helix	trans	-61.1	-39.3	176.5	53.7	0	0	0	0	112.3	F768 T769 Y809 F816	F768-T772 PolarHBondContact O-N 3.37Å; F768-T772 VanDerWaalsContact O-N 3.12Å; T769-T772 PolarHBondContact O-OG1 2.9Å; T772-Y809 HydrophobicContact CG2-CD1 4.46Å; T772-Y809 HydrophobicContact CG2-CG 4.46Å; T772-F816 HydrophobicContact CG2-CE1 3.5Å; T772-F816 HydrophobicContact CG2-CZ 3.32Å
773	H	83.4	Confident	86.6	Confident	114 Å²	114	59.1 Å²	59.1	53%	0.528	31%	0.314	S	S	.	.	H	α-helix	trans	-72.3	-43.9	177.3	-68	-47.9	0	0	0	112.9	T769 R770 I771	T769-H773 PolarHBondContact O-CD2 3.1Å; T769-H773 PolarHBondContact O-N 3.08Å; R770-H773 PolarHBondContact O-N 3.03Å; I771-H773 VanDerWaalsContact C-N 3.3Å; I771-H773 PolarHBondContact O-N 2.89Å
774	T	83.3	Confident	86.7	Confident	73 Å²	73	56.2 Å²	56.2	45%	0.448	30%	0.296	S	S	.	.	H	α-helix	trans	-87.1	-15.3	-174.6	57.4	0	0	0	0	114.4	R770 I771 S776	R770-T774 HydrophobicContact CG-CG2 4.2Å; R770-T774 WeakPolarHBondContact O-CG2 3.18Å; R770-T774 PolarHBondContact O-N 3.39Å; R770-T774 PolarHBondContact O-OG1 2.73Å; I771-T774 PolarHBondContact O-N 3.5Å; T774-S776 WeakPolarHBondContact CB-OG 3.35Å; T774-S776 PolarHBondContact O-N 2.94Å; T774-S776 VanDerWaalsContact O-N 3.11Å; T774-S776 WeakPolarHBondContact OG1-CB 3.39Å; T774-S776 PolarHBondContact OG1-N 3.4Å; T774-S776 PolarHBondContact OG1-OG 2.94Å
775	N	80.8	Confident	86.6	Confident	77 Å²	77	56.3 Å²	56.3	41%	0.412	30%	0.296	S	S	.	.			trans	52.6	22.8	-167.6	-149.7	56.2	0	0	0	114	I771 Y809 K811	I771-N775 WeakPolarHBondContact O-CA 3.09Å; I771-N775 PolarHBondContact O-N 3.32Å; N775-Y809 PolarHBondContact OD1-O 3.12Å; N775-K811 HydrophobicContact CB-CD 4.4Å; N775-K811 WeakPolarHBondContact OD1-CD 3.39Å; N775-K811 WeakPolarHBondContact OD1-CE 3.45Å; N775-K811 VanDerWaalsContact OD1-CG 3.27Å; N775-K811 WeakPolarHBondContact OD1-CG 3.33Å
776	S	78.9	Confident	86.2	Confident	47 Å²	47	55 Å²	55	33%	0.329	29%	0.291	S	S	.	.			trans	-103.8	139.1	-171.5	70.1	0	0	0	0	111.4	T774 A778	T774-S776 WeakPolarHBondContact CB-OG 3.35Å; T774-S776 PolarHBondContact O-N 2.94Å; T774-S776 VanDerWaalsContact O-N 3.11Å; T774-S776 WeakPolarHBondContact OG1-CB 3.39Å; T774-S776 PolarHBondContact OG1-N 3.4Å; T774-S776 PolarHBondContact OG1-OG 2.94Å; S776-A778 PolarHBondContact O-N 2.84Å
777	L	87.2	Confident	85.2	Confident	112 Å²	112	52 Å²	52	59%	0.586	27%	0.273	S	S	*	.			trans	-56.1	126.4	165.6	-173.1	73.6	0	0	0	110.6	L806	L777-L806 HydrophobicContact CD1-CD1 3.7Å; L777-L806 HydrophobicContact CD1-CD2 4.14Å; L777-L806 HydrophobicContact CD1-CG 3.69Å; L777-L806 HydrophobicContact CD2-CD1 4.04Å; L777-L806 HydrophobicContact CD2-CD2 4.26Å; L777-L806 HydrophobicContact CD2-CG 4.44Å; L777-L806 HydrophobicContact CG-CD1 3.56Å; L777-L806 HydrophobicContact CG-CD2 4.45Å; L777-L806 HydrophobicContact CG-CG 4.1Å
778	A	87	Confident	83.8	Confident	20 Å²	20	53.7 Å²	53.7	17%	0.165	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	141.1	177	0	0	0	0	0	113.1	I767 I771 S776 V807	I767-A778 HydrophobicContact CG2-CB 4.26Å; I771-A778 HydrophobicContact CD1-CB 4.01Å; I771-A778 HydrophobicContact CG1-CB 3.88Å; S776-A778 PolarHBondContact O-N 2.84Å; A778-V807 PolarHBondContact N-O 3Å; A778-V807 PolarHBondContact O-N 3.46Å
779	W	86.6	Confident	81.9	Confident	126 Å²	126	58.1 Å²	58.1	48%	0.477	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.3	170	-79.6	100.8	0	0	0	110.9	R804 L806	W779-R804 HydrophobicContact CE3-CB 4.48Å; W779-R804 HydrophobicContact CZ3-CB 4.38Å; W779-R804 HydrophobicContact CZ3-CG 4.03Å; W779-L806 HydrophobicContact CD2-CB 3.97Å; W779-L806 HydrophobicContact CD2-CD1 3.88Å; W779-L806 HydrophobicContact CD2-CG 4.45Å; W779-L806 HydrophobicContact CE3-CB 3.84Å; W779-L806 HydrophobicContact CG-CD1 3.92Å; W779-L806 HydrophobicContact CH2-CB 3.7Å; W779-L806 HydrophobicContact CH2-CD2 4.39Å; W779-L806 HydrophobicContact CZ2-CB 3.85Å; W779-L806 HydrophobicContact CZ2-CD1 4.31Å; W779-L806 HydrophobicContact CZ2-CD2 3.87Å; W779-L806 HydrophobicContact CZ2-CG 4.24Å; W779-L806 HydrophobicContact CZ3-CB 3.7Å
780	I	89.4	Confident	80.1	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128	164.3	-57.3	177.5	0	0	0	108	V764 I767 F768 Y783 S805 V807	V764-I780 HydrophobicContact CG1-CD1 4.12Å; V764-I780 HydrophobicContact CG2-CG2 3.96Å; I767-I780 HydrophobicContact CB-CG1 4.16Å; I767-I780 HydrophobicContact CD1-CB 4.28Å; I767-I780 HydrophobicContact CD1-CG1 4.18Å; I767-I780 HydrophobicContact CD1-CG2 4.19Å; I767-I780 HydrophobicContact CG2-CD1 4.49Å; I767-I780 HydrophobicContact CG2-CG1 3.72Å; F768-I780 HydrophobicContact CD2-CD1 4.38Å; F768-I780 HydrophobicContact CE2-CD1 3.93Å; F768-I780 HydrophobicContact CZ-CD1 4.47Å; I780-Y783 HydrophobicContact CB-CD1 4.4Å; I780-Y783 HydrophobicContact CB-CE1 4.04Å; I780-Y783 HydrophobicContact CD1-CE1 4.47Å; I780-Y783 HydrophobicContact CG2-CD1 3.52Å; I780-Y783 HydrophobicContact CG2-CE1 3.51Å; I780-S805 WeakPolarHBondContact CB-O 3.38Å; I780-S805 PolarHBondContact N-O 3.4Å; I780-V807 HydrophobicContact CD1-CB 4.5Å; I780-V807 HydrophobicContact CD1-CG2 3.51Å; I780-V807 HydrophobicContact CG1-CG2 4.11Å
781	S	83.5	Confident	77.6	Confident	87 Å²	87	60.1 Å²	60.1	61%	0.608	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.9	147.1	171.4	-60	0	0	0	0	111	Y783	S781-Y783 WeakPolarHBondContact O-CD1 3.44Å; S781-Y783 PolarHBondContact O-N 3.34Å
782	P	89.6	Confident	75.2	Confident	74 Å²	74	65 Å²	65	48%	0.481	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-45.6	127.6	178.4	-30.5	36.1	0	0	0	113.3	W802 I803 R804 L823	P782-W802 HydrophobicContact CB-CE3 4.21Å; P782-I803 CarbonylContact C-O 3.55Å; P782-I803 WeakPolarHBondContact CA-O 3.27Å; P782-R804 HydrophobicContact CG-CB 4.47Å; P782-L823 HydrophobicContact CB-CD1 3.65Å; P782-L823 HydrophobicContact CG-CD1 3.7Å
783	Y	90.7	Very high	72.8	Confident	3 Å²	3	69.3 Å²	69.3	1%	0.012	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	161	-178.8	63.5	-82.9	0	0	0	111.3	Y752 I756 V764 I780 S781 V785 I803 S805	Y752-Y783 PolarHBondContact OH-OH 2.97Å; I756-Y783 HydrophobicContact CD1-CE2 4.12Å; I756-Y783 HydrophobicContact CG1-CD2 4.35Å; I756-Y783 HydrophobicContact CG1-CE2 4.02Å; I756-Y783 HydrophobicContact CG2-CD2 4.14Å; V764-Y783 HydrophobicContact CG2-CD1 4.14Å; V764-Y783 HydrophobicContact CG2-CD2 4Å; V764-Y783 HydrophobicContact CG2-CE1 4.4Å; V764-Y783 HydrophobicContact CG2-CE2 4.27Å; V764-Y783 HydrophobicContact CG2-CG 3.9Å; I780-Y783 HydrophobicContact CB-CD1 4.4Å; I780-Y783 HydrophobicContact CB-CE1 4.04Å; I780-Y783 HydrophobicContact CD1-CE1 4.47Å; I780-Y783 HydrophobicContact CG2-CD1 3.52Å; I780-Y783 HydrophobicContact CG2-CE1 3.51Å; S781-Y783 WeakPolarHBondContact O-CD1 3.44Å; S781-Y783 PolarHBondContact O-N 3.34Å; Y783-V785 HydrophobicContact CD2-CG2 3.93Å; Y783-V785 HydrophobicContact CE2-CG2 3.6Å; Y783-I803 HydrophobicContact CD1-CG1 4.4Å; Y783-I803 HydrophobicContact CD2-CG1 4.23Å; Y783-I803 HydrophobicContact CE1-CD1 4.32Å; Y783-I803 HydrophobicContact CE1-CG1 4.04Å; Y783-I803 HydrophobicContact CE2-CD1 3.81Å; Y783-I803 HydrophobicContact CE2-CG1 3.85Å; Y783-I803 PolarHBondContact N-O 2.99Å; Y783-I803 PolarHBondContact O-N 3.32Å; Y783-S805 PolarHBondContact OH-OG 3.1Å
784	R	88.2	Confident	70.4	Confident	45 Å²	45	70.5 Å²	70.5	17%	0.17	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.1	-178.6	-68.3	164.4	-69.6	169.8	-5.1	111.2	H757 D759 D760 Y800 R801 W802	H757-R784 HydrophobicContact CB-CB 3.65Å; H757-R784 PolarHBondContact CD2-NH1 3.02Å; H757-R784 PolarHBondContact CE1-NH1 3.05Å; H757-R784 VanDerWaalsContact CE1-NH1 3.3Å; H757-R784 VanDerWaalsContact CG-CZ 3.48Å; H757-R784 PolarHBondContact N-O 2.77Å; H757-R784 PolarHBondContact ND1-NH2 3.04Å; H757-R784 PolarHBondContact NE2-NH1 2.91Å; H757-R784 VanDerWaalsContact NE2-NH1 3.2Å; D759-R784 IonicContact OD2-CZ 2.62Å; D759-R784 IonicContact OD2-NH1 3.45Å; D759-R784 PolarHBondContact OD2-NH1 2.97Å; D759-R784 IonicContact OD2-NH2 3.58Å; D759-R784 PolarHBondContact OD2-NH2 3.4Å; D760-R784 IonicContact OD1-CZ 2.76Å; D760-R784 IonicContact OD1-NE 3.62Å; D760-R784 IonicContact OD1-NH2 2.61Å; D760-R784 PolarHBondContact OD1-NH2 2.91Å; D760-R784 WeakPolarHBondContact OD2-CB 3.37Å; D760-R784 IonicContact OD2-CZ 2.78Å; D760-R784 PolarHBondContact OD2-N 3.49Å; D760-R784 IonicContact OD2-NE 3.67Å; D760-R784 PolarHBondContact OD2-NE 3.24Å; D760-R784 IonicContact OD2-NH2 2.75Å; D760-R784 PolarHBondContact OD2-NH2 2.82Å; R784-Y800 HydrophobicContact CB-CD1 3.96Å; R784-Y800 HydrophobicContact CB-CG 4.31Å; R784-R801 WeakPolarHBondContact CA-O 3.32Å; R784-W802 HydrophobicContact CG-CD2 3.81Å; R784-W802 HydrophobicContact CG-CE3 3.88Å; R784-W802 HydrophobicContact CG-CH2 3.68Å; R784-W802 HydrophobicContact CG-CZ2 3.59Å; R784-W802 HydrophobicContact CG-CZ3 3.82Å
785	V	87	Confident	68.3	Low	2 Å²	2	74.4 Å²	74.4	1%	0.012	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.5	172	163.1	0	0	0	0	109.1	F739 F755 Y783 Y800 R801 I803	F739-V785 HydrophobicContact CD1-CG1 3.62Å; F739-V785 HydrophobicContact CE1-CG1 3.91Å; F755-V785 HydrophobicContact CB-CG1 4.14Å; F755-V785 CarbonylContact O-C 3.57Å; F755-V785 VanDerWaalsContact O-CA 3.22Å; F755-V785 WeakPolarHBondContact O-CA 3.35Å; Y783-V785 HydrophobicContact CD2-CG2 3.93Å; Y783-V785 HydrophobicContact CE2-CG2 3.6Å; V785-Y800 CarbonylContact O-C 3.58Å; V785-Y800 WeakPolarHBondContact O-CA 3.17Å; V785-R801 PolarHBondContact N-O 2.93Å; V785-R801 PolarHBondContact O-N 3.33Å; V785-I803 HydrophobicContact CB-CD1 4.36Å; V785-I803 HydrophobicContact CB-CG1 4.43Å; V785-I803 HydrophobicContact CG2-CD1 3.52Å; V785-I803 HydrophobicContact CG2-CG1 3.78Å
786	S	81.2	Confident	66.5	Low	13 Å²	13	75 Å²	75	9%	0.091	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	135.8	177.1	55.9	0	0	0	0	111.3	F755 H788	F755-S786 PolarHBondContact O-N 3.06Å; F755-S786 PolarHBondContact O-OG 2.9Å; S786-H788 PolarHBondContact O-N 3.22Å
787	A	66.4	Low	65.2	Low	12 Å²	12	76.4 Å²	76.4	10%	0.099	41%	0.414	C	S	.	.			trans	-57.3	125.5	161.6	0	0	0	0	0	110.2	F739 D740 N789 S799	F739-A787 WeakPolarHBondContact O-CA 3.27Å; D740-A787 HydrophobicContact CB-CB 3.46Å; D740-A787 VanDerWaalsContact CB-CB 3.46Å; A787-N789 VanDerWaalsContact C-N 3.31Å; A787-N789 PolarHBondContact O-N 3.01Å; A787-S799 VanDerWaalsContact CB-OG 3.23Å; A787-S799 WeakPolarHBondContact CB-OG 3.16Å; A787-S799 PolarHBondContact N-O 3.15Å; A787-S799 VanDerWaalsContact N-O 3.17Å
788	H	59.8	Low	63.8	Low	66 Å²	66	77.6 Å²	77.6	31%	0.306	42%	0.415	S	S	.	.			trans	-84.3	77.5	174.9	-174	-74.9	0	0	0	110.2	I741 F755 S786 K790	I741-H788 HydrophobicContact CD1-CB 3.65Å; I741-H788 HydrophobicContact CG1-CB 4.15Å; F755-H788 HydrophobicContact CD1-CB 4.36Å; F755-H788 HydrophobicContact CE1-CB 3.92Å; S786-H788 PolarHBondContact O-N 3.22Å; H788-K790 PolarHBondContact O-N 2.91Å
789	N	51.7	Low	63	Low	99 Å²	99	78.4 Å²	78.4	53%	0.529	42%	0.419	S	S	.	.			trans	-65.2	106.2	170.2	-80.9	-12.8	0	0	0	110.1	A787 T791	A787-N789 VanDerWaalsContact C-N 3.31Å; A787-N789 PolarHBondContact O-N 3.01Å; N789-T791 PolarHBondContact O-N 3.44Å; N789-T791 VanDerWaalsContact O-N 3.12Å
790	K	48.5	Very low	62.7	Low	100 Å²	100	73.7 Å²	73.7	44%	0.435	40%	0.401	S	S	.	.			trans	-43.2	115.8	164.1	-90.4	167.8	164.3	152.7	0	109.4	D746 H788 V792	D746-K790 VanDerWaalsContact CG-CE 3.42Å; D746-K790 WeakPolarHBondContact OD1-CE 3.28Å; D746-K790 IonicContact OD1-NZ 2.66Å; D746-K790 PolarHBondContact OD1-NZ 3.29Å; D746-K790 WeakPolarHBondContact OD2-CE 3.34Å; D746-K790 IonicContact OD2-NZ 3.2Å; D746-K790 PolarHBondContact OD2-NZ 3.18Å; H788-K790 PolarHBondContact O-N 2.91Å; K790-V792 WeakPolarHBondContact O-CG2 3.36Å; K790-V792 PolarHBondContact O-N 2.88Å
791	T	34.9	Very low	62.4	Low	144 Å²	144	75.5 Å²	75.5	88%	0.883	41%	0.408	S	S	*	.	S	Bend	trans	25.6	61.6	152.5	54.1	0	0	0	0	117.5	N789	N789-T791 PolarHBondContact O-N 3.44Å; N789-T791 VanDerWaalsContact O-N 3.12Å
792	V	35.4	Very low	62.6	Low	101 Å²	101	74.6 Å²	74.6	61%	0.612	39%	0.391	S	S	*	.			trans	-123.8	109.1	167.3	176.9	0	0	0	0	109.5	K790	K790-V792 WeakPolarHBondContact O-CG2 3.36Å; K790-V792 PolarHBondContact O-N 2.88Å
793	N	35.4	Very low	62.6	Low	137 Å²	137	71 Å²	71	73%	0.733	37%	0.368	S	S	*	.			trans	25.5	113.6	159	-63.8	-24.3	0	0	0	119.2
794	N	32	Very low	62.4	Low	138 Å²	138	74.8 Å²	74.8	74%	0.738	38%	0.382	S	S	*	.	S	Bend	trans	-2.3	120	153.4	-57.4	-20.6	0	0	0	116.2
795	N	39.1	Very low	62.6	Low	156 Å²	156	72.6 Å²	72.6	83%	0.834	37%	0.374	S	S	*	.			trans	90.7	23.6	172.3	-44.3	-23.3	0	0	0	117.5
796	T	44.8	Very low	62.8	Low	90 Å²	90	74.1 Å²	74.1	55%	0.552	38%	0.382	S	S	*	.			trans	-93.5	127.9	166.2	55	0	0	0	0	111.6	K798	T796-K798 PolarHBondContact O-N 3.18Å
797	E	50.3	Low	63.3	Low	76 Å²	76	73.5 Å²	73.5	36%	0.355	38%	0.378	S	S	.	.			trans	-47.2	130.6	175.7	-64.1	167.2	-175.5	0	0	111.6	S799 L828 Y829 D830	E797-S799 PolarHBondContact O-N 3.27Å; E797-S799 VanDerWaalsContact O-N 3.1Å; E797-L828 WeakPolarHBondContact CG-O 3.21Å; E797-Y829 WeakPolarHBondContact OE1-CA 3.47Å; E797-D830 HydrophobicContact CG-CB 4.15Å; E797-D830 WeakPolarHBondContact OE1-CB 3.34Å; E797-D830 PolarHBondContact OE1-N 3.17Å
798	K	59	Low	64.5	Low	137 Å²	137	74.7 Å²	74.7	60%	0.596	39%	0.385	S	S	*	.			trans	-72.5	103.2	168	-76.5	-165.8	173.6	-161.4	0	108.4	T796 Y800	T796-K798 PolarHBondContact O-N 3.18Å; K798-Y800 HydrophobicContact CB-CD2 4.41Å; K798-Y800 HydrophobicContact CB-CE2 3.72Å; K798-Y800 WeakPolarHBondContact O-CD2 3.45Å; K798-Y800 WeakPolarHBondContact O-CE2 3.42Å
799	S	69.6	Low	66	Low	36 Å²	36	73.1 Å²	73.1	25%	0.252	38%	0.376	S	S	.	.			trans	-64.6	133.1	167	55.5	0	0	0	0	109.5	A787 E797	A787-S799 VanDerWaalsContact CB-OG 3.23Å; A787-S799 WeakPolarHBondContact CB-OG 3.16Å; A787-S799 PolarHBondContact N-O 3.15Å; A787-S799 VanDerWaalsContact N-O 3.17Å; E797-S799 PolarHBondContact O-N 3.27Å; E797-S799 VanDerWaalsContact O-N 3.1Å
800	Y	80.9	Confident	67.7	Low	27 Å²	27	69.8 Å²	69.8	11%	0.106	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133.2	174.9	-72.8	-83.3	0	0	0	109.6	H757 R784 V785 K798 C826 L828	H757-Y800 HydrophobicContact CB-CD1 4.2Å; H757-Y800 HydrophobicContact CB-CE1 3.89Å; H757-Y800 AromaticContact CD2-CE1 3.52Å; H757-Y800 AromaticContact CD2-CE2 3.84Å; H757-Y800 AromaticContact CD2-CZ 3.43Å; H757-Y800 VanDerWaalsContact CD2-CZ 3.43Å; R784-Y800 HydrophobicContact CB-CD1 3.96Å; R784-Y800 HydrophobicContact CB-CG 4.31Å; V785-Y800 CarbonylContact O-C 3.58Å; V785-Y800 WeakPolarHBondContact O-CA 3.17Å; K798-Y800 HydrophobicContact CB-CD2 4.41Å; K798-Y800 HydrophobicContact CB-CE2 3.72Å; K798-Y800 WeakPolarHBondContact O-CD2 3.45Å; K798-Y800 WeakPolarHBondContact O-CE2 3.42Å; Y800-C826 WeakPolarHBondContact O-CB 3.21Å; Y800-C826 PolarHBondContact O-N 3.18Å; Y800-L828 HydrophobicContact CD2-CD1 3.89Å; Y800-L828 HydrophobicContact CE2-CD1 4.19Å
801	R	82.5	Confident	69.4	Low	43 Å²	43	70.2 Å²	70.2	16%	0.162	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.2	173.2	-65.7	-173.6	175.9	-156.5	0.3	108.7	T736 D737 D740 R784 V785 F822	T736-R801 PolarHBondContact O-NH1 2.98Å; D737-R801 VanDerWaalsContact C-NH1 3.31Å; D737-R801 WeakPolarHBondContact O-CD 3.49Å; D737-R801 PolarHBondContact O-NH1 3.32Å; D740-R801 VanDerWaalsContact CB-CZ 3.5Å; D740-R801 IonicContact OD1-CZ 2.66Å; D740-R801 IonicContact OD1-NH2 3.3Å; D740-R801 PolarHBondContact OD1-NH2 3.38Å; D740-R801 IonicContact OD2-CZ 2.63Å; D740-R801 VanDerWaalsContact OD2-CZ 3.3Å; D740-R801 IonicContact OD2-NE 3.96Å; D740-R801 PolarHBondContact OD2-NE 3.28Å; D740-R801 IonicContact OD2-NH2 3.52Å; D740-R801 PolarHBondContact OD2-NH2 2.85Å; R784-R801 WeakPolarHBondContact CA-O 3.32Å; V785-R801 PolarHBondContact N-O 2.93Å; V785-R801 PolarHBondContact O-N 3.33Å; R801-F822 HydrophobicContact CB-CD2 4.26Å; R801-F822 HydrophobicContact CB-CE2 3.91Å; R801-F822 HydrophobicContact CG-CE2 3.98Å
802	W	87.7	Confident	71.7	Confident	67 Å²	67	71.9 Å²	71.9	25%	0.254	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.2	171.9	-73.5	97.3	0	0	0	108.9	P782 R784 L823 G824	P782-W802 HydrophobicContact CB-CE3 4.21Å; R784-W802 HydrophobicContact CG-CD2 3.81Å; R784-W802 HydrophobicContact CG-CE3 3.88Å; R784-W802 HydrophobicContact CG-CH2 3.68Å; R784-W802 HydrophobicContact CG-CZ2 3.59Å; R784-W802 HydrophobicContact CG-CZ3 3.82Å; W802-L823 HydrophobicContact CB-CB 3.99Å; W802-L823 WeakPolarHBondContact O-CB 3.24Å; W802-L823 PolarHBondContact O-N 3.14Å; W802-G824 PolarHBondContact N-O 3.04Å
803	I	88.9	Confident	74	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	154.5	171.3	68.8	166.7	0	0	0	110.1	P782 Y783 V785 N820 Q821	P782-I803 CarbonylContact C-O 3.55Å; P782-I803 WeakPolarHBondContact CA-O 3.27Å; Y783-I803 HydrophobicContact CD1-CG1 4.4Å; Y783-I803 HydrophobicContact CD2-CG1 4.23Å; Y783-I803 HydrophobicContact CE1-CD1 4.32Å; Y783-I803 HydrophobicContact CE1-CG1 4.04Å; Y783-I803 HydrophobicContact CE2-CD1 3.81Å; Y783-I803 HydrophobicContact CE2-CG1 3.85Å; Y783-I803 PolarHBondContact N-O 2.99Å; Y783-I803 PolarHBondContact O-N 3.32Å; V785-I803 HydrophobicContact CB-CD1 4.36Å; V785-I803 HydrophobicContact CB-CG1 4.43Å; V785-I803 HydrophobicContact CG2-CD1 3.52Å; V785-I803 HydrophobicContact CG2-CG1 3.78Å; I803-N820 HydrophobicContact CD1-CB 4.17Å; I803-Q821 WeakPolarHBondContact CA-O 3.49Å
804	R	88.1	Confident	76.5	Confident	81 Å²	81	69.7 Å²	69.7	31%	0.306	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.6	161.7	55.5	-177.9	-88.6	-159.2	-9.7	107.7	W779 P782 Q821 L823	W779-R804 HydrophobicContact CE3-CB 4.48Å; W779-R804 HydrophobicContact CZ3-CB 4.38Å; W779-R804 HydrophobicContact CZ3-CG 4.03Å; P782-R804 HydrophobicContact CG-CB 4.47Å; R804-Q821 HydrophobicContact CG-CB 3.89Å; R804-Q821 HydrophobicContact CG-CG 4.44Å; R804-Q821 VanDerWaalsContact CZ-OE1 3.3Å; R804-Q821 PolarHBondContact N-O 2.94Å; R804-Q821 PolarHBondContact O-N 3.5Å; R804-L823 HydrophobicContact CB-CD1 3.93Å; R804-L823 HydrophobicContact CG-CD1 3.91Å; R804-L823 HydrophobicContact CG-CD2 4.12Å; R804-L823 HydrophobicContact CG-CG 4.08Å
805	S	91.4	Very high	79.2	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.2	-175.9	-56.3	0	0	0	0	111	I780 Y783 S819 N820	I780-S805 WeakPolarHBondContact CB-O 3.38Å; I780-S805 PolarHBondContact N-O 3.4Å; Y783-S805 PolarHBondContact OH-OG 3.1Å; S805-S819 WeakPolarHBondContact CA-O 3.4Å; S805-N820 WeakPolarHBondContact CB-OD1 3.31Å; S805-N820 PolarHBondContact OG-OD1 3.4Å
806	L	91.8	Very high	81.7	Confident	34 Å²	34	58.2 Å²	58.2	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	119.9	168.3	179.8	59.3	0	0	0	107.3	L777 W779 C818 S819	L777-L806 HydrophobicContact CD1-CD1 3.7Å; L777-L806 HydrophobicContact CD1-CD2 4.14Å; L777-L806 HydrophobicContact CD1-CG 3.69Å; L777-L806 HydrophobicContact CD2-CD1 4.04Å; L777-L806 HydrophobicContact CD2-CD2 4.26Å; L777-L806 HydrophobicContact CD2-CG 4.44Å; L777-L806 HydrophobicContact CG-CD1 3.56Å; L777-L806 HydrophobicContact CG-CD2 4.45Å; L777-L806 HydrophobicContact CG-CG 4.1Å; W779-L806 HydrophobicContact CD2-CB 3.97Å; W779-L806 HydrophobicContact CD2-CD1 3.88Å; W779-L806 HydrophobicContact CD2-CG 4.45Å; W779-L806 HydrophobicContact CE3-CB 3.84Å; W779-L806 HydrophobicContact CG-CD1 3.92Å; W779-L806 HydrophobicContact CH2-CB 3.7Å; W779-L806 HydrophobicContact CH2-CD2 4.39Å; W779-L806 HydrophobicContact CZ2-CB 3.85Å; W779-L806 HydrophobicContact CZ2-CD1 4.31Å; W779-L806 HydrophobicContact CZ2-CD2 3.87Å; W779-L806 HydrophobicContact CZ2-CG 4.24Å; W779-L806 HydrophobicContact CZ3-CB 3.7Å; L806-C818 CarbonylContact O-C 3.57Å; L806-C818 WeakPolarHBondContact O-CA 3.35Å; L806-S819 PolarHBondContact N-O 3.46Å; L806-S819 PolarHBondContact O-N 2.99Å
807	V	91.8	Very high	83.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.1	-173.6	-178.3	0	0	0	0	110.4	F768 I771 A778 I780 F816 I817 C818	F768-V807 HydrophobicContact CD1-CG1 4.1Å; F768-V807 HydrophobicContact CE1-CG1 3.63Å; F768-V807 HydrophobicContact CE1-CG2 4.47Å; F768-V807 HydrophobicContact CZ-CG1 4.19Å; F768-V807 HydrophobicContact CZ-CG2 4.2Å; I771-V807 HydrophobicContact CD1-CB 3.54Å; I771-V807 HydrophobicContact CD1-CG1 3.59Å; A778-V807 PolarHBondContact N-O 3Å; A778-V807 PolarHBondContact O-N 3.46Å; I780-V807 HydrophobicContact CD1-CB 4.5Å; I780-V807 HydrophobicContact CD1-CG2 3.51Å; I780-V807 HydrophobicContact CG1-CG2 4.11Å; V807-F816 HydrophobicContact CG1-CB 4.42Å; V807-F816 HydrophobicContact CG1-CD1 4.23Å; V807-I817 WeakPolarHBondContact CA-O 3.45Å; V807-C818 HydrophobicContact CG2-CB 4.09Å
808	S	91.3	Very high	85.8	Confident	36 Å²	36	51.1 Å²	51.1	25%	0.252	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	160.2	166.1	57.4	0	0	0	0	110.2	F816 I817	S808-F816 VanDerWaalsContact O-CA 3.29Å; S808-F816 WeakPolarHBondContact O-CA 3.4Å; S808-I817 PolarHBondContact N-O 3.33Å; S808-I817 PolarHBondContact O-N 3.49Å
809	Y	91.7	Very high	87.3	Confident	33 Å²	33	46 Å²	46	13%	0.129	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.1	173.8	179.5	-115.2	0	0	0	109	C724 T772 N775 K811 N814 F816	C724-Y809 PolarHBondContact SG-OH 3.5Å; T772-Y809 HydrophobicContact CG2-CD1 4.46Å; T772-Y809 HydrophobicContact CG2-CG 4.46Å; N775-Y809 PolarHBondContact OD1-O 3.12Å; Y809-K811 HydrophobicContact CD1-CG 3.76Å; Y809-K811 HydrophobicContact CE1-CB 4.37Å; Y809-K811 HydrophobicContact CE1-CG 3.53Å; Y809-N814 PolarHBondContact OH-OD1 2.78Å; Y809-F816 AromaticContact CD2-CD1 3.5Å; Y809-F816 HydrophobicContact CD2-CD1 3.5Å; Y809-F816 HydrophobicContact CD2-CD2 4.01Å; Y809-F816 AromaticContact CD2-CE1 3.46Å; Y809-F816 HydrophobicContact CD2-CE1 3.46Å; Y809-F816 VanDerWaalsContact CD2-CE1 3.46Å; Y809-F816 AromaticContact CD2-CE2 3.98Å; Y809-F816 HydrophobicContact CD2-CE2 3.98Å; Y809-F816 AromaticContact CD2-CG 3.79Å; Y809-F816 HydrophobicContact CD2-CG 3.79Å; Y809-F816 AromaticContact CD2-CZ 3.72Å; Y809-F816 HydrophobicContact CD2-CZ 3.72Å; Y809-F816 HydrophobicContact CE2-CD1 4.45Å; Y809-F816 HydrophobicContact CE2-CD2 4.29Å; Y809-F816 HydrophobicContact CE2-CE1 4.16Å; Y809-F816 HydrophobicContact CE2-CE2 4Å; Y809-F816 AromaticContact CE2-CZ 3.94Å; Y809-F816 HydrophobicContact CE2-CZ 3.94Å; Y809-F816 HydrophobicContact CG-CD1 4.06Å; Y809-F816 AromaticContact CG-CE1 3.93Å; Y809-F816 HydrophobicContact CG-CE1 3.93Å
810	D	86.8	Confident	88.3	Confident	29 Å²	29	44.4 Å²	44.4	16%	0.155	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	104.7	171	-176.9	-18.2	0	0	0	108.3	M812 K813 N814 I815	D810-M812 VanDerWaalsContact C-N 3.28Å; D810-M812 PolarHBondContact O-N 3.16Å; D810-M812 WeakPolarHBondContact OD1-CA 3.4Å; D810-M812 WeakPolarHBondContact OD1-CB 3.29Å; D810-M812 PolarHBondContact OD1-N 3.39Å; D810-K813 HydrophobicContact CB-CB 4.33Å; D810-K813 PolarHBondContact OD1-N 3.43Å; D810-K813 WeakPolarHBondContact OD2-CD 3.34Å; D810-K813 VanDerWaalsContact OD2-CG 3.31Å; D810-K813 WeakPolarHBondContact OD2-CG 3.44Å; D810-N814 WeakPolarHBondContact O-CA 3.44Å; D810-N814 PolarHBondContact O-N 3.03Å; D810-I815 PolarHBondContact N-O 3.03Å; D810-I815 PolarHBondContact O-N 3.22Å
811	K	84.5	Confident	88.6	Confident	109 Å²	109	45.8 Å²	45.8	47%	0.474	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.5	176.3	-85	175.5	-178.6	-178.4	0	113.6	N775 Y809	N775-K811 HydrophobicContact CB-CD 4.4Å; N775-K811 WeakPolarHBondContact OD1-CD 3.39Å; N775-K811 WeakPolarHBondContact OD1-CE 3.45Å; N775-K811 VanDerWaalsContact OD1-CG 3.27Å; N775-K811 WeakPolarHBondContact OD1-CG 3.33Å; Y809-K811 HydrophobicContact CD1-CG 3.76Å; Y809-K811 HydrophobicContact CE1-CB 4.37Å; Y809-K811 HydrophobicContact CE1-CG 3.53Å
812	M	83.4	Confident	88.8	Confident	180 Å²	180	45.9 Å²	45.9	89%	0.887	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-41.7	-178.4	-62.4	-59.8	-168.4	0	0	110.4	D810	D810-M812 VanDerWaalsContact C-N 3.28Å; D810-M812 PolarHBondContact O-N 3.16Å; D810-M812 WeakPolarHBondContact OD1-CA 3.4Å; D810-M812 WeakPolarHBondContact OD1-CB 3.29Å; D810-M812 PolarHBondContact OD1-N 3.39Å
813	K	84	Confident	88.6	Confident	102 Å²	102	45.3 Å²	45.3	44%	0.443	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-9.4	178.1	-62.6	-174.4	-178.3	-175	0	114.1	D810 I815	D810-K813 HydrophobicContact CB-CB 4.33Å; D810-K813 PolarHBondContact OD1-N 3.43Å; D810-K813 WeakPolarHBondContact OD2-CD 3.34Å; D810-K813 VanDerWaalsContact OD2-CG 3.31Å; D810-K813 WeakPolarHBondContact OD2-CG 3.44Å; K813-I815 VanDerWaalsContact C-N 3.26Å; K813-I815 HydrophobicContact CB-CB 4.3Å; K813-I815 HydrophobicContact CB-CD1 4.14Å; K813-I815 HydrophobicContact CB-CG1 4.36Å; K813-I815 WeakPolarHBondContact O-CG1 3.24Å; K813-I815 PolarHBondContact O-N 3.43Å
814	N	86.6	Confident	88	Confident	89 Å²	89	46 Å²	46	48%	0.476	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	42.5	-172.5	-83.3	-35.1	0	0	0	112.5	C724 Y809 D810	C724-N814 PolarHBondContact N-O 3.28Å; C724-N814 VanDerWaalsContact SG-CB 3.59Å; C724-N814 PolarHBondContact SG-O 3.22Å; Y809-N814 PolarHBondContact OH-OD1 2.78Å; D810-N814 WeakPolarHBondContact O-CA 3.44Å; D810-N814 PolarHBondContact O-N 3.03Å
815	I	88.9	Confident	87.1	Confident	47 Å²	47	44.5 Å²	44.5	24%	0.241	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.4	-175.2	-74.3	171.3	0	0	0	110.2	Y721 L722 D810 K813 I817	Y721-I815 HydrophobicContact CD1-CG2 4.15Å; L722-I815 CarbonylContact O-C 3.58Å; L722-I815 WeakPolarHBondContact O-CA 3.15Å; L722-I815 WeakPolarHBondContact O-CG2 3.22Å; D810-I815 PolarHBondContact N-O 3.03Å; D810-I815 PolarHBondContact O-N 3.22Å; K813-I815 VanDerWaalsContact C-N 3.26Å; K813-I815 HydrophobicContact CB-CB 4.3Å; K813-I815 HydrophobicContact CB-CD1 4.14Å; K813-I815 HydrophobicContact CB-CG1 4.36Å; K813-I815 WeakPolarHBondContact O-CG1 3.24Å; K813-I815 PolarHBondContact O-N 3.43Å; I815-I817 HydrophobicContact CG2-CG1 4.3Å
816	F	91.4	Very high	85.4	Confident	7 Å²	7	45.5 Å²	45.5	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	139.1	163.1	-56	-94.5	0	0	0	110.4	Y721 L722 L726 F768 T772 V807 S808 Y809	Y721-F816 WeakPolarHBondContact CA-O 3.02Å; L722-F816 HydrophobicContact CB-CB 4.16Å; L722-F816 HydrophobicContact CB-CD2 4.34Å; L722-F816 HydrophobicContact CD1-CB 4.49Å; L722-F816 PolarHBondContact N-O 3.02Å; L722-F816 PolarHBondContact O-N 3.05Å; L726-F816 HydrophobicContact CD2-CD2 3.65Å; L726-F816 HydrophobicContact CD2-CE2 3.52Å; L726-F816 HydrophobicContact CD2-CG 4.35Å; L726-F816 HydrophobicContact CD2-CZ 4.15Å; F768-F816 AromaticContact CD1-CD1 3.67Å; F768-F816 HydrophobicContact CD1-CD1 3.67Å; F768-F816 AromaticContact CD1-CE1 3.74Å; F768-F816 HydrophobicContact CD1-CE1 3.74Å; F768-F816 HydrophobicContact CD1-CG 4.06Å; F768-F816 HydrophobicContact CD1-CZ 4.18Å; F768-F816 HydrophobicContact CE1-CB 4.13Å; F768-F816 AromaticContact CE1-CD1 3.93Å; F768-F816 HydrophobicContact CE1-CD1 3.93Å; F768-F816 HydrophobicContact CE1-CE1 4.45Å; F768-F816 AromaticContact CE1-CG 3.97Å; F768-F816 HydrophobicContact CE1-CG 3.97Å; T772-F816 HydrophobicContact CG2-CE1 3.5Å; T772-F816 HydrophobicContact CG2-CZ 3.32Å; V807-F816 HydrophobicContact CG1-CB 4.42Å; V807-F816 HydrophobicContact CG1-CD1 4.23Å; S808-F816 VanDerWaalsContact O-CA 3.29Å; S808-F816 WeakPolarHBondContact O-CA 3.4Å; Y809-F816 AromaticContact CD2-CD1 3.5Å; Y809-F816 HydrophobicContact CD2-CD1 3.5Å; Y809-F816 HydrophobicContact CD2-CD2 4.01Å; Y809-F816 AromaticContact CD2-CE1 3.46Å; Y809-F816 HydrophobicContact CD2-CE1 3.46Å; Y809-F816 VanDerWaalsContact CD2-CE1 3.46Å; Y809-F816 AromaticContact CD2-CE2 3.98Å; Y809-F816 HydrophobicContact CD2-CE2 3.98Å; Y809-F816 AromaticContact CD2-CG 3.79Å; Y809-F816 HydrophobicContact CD2-CG 3.79Å; Y809-F816 AromaticContact CD2-CZ 3.72Å; Y809-F816 HydrophobicContact CD2-CZ 3.72Å; Y809-F816 HydrophobicContact CE2-CD1 4.45Å; Y809-F816 HydrophobicContact CE2-CD2 4.29Å; Y809-F816 HydrophobicContact CE2-CE1 4.16Å; Y809-F816 HydrophobicContact CE2-CE2 4Å; Y809-F816 AromaticContact CE2-CZ 3.94Å; Y809-F816 HydrophobicContact CE2-CZ 3.94Å; Y809-F816 HydrophobicContact CG-CD1 4.06Å; Y809-F816 AromaticContact CG-CE1 3.93Å; Y809-F816 HydrophobicContact CG-CE1 3.93Å
817	I	90.8	Very high	83.2	Confident	17 Å²	17	49.6 Å²	49.6	9%	0.087	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.3	173	-51.5	175.9	0	0	0	107.2	F664 Y721 V807 S808 I815	F664-I817 WeakPolarHBondContact O-CD1 3.49Å; Y721-I817 HydrophobicContact CD1-CG1 4Å; Y721-I817 HydrophobicContact CE1-CD1 4.02Å; Y721-I817 HydrophobicContact CE1-CG1 3.92Å; Y721-I817 HydrophobicContact CE1-CG2 4.12Å; V807-I817 WeakPolarHBondContact CA-O 3.45Å; S808-I817 PolarHBondContact N-O 3.33Å; S808-I817 PolarHBondContact O-N 3.49Å; I815-I817 HydrophobicContact CG2-CG1 4.3Å
818	C	91.5	Very high	80.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	102.7	-176.7	-54.6	0	0	0	0	110.1	H719 T720 L806 V807 N820	H719-C818 CarbonylContact C-O 3.47Å; H719-C818 WeakPolarHBondContact CA-O 3.47Å; T720-C818 PolarHBondContact N-O 3.4Å; T720-C818 PolarHBondContact O-N 3.45Å; L806-C818 CarbonylContact O-C 3.57Å; L806-C818 WeakPolarHBondContact O-CA 3.35Å; V807-C818 HydrophobicContact CG2-CB 4.09Å; C818-N820 PolarHBondContact O-N 3.26Å
819	S	90.5	Very high	77.8	Confident	30 Å²	30	59.9 Å²	59.9	21%	0.21	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	96.8	169.3	-52.1	0	0	0	0	109.1	H719 S805 L806	H719-S819 PolarHBondContact CD2-OG 2.91Å; H719-S819 PolarHBondContact NE2-OG 3.47Å; S805-S819 WeakPolarHBondContact CA-O 3.4Å; L806-S819 PolarHBondContact N-O 3.46Å; L806-S819 PolarHBondContact O-N 2.99Å
820	N	90.4	Very high	74.8	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.2	176.3	-43.5	-59.1	0	0	0	109.6	Q717 C718 T720 Y752 I803 S805 C818	Q717-N820 VanDerWaalsContact CA-O 3.23Å; Q717-N820 WeakPolarHBondContact CA-O 3.39Å; C718-N820 PolarHBondContact N-O 2.86Å; C718-N820 PolarHBondContact O-N 2.83Å; C718-N820 PolarHBondContact SG-ND2 3.22Å; T720-N820 PolarHBondContact OG1-ND2 3.44Å; Y752-N820 PolarHBondContact OH-OD1 3.26Å; I803-N820 HydrophobicContact CD1-CB 4.17Å; S805-N820 WeakPolarHBondContact CB-OD1 3.31Å; S805-N820 PolarHBondContact OG-OD1 3.4Å; C818-N820 PolarHBondContact O-N 3.26Å
821	Q	87	Confident	71.9	Confident	56 Å²	56	68.4 Å²	68.4	26%	0.262	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.5	170.1	176.9	-177.3	15.6	0	0	108.8	F716 Q717 I803 R804	F716-Q821 WeakPolarHBondContact O-CA 3.32Å; Q717-Q821 HydrophobicContact CG-CB 4.25Å; Q717-Q821 HydrophobicContact CG-CG 4.33Å; I803-Q821 WeakPolarHBondContact CA-O 3.49Å; R804-Q821 HydrophobicContact CG-CB 3.89Å; R804-Q821 HydrophobicContact CG-CG 4.44Å; R804-Q821 VanDerWaalsContact CZ-OE1 3.3Å; R804-Q821 PolarHBondContact N-O 2.94Å; R804-Q821 PolarHBondContact O-N 3.5Å
822	F	85.6	Confident	69.1	Low	45 Å²	45	67.8 Å²	67.8	20%	0.197	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	139.5	173.7	176	-102.2	0	0	0	111.1	F716 D737 R801 G824	F716-F822 HydrophobicContact CB-CB 4.34Å; F716-F822 HydrophobicContact CD1-CD1 4.24Å; F716-F822 PolarHBondContact O-N 3.01Å; D737-F822 VanDerWaalsContact O-CD2 3.27Å; D737-F822 WeakPolarHBondContact O-CD2 3.42Å; R801-F822 HydrophobicContact CB-CD2 4.26Å; R801-F822 HydrophobicContact CB-CE2 3.91Å; R801-F822 HydrophobicContact CG-CE2 3.98Å; F822-G824 WeakPolarHBondContact CE2-O 3.3Å; F822-G824 VanDerWaalsContact CZ-CA 3.44Å
823	L	83.8	Confident	66.3	Low	56 Å²	56	66.7 Å²	66.7	29%	0.293	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-17.8	-176.9	-67.1	173.6	0	0	0	114	P782 W802 R804	P782-L823 HydrophobicContact CB-CD1 3.65Å; P782-L823 HydrophobicContact CG-CD1 3.7Å; W802-L823 HydrophobicContact CB-CB 3.99Å; W802-L823 WeakPolarHBondContact O-CB 3.24Å; W802-L823 PolarHBondContact O-N 3.14Å; R804-L823 HydrophobicContact CB-CD1 3.93Å; R804-L823 HydrophobicContact CG-CD1 3.91Å; R804-L823 HydrophobicContact CG-CD2 4.12Å; R804-L823 HydrophobicContact CG-CG 4.08Å
824	G	76.7	Confident	63.4	Low	13 Å²	13	65 Å²	65	13%	0.134	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.2	160.4	-178.6	0	0	0	0	0	112.9	W802 F822	W802-G824 PolarHBondContact N-O 3.04Å; F822-G824 WeakPolarHBondContact CE2-O 3.3Å; F822-G824 VanDerWaalsContact CZ-CA 3.44Å
825	S	69.4	Low	60.4	Low	51 Å²	51	65.8 Å²	65.8	36%	0.357	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	159.5	172.7	49.3	0	0	0	0	111.5
826	C	55.9	Low	57.4	Low	20 Å²	20	70.3 Å²	70.3	14%	0.135	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	101.5	170.1	-165.9	0	0	0	0	108.6	Y800 L828	Y800-C826 WeakPolarHBondContact O-CB 3.21Å; Y800-C826 PolarHBondContact O-N 3.18Å; C826-L828 PolarHBondContact O-N 3.32Å
827	E	45.2	Very low	54.2	Low	120 Å²	120	77.7 Å²	77.7	56%	0.561	45%	0.452	S	S	*	.			trans	-73.5	117.6	168.3	-67.7	177.7	-176.8	0	0	108.9	Y829	E827-Y829 HydrophobicContact CB-CD2 4.23Å; E827-Y829 HydrophobicContact CB-CE2 3.77Å; E827-Y829 WeakPolarHBondContact OE2-CE2 3.39Å; E827-Y829 PolarHBondContact OE2-OH 2.91Å
828	L	41	Very low	51.2	Low	76 Å²	76	88.5 Å²	88.5	40%	0.398	49%	0.492	S	S	.	.			trans	-99	78.6	177.4	-89.4	172.4	0	0	0	109.6	E797 Y800 C826 D830	E797-L828 WeakPolarHBondContact CG-O 3.21Å; Y800-L828 HydrophobicContact CD2-CD1 3.89Å; Y800-L828 HydrophobicContact CE2-CD1 4.19Å; C826-L828 PolarHBondContact O-N 3.32Å; L828-D830 PolarHBondContact O-N 2.84Å; L828-D830 VanDerWaalsContact O-N 3.11Å
829	Y	29.1	Very low	48.1	Very low	176 Å²	176	95.3 Å²	95.3	69%	0.69	53%	0.527	S	S	*	.			trans	-51.9	117.4	174.9	-73.1	-91.1	0	0	0	111.5	E797 E827 C831	E797-Y829 WeakPolarHBondContact OE1-CA 3.47Å; E827-Y829 HydrophobicContact CB-CD2 4.23Å; E827-Y829 HydrophobicContact CB-CE2 3.77Å; E827-Y829 WeakPolarHBondContact OE2-CE2 3.39Å; E827-Y829 PolarHBondContact OE2-OH 2.91Å; Y829-C831 PolarHBondContact O-N 3.34Å
830	D	28.4	Very low	45	Very low	114 Å²	114	100.4 Å²	100.4	61%	0.61	55%	0.551	S	S	*	*			trans	-62.7	119.4	-179.4	-101.6	-24	0	0	0	110.7	E797 L828	E797-D830 HydrophobicContact CG-CB 4.15Å; E797-D830 WeakPolarHBondContact OE1-CB 3.34Å; E797-D830 PolarHBondContact OE1-N 3.17Å; L828-D830 PolarHBondContact O-N 2.84Å; L828-D830 VanDerWaalsContact O-N 3.11Å
831	C	25.9	Very low	42	Very low	127 Å²	127	105.3 Å²	105.3	86%	0.858	59%	0.586	S	S	*	*			trans	-122.8	105.4	165.4	-94.3	0	0	0	0	109.6	Y829	Y829-C831 PolarHBondContact O-N 3.34Å
832	A	26	Very low	39.2	Very low	97 Å²	97	106.4 Å²	106.4	80%	0.802	60%	0.596	S	S	*	*			trans	-58	135.8	-177.3	0	0	0	0	0	113.1	G834	A832-G834 PolarHBondContact O-N 3.38Å
833	V	24.5	Very low	36.5	Very low	156 Å²	156	108.7 Å²	108.7	95%	0.945	61%	0.614	S	S	*	*	S	Bend	trans	14.4	87.7	155.8	-168.9	0	0	0	0	115.6
834	G	23.7	Very low	33.9	Very low	68 Å²	68	112.8 Å²	112.8	70%	0.701	63%	0.63	S	S	*	*			trans	-166.8	129.5	173.8	0	0	0	0	0	112.3	A832	A832-G834 PolarHBondContact O-N 3.38Å
835	S	23.7	Very low	31.5	Very low	105 Å²	105	120.8 Å²	120.8	73%	0.734	66%	0.664	S	S	*	*			trans	-53.3	141.5	177	52.4	0	0	0	0	113.7
836	N	25	Very low	29.6	Very low	141 Å²	141	123.9 Å²	123.9	75%	0.754	68%	0.676	S	S	*	*	S	Bend	trans	110.3	100.6	160.6	-55.2	-45.5	0	0	0	117
837	Q	24.3	Very low	28.2	Very low	162 Å²	162	127.8 Å²	127.8	76%	0.757	70%	0.704	S	S	*	*			trans	20.9	103.8	141.6	-60.2	177.1	0.1	0	0	117.6
838	R	27.5	Very low	27.4	Very low	245 Å²	245	130.5 Å²	130.5	93%	0.925	71%	0.714	S	S	*	*			trans	-145.5	157.6	157.7	-109.6	166.7	-177	-177.3	-1.9	111.9
839	L	26.5	Very low	26.7	Very low	142 Å²	142	136.3 Å²	136.3	74%	0.743	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-72.1	145.2	-164.2	-84.2	68.7	0	0	0	113.2
840	L	25.9	Very low	26.5	Very low	137 Å²	137	134.5 Å²	134.5	72%	0.717	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-72.8	126.4	154	-79.1	152.4	0	0	0	109.2
841	S	27.1	Very low	26.4	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-103.1	116.5	165.5	48.7	0	0	0	0	109.4
842	V	28.6	Very low	26.4	Very low	78 Å²	78	139.1 Å²	139.1	47%	0.473	74%	0.737	S	S	.	*			trans	-94.9	112.5	173.1	-178.7	0	0	0	0	108.5	F844	V842-F844 HydrophobicContact CB-CE2 4.33Å; V842-F844 HydrophobicContact CG1-CD2 3.76Å; V842-F844 HydrophobicContact CG1-CE2 3.54Å; V842-F844 HydrophobicContact CG1-CG 4.4Å; V842-F844 HydrophobicContact CG1-CZ 4.01Å; V842-F844 PolarHBondContact O-N 2.99Å
843	T	27.7	Very low	26.4	Very low	94 Å²	94	140.8 Å²	140.8	58%	0.577	73%	0.731	S	S	*	*			trans	-84	93.8	169.7	28	0	0	0	0	109.7	E845	T843-E845 PolarHBondContact O-N 2.82Å; T843-E845 VanDerWaalsContact O-N 3.15Å
844	F	28.7	Very low	26.4	Very low	141 Å²	141	142.1 Å²	142.1	62%	0.618	72%	0.724	S	S	*	*			trans	-74.4	95.4	160.5	-72.7	-79.6	0	0	0	108.5	V842 N846	V842-F844 HydrophobicContact CB-CE2 4.33Å; V842-F844 HydrophobicContact CG1-CD2 3.76Å; V842-F844 HydrophobicContact CG1-CE2 3.54Å; V842-F844 HydrophobicContact CG1-CG 4.4Å; V842-F844 HydrophobicContact CG1-CZ 4.01Å; V842-F844 PolarHBondContact O-N 2.99Å; F844-N846 PolarHBondContact O-N 3.43Å
845	E	27.6	Very low	26.7	Very low	182 Å²	182	144.2 Å²	144.2	85%	0.85	72%	0.718	S	S	*	*			trans	-67.2	87.2	162.1	-82.9	-155.5	132	0	0	109.1	T843 S847	T843-E845 PolarHBondContact O-N 2.82Å; T843-E845 VanDerWaalsContact O-N 3.15Å; E845-S847 PolarHBondContact O-N 3.22Å
846	N	28.3	Very low	26.7	Very low	115 Å²	115	144.1 Å²	144.1	62%	0.615	71%	0.71	S	S	*	*			trans	-71.7	109.6	174.4	-111.2	-13.2	0	0	0	108.9	F844 F848	F844-N846 PolarHBondContact O-N 3.43Å; N846-F848 HydrophobicContact CB-CB 4.36Å; N846-F848 PolarHBondContact O-N 3.3Å
847	S	27.9	Very low	26.9	Very low	102 Å²	102	141.9 Å²	141.9	71%	0.713	70%	0.698	S	S	*	*			trans	-63.9	17	163	-57	0	0	0	0	113.9	E845 K849	E845-S847 PolarHBondContact O-N 3.22Å; S847-K849 PolarHBondContact O-N 3.24Å
848	F	27.7	Very low	26.9	Very low	178 Å²	178	139.2 Å²	139.2	78%	0.781	69%	0.693	S	S	*	*			trans	-81.1	84	166.2	-84.9	-81.7	0	0	0	109.9	N846 Q850	N846-F848 HydrophobicContact CB-CB 4.36Å; N846-F848 PolarHBondContact O-N 3.3Å; F848-Q850 PolarHBondContact O-N 3.33Å
849	K	27.4	Very low	27.1	Very low	197 Å²	197	133.9 Å²	133.9	86%	0.857	69%	0.687	S	S	*	*			trans	-60.3	105.2	163.7	-78.7	-176.4	175.1	178.9	0	109.8	S847	S847-K849 PolarHBondContact O-N 3.24Å
850	Q	24.6	Very low	27.1	Very low	139 Å²	139	134 Å²	134	65%	0.65	69%	0.689	S	S	*	*			trans	31.6	97.5	140.9	-163.6	175.5	19.7	0	0	116.9	F848 E852	F848-Q850 PolarHBondContact O-N 3.33Å; Q850-E852 HydrophobicContact CG-CB 4.37Å; Q850-E852 HydrophobicContact CG-CG 4.28Å; Q850-E852 PolarHBondContact NE2-OE2 3.07Å
851	F	25.4	Very low	27.2	Very low	195 Å²	195	134.4 Å²	134.4	86%	0.855	69%	0.692	S	S	*	*			trans	-108.9	75	146.4	-91	-82.5	0	0	0	109.3	L853	F851-L853 PolarHBondContact O-N 2.91Å
852	E	25.7	Very low	27.3	Very low	143 Å²	143	133.6 Å²	133.6	67%	0.668	69%	0.686	S	S	*	*			trans	-68.6	86.7	155	-82.2	-175.8	114.5	0	0	108	Q850 K854	Q850-E852 HydrophobicContact CG-CB 4.37Å; Q850-E852 HydrophobicContact CG-CG 4.28Å; Q850-E852 PolarHBondContact NE2-OE2 3.07Å; E852-K854 VanDerWaalsContact C-N 3.27Å; E852-K854 PolarHBondContact O-N 3.3Å
853	L	26.2	Very low	27.2	Very low	131 Å²	131	137.1 Å²	137.1	69%	0.686	70%	0.702	S	S	*	*			trans	-70.7	88.1	172.8	-111.7	160.6	0	0	0	109.1	F851 I855	F851-L853 PolarHBondContact O-N 2.91Å; L853-I855 HydrophobicContact CD2-CG1 4.19Å; L853-I855 PolarHBondContact O-N 3.24Å
854	K	24.7	Very low	27.4	Very low	184 Å²	184	140.1 Å²	140.1	80%	0.8	71%	0.713	S	S	*	*			trans	-59.4	85.3	161.5	-89.9	-179.6	171.8	172.3	0	109.3	E852 N856	E852-K854 VanDerWaalsContact C-N 3.27Å; E852-K854 PolarHBondContact O-N 3.3Å; K854-N856 VanDerWaalsContact C-N 3.31Å; K854-N856 PolarHBondContact O-N 3.36Å; K854-N856 VanDerWaalsContact O-N 3.1Å
855	I	29.6	Very low	27.2	Very low	113 Å²	113	137.9 Å²	137.9	58%	0.579	72%	0.715	S	S	*	*			trans	-80.6	88.6	164.7	-58.2	-179.4	0	0	0	107.2	L853 N857	L853-I855 HydrophobicContact CD2-CG1 4.19Å; L853-I855 PolarHBondContact O-N 3.24Å; I855-N857 PolarHBondContact O-N 2.88Å
856	N	24.9	Very low	27.3	Very low	103 Å²	103	134.2 Å²	134.2	55%	0.551	71%	0.71	S	S	*	*			trans	-61.2	115.7	162.1	-74.1	-25.5	0	0	0	107.8	Q466 K854	Q466-N856 PolarHBondContact NE2-O 3.3Å; K854-N856 VanDerWaalsContact C-N 3.31Å; K854-N856 PolarHBondContact O-N 3.36Å; K854-N856 VanDerWaalsContact O-N 3.1Å
857	N	28	Very low	27.4	Very low	94 Å²	94	136.6 Å²	136.6	50%	0.503	72%	0.717	S	S	.	*			trans	-109.2	80.4	163.3	-85.2	-14.8	0	0	0	110.2	N468 I855 T859	N468-N857 PolarHBondContact ND2-ND2 2.79Å; N468-N857 PolarHBondContact ND2-OD1 2.96Å; N468-N857 PolarHBondContact OD1-ND2 2.9Å; N468-N857 PolarHBondContact OD1-OD1 3.38Å; N468-N857 VanDerWaalsContact OD1-OD1 3.12Å; I855-N857 PolarHBondContact O-N 2.88Å; N857-T859 PolarHBondContact O-N 3.34Å
858	T	25.2	Very low	27.5	Very low	106 Å²	106	137.7 Å²	137.7	65%	0.65	72%	0.715	S	S	*	*			trans	-65.5	104	162.9	44.1	0	0	0	0	110
859	T	30.8	Very low	27.5	Very low	133 Å²	133	139.1 Å²	139.1	82%	0.816	72%	0.721	S	S	*	*			trans	-129.9	113	152.6	26.9	0	0	0	0	109.1	N857 N861	N857-T859 PolarHBondContact O-N 3.34Å; T859-N861 PolarHBondContact O-N 3.15Å
860	N	26.5	Very low	27.5	Very low	145 Å²	145	137.6 Å²	137.6	78%	0.775	72%	0.719	S	S	*	*			trans	-60.2	131.8	172.9	-59.8	-40.8	0	0	0	109.5
861	N	29.5	Very low	27.6	Very low	145 Å²	145	141.9 Å²	141.9	78%	0.775	73%	0.729	S	S	*	*				-175.2	114.5	105.8	-91.1	-19.4	0	0	0	112.9	T859	T859-N861 PolarHBondContact O-N 3.15Å
862	S	28.9	Very low	27.7	Very low	88 Å²	88	136 Å²	136	62%	0.615	71%	0.71	S	S	*	*			trans	42.3	110.5	135.2	64.1	0	0	0	0	120.4
863	N	27.1	Very low	27.7	Very low	151 Å²	151	138.3 Å²	138.3	81%	0.807	72%	0.718	S	S	*	*			trans	80.8	156.6	130.3	-57.2	-17.4	0	0	0	119.8
864	I	30.3	Very low	27.7	Very low	157 Å²	157	137.3 Å²	137.3	81%	0.805	71%	0.713	S	S	*	*			trans	73.4	73.9	177.3	-45	172.2	0	0	0	112.1
865	S	25.7	Very low	27.9	Very low	95 Å²	95	138.8 Å²	138.8	66%	0.664	72%	0.715	S	S	*	*				71.9	137.7	67.2	86.8	0	0	0	0	115
866	S	28.7	Very low	27.9	Very low	105 Å²	105	139.1 Å²	139.1	73%	0.734	72%	0.718	S	S	*	*			trans	73.5	142.5	175.5	83	0	0	0	0	115.9
867	Q	31	Very low	27.9	Very low	164 Å²	164	140.6 Å²	140.6	77%	0.766	73%	0.733	S	S	*	*			cis	-162.3	146.8	-14.7	-119	166.4	-0.5	0	0	108.4
868	N	30	Very low	28	Very low	126 Å²	126	139.8 Å²	139.8	67%	0.674	74%	0.735	S	S	*	*			trans	48.4	106.9	150.8	-53.2	-26.5	0	0	0	119.5
869	F	28.4	Very low	28.3	Very low	208 Å²	208	142.7 Å²	142.7	91%	0.912	75%	0.746	S	S	*	*				-171.9	73.5	107.6	-105.4	-70.9	0	0	0	110.8
870	M	25.7	Very low	28.2	Very low	164 Å²	164	142.2 Å²	142.2	81%	0.808	74%	0.735	S	S	*	*			trans	-88.2	128.1	165.3	-159.8	-175.4	-163.1	0	0	108.4	T872	M870-T872 HydrophobicContact CE-CG2 3.64Å; M870-T872 HydrophobicContact CG-CG2 4.41Å; M870-T872 HydrophobicContact SD-CG2 4.29Å
871	R	27.2	Very low	28.3	Very low	230 Å²	230	139.4 Å²	139.4	87%	0.868	73%	0.727	S	S	*	*			trans	-135	84.6	160.3	-155.6	177.3	-149.6	176.3	8	109.3
872	T	27.5	Very low	28.3	Very low	72 Å²	72	136 Å²	136	44%	0.442	71%	0.714	S	S	.	*			trans	-54	134.4	166.3	30.6	0	0	0	0	110.6	M870 N874	M870-T872 HydrophobicContact CE-CG2 3.64Å; M870-T872 HydrophobicContact CG-CG2 4.41Å; M870-T872 HydrophobicContact SD-CG2 4.29Å; T872-N874 VanDerWaalsContact CB-OD1 3.32Å; T872-N874 WeakPolarHBondContact CB-OD1 3.33Å; T872-N874 WeakPolarHBondContact CG2-OD1 3.26Å; T872-N874 PolarHBondContact O-N 3.13Å
873	F	25.7	Very low	28.3	Very low	191 Å²	191	137 Å²	137	84%	0.838	71%	0.711	S	S	*	*			trans	-90.2	74.4	149.7	-86.2	-78.1	0	0	0	107.5
874	N	27.4	Very low	28.4	Very low	109 Å²	109	134 Å²	134	58%	0.583	70%	0.696	S	S	*	*			trans	-69.2	126	156.4	-68	0.2	0	0	0	106	T872	T872-N874 VanDerWaalsContact CB-OD1 3.32Å; T872-N874 WeakPolarHBondContact CB-OD1 3.33Å; T872-N874 WeakPolarHBondContact CG2-OD1 3.26Å; T872-N874 PolarHBondContact O-N 3.13Å
875	Y	27.4	Very low	28.3	Very low	215 Å²	215	131.6 Å²	131.6	84%	0.843	69%	0.692	S	S	*	*			trans	-111.1	101.1	161	-122.9	-83	0	0	0	106.3	P877	Y875-P877 WeakPolarHBondContact O-CD 3.46Å
876	D	29.6	Very low	28.4	Very low	120 Å²	120	137.6 Å²	137.6	64%	0.642	70%	0.7	S	S	*	*			trans	-65.9	124	-177.3	-66.8	-51.6	0	0	0	110.9	S878	D876-S878 PolarHBondContact O-N 3.49Å
877	P	25.5	Very low	28.3	Very low	135 Å²	135	141.8 Å²	141.8	88%	0.877	70%	0.701	S	S	*	*			trans	-88.4	60.6	164.3	36.7	-30.8	0	0	0	109.3	Y875	Y875-P877 WeakPolarHBondContact O-CD 3.46Å
878	S	30.2	Very low	28.4	Very low	77 Å²	77	141 Å²	141	54%	0.538	70%	0.697	S	S	.	*			trans	-158.9	86.2	173.8	61.5	0	0	0	0	111.8	D876	D876-S878 PolarHBondContact O-N 3.49Å
879	N	31.9	Very low	28.5	Very low	166 Å²	166	143 Å²	143	89%	0.888	70%	0.703	S	S	*	*			trans	-160	70.3	150.1	-107.2	-14.4	0	0	0	109.1	S881	N879-S881 PolarHBondContact O-N 3.32Å
880	E	28.3	Very low	28.5	Very low	123 Å²	123	139.9 Å²	139.9	58%	0.575	69%	0.691	S	S	*	*			trans	-59.6	116.6	148.2	-71.3	171	-151.1	0	0	107.9	S1106	E880-S1106 VanDerWaalsContact CD-OG 3.23Å; E880-S1106 WeakPolarHBondContact OE1-CB 3.19Å; E880-S1106 WeakPolarHBondContact OE2-CB 3.43Å; E880-S1106 PolarHBondContact OE2-OG 3.15Å
881	S	28.4	Very low	28.8	Very low	87 Å²	87	138.3 Å²	138.3	61%	0.608	69%	0.693	S	S	*	*				165.4	139.1	119.8	48.9	0	0	0	0	110.6	N879	N879-S881 PolarHBondContact O-N 3.32Å
882	S	28.8	Very low	28.8	Very low	72 Å²	72	135.6 Å²	135.6	50%	0.503	69%	0.688	S	S	.	*			trans	72.3	121.3	149.4	85.7	0	0	0	0	118.4	F1103	S882-F1103 VanDerWaalsContact CA-O 3.31Å; S882-F1103 WeakPolarHBondContact CA-O 3.4Å
883	I	30.1	Very low	29	Very low	110 Å²	110	137.4 Å²	137.4	56%	0.564	70%	0.703	S	S	*	*			trans	105.6	97	130.1	-65.7	157.4	0	0	0	120.4	S885 P1102 F1103	I883-S885 PolarHBondContact O-N 3.32Å; I883-P1102 VanDerWaalsContact CA-CG 3.48Å; I883-P1102 HydrophobicContact CB-CG 3.94Å; I883-P1102 HydrophobicContact CG1-CG 3.79Å; I883-P1102 HydrophobicContact CG2-CG 4.03Å; I883-F1103 PolarHBondContact N-O 3.46Å
884	N	27.5	Very low	29.3	Very low	89 Å²	89	136.4 Å²	136.4	48%	0.476	70%	0.699	S	S	.	*			trans	-41.1	130.7	150.5	-81.7	-48.3	0	0	0	110.5	P1102 F1103	N884-P1102 HydrophobicContact CB-CB 3.44Å; N884-P1102 VanDerWaalsContact CB-CB 3.44Å; N884-P1102 HydrophobicContact CB-CG 3.55Å; N884-P1102 WeakPolarHBondContact ND2-CB 3.41Å; N884-F1103 VanDerWaalsContact OD1-CD2 3.3Å; N884-F1103 WeakPolarHBondContact OD1-CD2 3.48Å; N884-F1103 VanDerWaalsContact OD1-CE2 3.24Å; N884-F1103 WeakPolarHBondContact OD1-CE2 3.33Å
885	S	30.2	Very low	29.3	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	71%	0.707	S	S	*	*				-170.9	113.4	114.3	31.5	0	0	0	0	113.1	I883	I883-S885 PolarHBondContact O-N 3.32Å
886	R	27.7	Very low	29.3	Very low	221 Å²	221	134.8 Å²	134.8	83%	0.834	70%	0.704	S	S	*	*				23.7	119.4	122.1	-100.4	-166.1	-87.9	-174.2	-7.8	118.7
887	Y	26.1	Very low	29.2	Very low	193 Å²	193	139.1 Å²	139.1	76%	0.757	71%	0.711	S	S	*	*			trans	63.2	131.4	155.8	-63	-85.5	0	0	0	116.7
888	H	32.9	Very low	29.4	Very low	147 Å²	147	140.1 Å²	140.1	68%	0.681	71%	0.707	S	S	*	*				-164.4	144.5	69.6	-100.8	-92	0	0	0	115.1
889	Q	32.3	Very low	29.2	Very low	169 Å²	169	140.7 Å²	140.7	79%	0.79	71%	0.711	S	S	*	*			trans	63.5	122.5	140.8	-71.4	167.8	5.1	0	0	122.7
890	Q	28	Very low	28.9	Very low	142 Å²	142	140.4 Å²	140.4	66%	0.664	71%	0.71	S	S	*	*			trans	-67.1	172.5	162.5	-51.5	176.7	-55.1	0	0	112.1
891	P	31.5	Very low	28.9	Very low	132 Å²	132	140 Å²	140	86%	0.857	72%	0.721	S	S	*	*				-120.2	127.1	119.2	32.9	-30.5	0	0	0	113.5
892	K	27.6	Very low	28.9	Very low	173 Å²	173	141.4 Å²	141.4	75%	0.752	73%	0.73	S	S	*	*			trans	-77.2	130.1	170.3	-73.7	159.8	168.1	155.6	0	110.9
893	S	31.9	Very low	28.8	Very low	110 Å²	110	143.6 Å²	143.6	77%	0.769	75%	0.746	S	S	*	*			trans	179.1	145.9	136.3	64.1	0	0	0	0	108.6
894	K	31.3	Very low	28.6	Very low	169 Å²	169	147.8 Å²	147.8	74%	0.735	76%	0.755	S	S	*	*			cis	-132	151.1	9.9	-68.4	172.2	175.2	171.6	0	111
895	Q	27.6	Very low	28.4	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.752	77%	0.773	S	S	*	*			trans	-69.3	137.7	163.9	-70.9	172.6	-20.8	0	0	110.8
896	V	28.5	Very low	28.3	Very low	129 Å²	129	148 Å²	148	78%	0.782	76%	0.76	S	S	*	*			trans	-125.4	97.4	144.8	175.9	0	0	0	0	106.6	I898	V896-I898 HydrophobicContact CG1-CD1 4.41Å; V896-I898 HydrophobicContact CG1-CG1 4.15Å; V896-I898 PolarHBondContact O-N 2.83Å
897	R	26.7	Very low	28.1	Very low	211 Å²	211	148.4 Å²	148.4	80%	0.796	76%	0.761	S	S	*	*			trans	-75.3	117	164.9	-91.1	-179.5	175.1	158.1	-3.2	107.8
898	I	29.5	Very low	28.2	Very low	156 Å²	156	145.3 Å²	145.3	80%	0.8	76%	0.757	S	S	*	*			trans	-121.4	98.4	151.5	-62	179.2	0	0	0	106.6	V896	V896-I898 HydrophobicContact CG1-CD1 4.41Å; V896-I898 HydrophobicContact CG1-CG1 4.15Å; V896-I898 PolarHBondContact O-N 2.83Å
899	S	26	Very low	27.8	Very low	89 Å²	89	147.4 Å²	147.4	62%	0.622	76%	0.764	S	S	*	*			trans	-80.3	149.4	170.5	36.5	0	0	0	0	110.9
900	N	26.4	Very low	27.7	Very low	161 Å²	161	147.6 Å²	147.6	86%	0.861	76%	0.763	S	S	*	*			trans	54.8	96.1	153.8	-60.6	-10.6	0	0	0	118.6
901	S	29.2	Very low	27.7	Very low	114 Å²	114	145.5 Å²	145.5	80%	0.797	76%	0.764	S	S	*	*			trans	-149.4	104.3	138.8	56.8	0	0	0	0	113.8	S903	S901-S903 PolarHBondContact O-N 2.8Å
902	S	26.6	Very low	27.4	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	76%	0.762	S	S	*	*			trans	37	71.8	135.6	177.1	0	0	0	0	118.5	R904	S902-R904 PolarHBondContact O-N 3.1Å
903	S	28.4	Very low	27.6	Very low	118 Å²	118	143.6 Å²	143.6	83%	0.825	77%	0.766	S	S	*	*			trans	-88.7	83.3	154.4	57.6	0	0	0	0	110.3	S901 S905	S901-S903 PolarHBondContact O-N 2.8Å; S903-S905 PolarHBondContact O-N 3.48Å; S903-S905 VanDerWaalsContact O-N 3.07Å
904	R	24.7	Very low	27.3	Very low	199 Å²	199	142.9 Å²	142.9	75%	0.751	76%	0.761	S	S	*	*			trans	-54.6	103.8	171.8	179.3	-168.3	-166.6	-152.1	8.9	110.9	S902 V906	S902-R904 PolarHBondContact O-N 3.1Å; R904-V906 VanDerWaalsContact C-N 3.33Å; R904-V906 HydrophobicContact CG-CG2 4.02Å; R904-V906 PolarHBondContact O-N 3.44Å
905	S	24.4	Very low	27.1	Very low	124 Å²	124	143 Å²	143	87%	0.867	77%	0.769	S	S	*	*			trans	-64	99.1	158.6	-80.7	0	0	0	0	108.3	S903 R907	S903-S905 PolarHBondContact O-N 3.48Å; S903-S905 VanDerWaalsContact O-N 3.07Å; S905-R907 PolarHBondContact O-N 3.3Å
906	V	27.1	Very low	27.1	Very low	75 Å²	75	140 Å²	140	46%	0.455	76%	0.761	S	S	.	*			trans	-63.9	124.2	-178.3	171.2	0	0	0	0	108.8	R904 L908	R904-V906 VanDerWaalsContact C-N 3.33Å; R904-V906 HydrophobicContact CG-CG2 4.02Å; R904-V906 PolarHBondContact O-N 3.44Å; V906-L908 HydrophobicContact CG1-CD2 4.07Å; V906-L908 HydrophobicContact CG1-CG 4.22Å; V906-L908 PolarHBondContact O-N 3.38Å
907	R	23.7	Very low	27	Very low	229 Å²	229	142 Å²	142	86%	0.864	77%	0.766	S	S	*	*			trans	-59.6	84.7	163.9	-170.7	-179.2	-166.8	175.4	4.5	108.9	S905 K909	S905-R907 PolarHBondContact O-N 3.3Å; R907-K909 VanDerWaalsContact C-N 3.28Å; R907-K909 PolarHBondContact O-N 3.25Å
908	L	28	Very low	27.1	Very low	127 Å²	127	140.2 Å²	140.2	67%	0.665	76%	0.764	S	S	*	*			trans	-72.2	85.6	174.7	-76.1	175.4	0	0	0	109.2	V906 K910	V906-L908 HydrophobicContact CG1-CD2 4.07Å; V906-L908 HydrophobicContact CG1-CG 4.22Å; V906-L908 PolarHBondContact O-N 3.38Å; L908-K910 HydrophobicContact CD2-CD 4.27Å; L908-K910 HydrophobicContact CD2-CG 4.29Å; L908-K910 PolarHBondContact O-N 2.95Å
909	K	25.1	Very low	27.1	Very low	192 Å²	192	140.2 Å²	140.2	84%	0.835	77%	0.766	S	S	*	*			trans	-62.1	96.6	143.8	-78.1	-171.2	172.4	-170.1	0	106.6	R907	R907-K909 VanDerWaalsContact C-N 3.28Å; R907-K909 PolarHBondContact O-N 3.25Å
910	K	30.5	Very low	27.3	Very low	173 Å²	173	140.6 Å²	140.6	75%	0.752	77%	0.769	S	S	*	*			trans	-135.4	123.1	164.9	-86.1	-163.9	172	-172.3	0	110.6	L908	L908-K910 HydrophobicContact CD2-CD 4.27Å; L908-K910 HydrophobicContact CD2-CG 4.29Å; L908-K910 PolarHBondContact O-N 2.95Å
911	S	27.1	Very low	27.4	Very low	98 Å²	98	140.2 Å²	140.2	69%	0.685	77%	0.767	S	S	*	*			trans	-58.5	160.2	165.3	34.7	0	0	0	0	111.8
912	P	25.4	Very low	27.2	Very low	126 Å²	126	142.1 Å²	142.1	82%	0.818	77%	0.766	S	S	*	*			trans	-72.7	133.9	177.8	30.9	-34.6	0	0	0	110.8
913	T	31.1	Very low	27.3	Very low	139 Å²	139	144.4 Å²	144.4	85%	0.853	77%	0.768	S	S	*	*			trans	-163.3	150	158.5	-4.3	0	0	0	0	111.1
914	S	25.1	Very low	27.2	Very low	95 Å²	95	147 Å²	147	66%	0.664	76%	0.764	S	S	*	*			trans	-81.6	149.5	-161.2	55.1	0	0	0	0	116.8
915	L	27.7	Very low	27.2	Very low	170 Å²	170	143.5 Å²	143.5	89%	0.89	77%	0.767	S	S	*	*			trans	-151.8	95	151.5	-104.3	138.2	0	0	0	105
916	V	26.9	Very low	27.4	Very low	98 Å²	98	144.6 Å²	144.6	59%	0.594	76%	0.762	S	S	*	*				55.7	83.5	70.3	-169.5	0	0	0	0	112	K918	V916-K918 HydrophobicContact CG1-CG 4.04Å
917	I	28.4	Very low	27.3	Very low	172 Å²	172	149.3 Å²	149.3	88%	0.882	78%	0.776	S	S	*	*			trans	-102.3	121.2	144	-64.3	176.9	0	0	0	105.1
918	K	27.3	Very low	27.5	Very low	174 Å²	174	146.5 Å²	146.5	76%	0.757	78%	0.777	S	S	*	*			trans	-82.8	137.5	175.1	-72.3	-178.1	173.7	-175.4	0	109.2	V916	V916-K918 HydrophobicContact CG1-CG 4.04Å
919	N	29.7	Very low	27.3	Very low	155 Å²	155	148.2 Å²	148.2	83%	0.829	78%	0.78	S	S	*	*				-156.6	130.8	121.3	-96.7	-11.2	0	0	0	111.2
920	S	30.2	Very low	27.5	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	77%	0.77	S	S	*	*			trans	39.4	93.9	158	51.4	0	0	0	0	120.6
921	N	28	Very low	27.3	Very low	153 Å²	153	145.7 Å²	145.7	82%	0.818	78%	0.779	S	S	*	*				62.3	135.5	117.9	-64.6	1.1	0	0	0	122.7
922	I	25.2	Very low	27.3	Very low	153 Å²	153	147 Å²	147	79%	0.785	77%	0.774	S	S	*	*			trans	70.4	79.9	164	-48.5	158.8	0	0	0	115.5
923	I	28.7	Very low	27.3	Very low	165 Å²	165	146.1 Å²	146.1	85%	0.846	77%	0.771	S	S	*	*			trans	-119.3	107.7	146.8	-62.5	179.1	0	0	0	106.8
924	K	26.9	Very low	27.1	Very low	171 Å²	171	144.7 Å²	144.7	74%	0.743	77%	0.767	S	S	*	*			trans	-61.5	146	169.3	-72.9	177.8	177.4	175.2	0	108.8	I926	K924-I926 PolarHBondContact O-N 2.83Å
925	P	25.2	Very low	27.4	Very low	127 Å²	127	147.5 Å²	147.5	83%	0.825	77%	0.769	S	S	*	*			trans	-69.2	93.9	175.5	29.4	-34	0	0	0	109.8	K927	P925-K927 PolarHBondContact O-N 2.78Å
926	I	27.8	Very low	27.4	Very low	146 Å²	146	150.2 Å²	150.2	75%	0.749	77%	0.769	S	S	*	*			trans	-65	119.1	166.1	-63.6	179	0	0	0	106.7	K924 L928	K924-I926 PolarHBondContact O-N 2.83Å; I926-L928 PolarHBondContact O-N 3.31Å
927	K	25.5	Very low	27.5	Very low	174 Å²	174	151.7 Å²	151.7	76%	0.757	77%	0.773	S	S	*	*			trans	-57.3	103.5	168.7	-71.2	175.5	177.8	174.9	0	107.7	P925 F929	P925-K927 PolarHBondContact O-N 2.78Å; K927-F929 HydrophobicContact CB-CD2 4.31Å; K927-F929 HydrophobicContact CB-CE2 4.19Å; K927-F929 WeakPolarHBondContact O-CD2 3.49Å; K927-F929 PolarHBondContact O-N 2.86Å
928	L	27.4	Very low	27.4	Very low	170 Å²	170	153.7 Å²	153.7	89%	0.89	78%	0.775	S	S	*	*			trans	-67.1	91.5	162.7	-85	164.1	0	0	0	107.1	I926	I926-L928 PolarHBondContact O-N 3.31Å
929	F	24.8	Very low	27.6	Very low	164 Å²	164	154 Å²	154	72%	0.719	78%	0.779	S	S	*	*			trans	-55.9	136.3	168.1	-79.1	-91.7	0	0	0	108.6	K927 F931	K927-F929 HydrophobicContact CB-CD2 4.31Å; K927-F929 HydrophobicContact CB-CE2 4.19Å; K927-F929 WeakPolarHBondContact O-CD2 3.49Å; K927-F929 PolarHBondContact O-N 2.86Å; F929-F931 PolarHBondContact O-N 2.93Å
930	P	29.4	Very low	27.5	Very low	96 Å²	96	155.8 Å²	155.8	62%	0.623	78%	0.782	S	S	*	*			trans	-62.4	134.6	164.3	29	-32	0	0	0	107.6	Q932	P930-Q932 HydrophobicContact CG-CG 4.43Å; P930-Q932 PolarHBondContact O-N 3.12Å
931	F	26.2	Very low	27.5	Very low	216 Å²	216	156.8 Å²	156.8	95%	0.947	79%	0.789	S	S	*	*			trans	-66.9	83.3	159.5	-92	-86	0	0	0	107.9	F929 S933	F929-F931 PolarHBondContact O-N 2.93Å; F931-S933 PolarHBondContact O-N 3.37Å
932	Q	26.3	Very low	27.6	Very low	125 Å²	125	152.9 Å²	152.9	58%	0.584	79%	0.785	S	S	*	*			trans	-65.5	122.4	155.3	-73.8	-178.5	-81.9	0	0	106.6	P930 S934	P930-Q932 HydrophobicContact CG-CG 4.43Å; P930-Q932 PolarHBondContact O-N 3.12Å; Q932-S934 PolarHBondContact O-N 3.06Å
933	S	26.7	Very low	27.7	Very low	107 Å²	107	154.8 Å²	154.8	75%	0.748	79%	0.791	S	S	*	*			trans	-50	121.1	152.3	48	0	0	0	0	107.4	F931 Q935	F931-S933 PolarHBondContact O-N 3.37Å; S933-Q935 PolarHBondContact O-N 3.24Å
934	S	26.5	Very low	27.7	Very low	109 Å²	109	150.7 Å²	150.7	76%	0.762	79%	0.789	S	S	*	*			trans	-53	93.2	-167.4	48.9	0	0	0	0	113.2	Q932	Q932-S934 PolarHBondContact O-N 3.06Å
935	Q	29.8	Very low	27.6	Very low	154 Å²	154	152.5 Å²	152.5	72%	0.72	79%	0.793	S	S	*	*			trans	-84.1	112.6	156.5	-72.9	-175.6	-53.4	0	0	106.5	S933 I937	S933-Q935 PolarHBondContact O-N 3.24Å; Q935-I937 PolarHBondContact O-N 2.84Å; Q935-I937 VanDerWaalsContact O-N 3.07Å
936	Y	28.6	Very low	27.6	Very low	228 Å²	228	152.9 Å²	152.9	89%	0.894	79%	0.788	S	S	*	*			trans	-60.9	111.2	168.6	-93.2	-91.1	0	0	0	108.7	K938	Y936-K938 PolarHBondContact O-N 3.43Å
937	I	28.7	Very low	27.6	Very low	129 Å²	129	154.5 Å²	154.5	66%	0.662	79%	0.792	S	S	*	*			trans	-75.8	112.1	168.8	-65	173.2	0	0	0	106.2	Q935 Q939	Q935-I937 PolarHBondContact O-N 2.84Å; Q935-I937 VanDerWaalsContact O-N 3.07Å; I937-Q939 HydrophobicContact CG2-CG 4.47Å; I937-Q939 PolarHBondContact O-N 3.13Å; I937-Q939 VanDerWaalsContact O-N 3.09Å
938	K	27.2	Very low	27.4	Very low	213 Å²	213	153.5 Å²	153.5	93%	0.926	79%	0.794	S	S	*	*			trans	-60.4	109.7	161.5	-88.3	-175.2	171.6	-175.6	0	107.5	Y936	Y936-K938 PolarHBondContact O-N 3.43Å
939	Q	30.5	Very low	27.2	Very low	181 Å²	181	153.5 Å²	153.5	85%	0.846	79%	0.793	S	S	*	*			trans	-112	126	161.6	-112.5	179.2	-15.6	0	0	108	I937	I937-Q939 HydrophobicContact CG2-CG 4.47Å; I937-Q939 PolarHBondContact O-N 3.13Å; I937-Q939 VanDerWaalsContact O-N 3.09Å
940	Q	28.2	Very low	27.1	Very low	193 Å²	193	150.8 Å²	150.8	90%	0.902	79%	0.794	S	S	*	*			trans	-70.1	127	-178.5	-66.9	155.3	-49.5	0	0	109.7
941	S	30.9	Very low	27	Very low	118 Å²	118	150 Å²	150	83%	0.825	80%	0.803	S	S	*	*			trans	-96.9	111	159.4	54	0	0	0	0	108.4
942	G	29.3	Very low	27	Very low	72 Å²	72	147.1 Å²	147.1	74%	0.742	80%	0.798	S	S	*	*			trans	-74.1	134.9	174.4	0	0	0	0	0	112.1
943	Q	27.8	Very low	27.1	Very low	193 Å²	193	149.2 Å²	149.2	90%	0.902	81%	0.813	S	S	*	*			trans	20.9	126.4	143.5	-66.2	170.1	-32.2	0	0	119
944	G	27.6	Very low	27	Very low	78 Å²	78	152.6 Å²	152.6	80%	0.804	82%	0.817	S	S	*	*			trans	179	51.3	176.4	0	0	0	0	0	114.6
945	Y	25.1	Very low	27.1	Very low	209 Å²	209	155.4 Å²	155.4	82%	0.82	82%	0.822	S	S	*	*			trans	-17.9	129.9	156.5	-84.9	-89.6	0	0	0	118
946	N	26	Very low	26.9	Very low	136 Å²	136	159.2 Å²	159.2	73%	0.727	83%	0.83	S	S	*	*				146.5	145.5	112.3	-86.1	-32.1	0	0	0	117.3
947	Q	26.5	Very low	26.6	Very low	180 Å²	180	154.2 Å²	154.2	84%	0.841	83%	0.828	S	S	*	*			trans	78.8	90.8	151.9	-76.2	173.9	-5.2	0	0	121.9
948	I	21.2	Very low	26.5	Very low	153 Å²	153	155.8 Å²	155.8	79%	0.785	84%	0.836	S	S	*	*			trans	-30.6	134.6	141.5	-57.1	151.4	0	0	0	114.6
949	I	25	Very low	26.3	Very low	170 Å²	170	153.8 Å²	153.8	87%	0.872	82%	0.823	S	S	*	*			trans	-141.6	125.5	135.6	-60	-173.2	0	0	0	108.6
950	S	22.6	Very low	26.2	Very low	107 Å²	107	153.1 Å²	153.1	75%	0.748	82%	0.824	S	S	*	*			trans	-93.2	145.7	174.2	-76.8	0	0	0	0	112.5
951	G	27.2	Very low	26.2	Very low	79 Å²	79	149.7 Å²	149.7	81%	0.814	81%	0.811	S	S	*	*			trans	-134	104.1	169.9	0	0	0	0	0	111.3
952	N	24.6	Very low	25.9	Very low	156 Å²	156	150 Å²	150	83%	0.834	81%	0.811	S	S	*	*			trans	-66.4	141.2	177.1	-79.1	-32.3	0	0	0	112
953	N	28.6	Very low	25.9	Very low	168 Å²	168	155.9 Å²	155.9	90%	0.898	82%	0.816	S	S	*	*			trans	-154	135.7	138.9	-103.4	-33.8	0	0	0	111.8
954	Q	24.8	Very low	25.8	Very low	178 Å²	178	152.2 Å²	152.2	83%	0.832	81%	0.807	S	S	*	*			trans	-82.9	156.7	-176.2	-58.3	172.7	-10.9	0	0	111.2
955	I	28.5	Very low	25.8	Very low	168 Å²	168	154.3 Å²	154.3	86%	0.862	80%	0.804	S	S	*	*				-166.5	119.5	129.6	-94.9	146.4	0	0	0	111.3
956	R	26.9	Very low	25.9	Very low	235 Å²	235	150.2 Å²	150.2	89%	0.887	80%	0.801	S	S	*	*			trans	2.6	128.9	160.8	-62.9	175.1	175.4	179.9	-3.1	120.7
957	S	22.2	Very low	26.1	Very low	122 Å²	122	150.2 Å²	150.2	85%	0.853	80%	0.801	S	S	*	*			trans	-84.5	154	159.6	41	0	0	0	0	113
958	I	26.2	Very low	26.1	Very low	163 Å²	163	148.5 Å²	148.5	84%	0.836	80%	0.798	S	S	*	*			trans	-116.3	131.8	171.4	-65.7	177.4	0	0	0	108.9
959	R	23	Very low	26.5	Very low	171 Å²	171	149.3 Å²	149.3	65%	0.645	80%	0.803	S	S	*	*			trans	-102.3	136.3	-175.5	-159.8	-176.6	-155.5	-168	4.7	109.7
960	L	27.3	Very low	26.6	Very low	167 Å²	167	150.1 Å²	150.1	87%	0.874	80%	0.801	S	S	*	*			trans	-126.9	126.6	169.5	-83.7	168.2	0	0	0	110.4
961	L	28.9	Very low	26.7	Very low	120 Å²	120	151.3 Å²	151.3	63%	0.628	80%	0.803	S	S	*	*			trans	-82.7	153.5	177.6	-83.4	70.3	0	0	0	110.9
962	P	25.1	Very low	26.6	Very low	126 Å²	126	152.7 Å²	152.7	82%	0.818	80%	0.798	S	S	*	*			trans	-77.2	143.4	169.4	33.1	-33.3	0	0	0	111.2
963	F	28.3	Very low	26.5	Very low	195 Å²	195	150.3 Å²	150.3	86%	0.855	79%	0.792	S	S	*	*			trans	-118.8	133.2	171.3	-83.7	-86.7	0	0	0	111
964	T	26.1	Very low	26.3	Very low	116 Å²	116	148.8 Å²	148.8	71%	0.712	78%	0.783	S	S	*	*			trans	-93.8	-174	166.2	50.3	0	0	0	0	110.4
965	T	27.6	Very low	26.3	Very low	122 Å²	122	144.5 Å²	144.5	75%	0.748	77%	0.773	S	S	*	*			trans	92.9	98.9	169.7	69.9	0	0	0	0	118.8
966	T	26.5	Very low	26.2	Very low	122 Å²	122	145 Å²	145	75%	0.748	77%	0.765	S	S	*	*				40.3	146.7	121.8	49.6	0	0	0	0	123.4
967	N	32.1	Very low	26.2	Very low	137 Å²	137	140.2 Å²	140.2	73%	0.733	76%	0.757	S	S	*	*			trans	80.7	106.5	157.7	-65.2	-17.3	0	0	0	119.4
968	N	26.4	Very low	26.3	Very low	143 Å²	143	140.1 Å²	140.1	77%	0.765	75%	0.747	S	S	*	*				35.9	98.3	125.2	-60.8	-15.2	0	0	0	117.2
969	N	29.7	Very low	26.5	Very low	170 Å²	170	137 Å²	137	91%	0.909	74%	0.735	S	S	*	*				-157.4	152.4	120.5	-102.6	-39.9	0	0	0	114.1
970	K	25.8	Very low	26.9	Very low	187 Å²	187	136 Å²	136	81%	0.813	74%	0.738	S	S	*	*			trans	-69.3	153.5	-177.8	-87.2	174.2	173.7	173.4	0	112.9
971	V	24.9	Very low	26.8	Very low	132 Å²	132	133.8 Å²	133.8	80%	0.8	73%	0.726	S	S	*	*			trans	74.1	143.8	138.9	160.7	0	0	0	0	117.1
972	P	25.3	Very low	26.8	Very low	108 Å²	108	138 Å²	138	70%	0.701	74%	0.735	S	S	*	*			cis	-132.1	-170.6	-32.2	36.3	-16.9	0	0	0	112.3
973	C	22.8	Very low	26.8	Very low	107 Å²	107	138 Å²	138	72%	0.723	73%	0.728	S	S	*	*			trans	-49.5	145.6	154.5	-42.9	0	0	0	0	111
974	L	23.9	Very low	26.9	Very low	135 Å²	135	133.7 Å²	133.7	71%	0.707	72%	0.722	S	S	*	*				-167.7	128.3	117.6	-124.4	83.4	0	0	0	111.2	Y976	L974-Y976 HydrophobicContact CD2-CE2 4.39Å
975	S	24.9	Very low	27.1	Very low	88 Å²	88	132.2 Å²	132.2	62%	0.615	72%	0.717	S	S	*	*				78.1	169.5	126.4	87.1	0	0	0	0	118.2
976	Y	26.4	Very low	27.1	Very low	179 Å²	179	135.7 Å²	135.7	70%	0.702	72%	0.721	S	S	*	*			cis	-156.4	152.5	7.8	-125.2	-38.6	0	0	0	108.5	L974	L974-Y976 HydrophobicContact CD2-CE2 4.39Å
977	L	26.2	Very low	27.2	Very low	134 Å²	134	134 Å²	134	70%	0.702	72%	0.72	S	S	*	*			trans	68.6	152	150.3	-58.5	165.8	0	0	0	115.8
978	N	26	Very low	27	Very low	120 Å²	120	133.9 Å²	133.9	64%	0.642	72%	0.719	S	S	*	*			cis	-153.7	164.8	15.7	-139.3	-17.7	0	0	0	112.9
979	T	28.9	Very low	27.3	Very low	97 Å²	97	132.4 Å²	132.4	60%	0.595	71%	0.712	S	S	*	*			trans	71.8	131.6	153.5	55.4	0	0	0	0	119.2
980	H	32.1	Very low	27.2	Very low	152 Å²	152	130.7 Å²	130.7	70%	0.704	70%	0.702	S	S	*	*			cis	-133	137.2	-1.4	-89.1	-71.4	0	0	0	108.2
981	L	26.1	Very low	27.4	Very low	120 Å²	120	126.9 Å²	126.9	63%	0.628	70%	0.699	S	S	*	*				47.8	116.2	88.4	-67.7	160.5	0	0	0	111.2
982	Y	27.9	Very low	27.7	Very low	209 Å²	209	130 Å²	130	82%	0.82	70%	0.698	S	S	*	*			cis	-137.5	149.2	35.1	-84.9	-103.6	0	0	0	110.4
983	D	25.5	Very low	27.8	Very low	124 Å²	124	129.4 Å²	129.4	66%	0.663	69%	0.693	S	S	*	*			cis	67.1	77.6	39.4	-160.3	25	0	0	0	114.8
984	S	29.2	Very low	28.1	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	69%	0.693	S	S	*	*			trans	-153.1	107.2	146.1	-134.6	0	0	0	0	107.5
985	S	30.3	Very low	28.3	Very low	85 Å²	85	134 Å²	134	59%	0.594	69%	0.692	S	S	*	*				62.9	121.3	71.8	106	0	0	0	0	112.4
986	K	28	Very low	28.4	Very low	194 Å²	194	134.6 Å²	134.6	84%	0.843	69%	0.691	S	S	*	*			trans	37.2	114.2	142	-66.7	176.7	179	174.8	0	117.9
987	A	28.5	Very low	28.5	Very low	87 Å²	87	132.5 Å²	132.5	72%	0.719	69%	0.692	S	S	*	*				69.5	127.7	119.1	0	0	0	0	0	118.6
988	N	28.9	Very low	28.6	Very low	135 Å²	135	131.2 Å²	131.2	72%	0.722	69%	0.694	S	S	*	*			trans	76.5	149.3	137.2	-99	42.2	0	0	0	119.3
989	D	31.6	Very low	28.7	Very low	112 Å²	112	131 Å²	131	60%	0.599	70%	0.697	S	S	*	*			trans	61.7	93.1	150.3	-58.2	-37.9	0	0	0	115.8
990	N	28.8	Very low	28.7	Very low	133 Å²	133	133.2 Å²	133.2	71%	0.711	71%	0.705	S	S	*	*				74.5	127.1	82.8	-81.1	-49.7	0	0	0	111.1
991	S	29.9	Very low	28.4	Very low	107 Å²	107	132 Å²	132	75%	0.748	70%	0.703	S	S	*	*			trans	72	155.7	156.4	92	0	0	0	0	115.6
992	Y	30	Very low	28.5	Very low	198 Å²	198	132.7 Å²	132.7	78%	0.776	71%	0.706	S	S	*	*			cis	-160.5	129	-16.3	-135.2	-125.6	0	0	0	106.2
993	T	29	Very low	28.4	Very low	96 Å²	96	126.6 Å²	126.6	59%	0.589	70%	0.695	S	S	*	*			trans	64.1	168.5	145	68.8	0	0	0	0	121.1
994	R	28.1	Very low	28.5	Very low	193 Å²	193	126.3 Å²	126.3	73%	0.728	70%	0.697	S	S	*	*			trans	79.8	112.5	152	-72.9	172.4	-160.7	-101	4.6	116.1
995	Q	27.5	Very low	28.4	Very low	146 Å²	146	126.8 Å²	126.8	68%	0.682	70%	0.696	S	S	*	*				80.7	139.5	91.5	-73.8	-179.8	-44.6	0	0	110.1
996	T	27.8	Very low	28.2	Very low	99 Å²	99	131.6 Å²	131.6	61%	0.607	71%	0.706	S	S	*	*			cis	-172	161.6	5.4	15.5	0	0	0	0	108.6
997	N	27.6	Very low	28.2	Very low	135 Å²	135	127.2 Å²	127.2	72%	0.722	70%	0.7	S	S	*	*			trans	46.2	129.8	141.6	-49.6	-15.4	0	0	0	118.5
998	S	30.1	Very low	28.2	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	70%	0.697	S	S	*	*				-165.5	130.9	68.9	-55.7	0	0	0	0	108.3
999	V	27.6	Very low	28.1	Very low	115 Å²	115	127.8 Å²	127.8	70%	0.697	70%	0.698	S	S	*	*				59.1	121.9	80.1	-178.3	0	0	0	0	110.4
1000	L	28.2	Very low	27.9	Very low	145 Å²	145	131.7 Å²	131.7	76%	0.759	71%	0.705	S	S	*	*			cis	-119	146.6	26.3	-75	87.6	0	0	0	112.7
1001	N	27	Very low	28	Very low	126 Å²	126	134.2 Å²	134.2	67%	0.674	71%	0.712	S	S	*	*			cis	81.9	117.3	34.1	-165.3	27.8	0	0	0	114.1
1002	I	27.4	Very low	27.6	Very low	134 Å²	134	134.3 Å²	134.3	69%	0.687	71%	0.713	S	S	*	*			trans	136.1	123.7	142.5	-71.5	158.9	0	0	0	109.1
1003	S	26.2	Very low	27.6	Very low	82 Å²	82	130.3 Å²	130.3	57%	0.573	71%	0.712	S	S	*	*			cis	-173.7	148.5	-10.2	53.8	0	0	0	0	110.2
1004	T	26.1	Very low	27.6	Very low	117 Å²	117	130.2 Å²	130.2	72%	0.718	72%	0.715	S	S	*	*			trans	50.6	138.7	140.2	62.5	0	0	0	0	120.2
1005	T	28.4	Very low	27.5	Very low	117 Å²	117	128.7 Å²	128.7	72%	0.718	72%	0.721	S	S	*	*			cis	-146.5	127.7	33	38	0	0	0	0	110.3
1006	K	26	Very low	27.5	Very low	186 Å²	186	128.8 Å²	128.8	81%	0.809	73%	0.731	S	S	*	*				43.3	112.3	99.1	-70.3	-180	175.2	176.1	0	114.2
1007	S	27.8	Very low	27.4	Very low	102 Å²	102	128.5 Å²	128.5	71%	0.713	73%	0.733	S	S	*	*				166.5	126.6	95.3	66.3	0	0	0	0	109.3
1008	S	28.3	Very low	27.2	Very low	94 Å²	94	127.3 Å²	127.3	66%	0.657	74%	0.736	S	S	*	*				75.9	141.6	106.1	75.9	0	0	0	0	115.2
1009	L	27.1	Very low	27.1	Very low	140 Å²	140	128 Å²	128	73%	0.733	74%	0.735	S	S	*	*			cis	-163.1	149	-7.7	-129.4	98.6	0	0	0	103.3
1010	Y	27.2	Very low	27.1	Very low	194 Å²	194	127.5 Å²	127.5	76%	0.761	73%	0.734	S	S	*	*			trans	33.5	119.9	147.9	-66.2	-119.4	0	0	0	118.4
1011	H	29.8	Very low	27	Very low	185 Å²	185	131.7 Å²	131.7	86%	0.856	74%	0.741	S	S	*	*				-174.3	111.4	113.4	-91.2	-56	0	0	0	111.2
1012	S	23.3	Very low	27.1	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	74%	0.742	S	S	*	*			trans	-60.7	151.3	148.5	-39.9	0	0	0	0	108.6
1013	P	30.1	Very low	27.1	Very low	115 Å²	115	134.4 Å²	134.4	75%	0.747	75%	0.75	S	S	*	*				-147.6	131.1	92.2	36.6	-19.3	0	0	0	116.5
1014	S	28.9	Very low	27.2	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	76%	0.756	S	S	*	*			trans	52.2	123	133.8	67.9	0	0	0	0	122.5
1015	N	25.2	Very low	27.2	Very low	160 Å²	160	138.4 Å²	138.4	86%	0.856	76%	0.763	S	S	*	*			trans	49.6	95.4	131.4	-60.5	-0.9	0	0	0	118.9
1016	V	27.7	Very low	27.1	Very low	148 Å²	148	139.5 Å²	139.5	90%	0.897	76%	0.762	S	S	*	*			trans	-131.8	134.8	144.4	-175.5	0	0	0	0	110.1
1017	S	25.2	Very low	27.1	Very low	94 Å²	94	137.8 Å²	137.8	66%	0.657	76%	0.761	S	S	*	*			trans	-56.8	151.2	-175.6	-180	0	0	0	0	115.4
1018	S	24.1	Very low	26.9	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	76%	0.763	S	S	*	*			trans	-51.3	136.1	160.6	50.5	0	0	0	0	113.2
1019	V	27.4	Very low	26.8	Very low	121 Å²	121	139 Å²	139	73%	0.733	76%	0.762	S	S	*	*			trans	-139.1	130.2	165.4	-179.7	0	0	0	0	108.1
1020	P	27.4	Very low	26.7	Very low	104 Å²	104	136.9 Å²	136.9	68%	0.675	76%	0.755	S	S	*	*			trans	-78.1	136.1	-174.5	30.7	-35	0	0	0	112.5	Y1022	P1020-Y1022 PolarHBondContact O-N 3.37Å
1021	Y	26.2	Very low	26.5	Very low	233 Å²	233	133.6 Å²	133.6	91%	0.914	75%	0.75	S	S	*	*			trans	-81.7	98.5	171.5	-89.5	-90.3	0	0	0	111.1	V1023	Y1021-V1023 PolarHBondContact O-N 2.88Å
1022	Y	28.4	Very low	26.3	Very low	173 Å²	173	134.8 Å²	134.8	68%	0.678	75%	0.749	S	S	*	*			trans	-65	120.8	165.6	-92	-96.3	0	0	0	111	P1020 K1024	P1020-Y1022 PolarHBondContact O-N 3.37Å; Y1022-K1024 PolarHBondContact O-N 3.46Å
1023	V	28.2	Very low	26.6	Very low	144 Å²	144	135.4 Å²	135.4	87%	0.873	75%	0.748	S	S	*	*			trans	-74	106.9	162.4	176.8	0	0	0	0	108.1	Y1021	Y1021-V1023 PolarHBondContact O-N 2.88Å
1024	K	29.4	Very low	26.3	Very low	160 Å²	160	136 Å²	136	70%	0.696	75%	0.754	S	S	*	*			trans	-102.7	89.9	-166.3	-174.6	174.2	-178	173.4	0	111.7	Y1022 M1026	Y1022-K1024 PolarHBondContact O-N 3.46Å; K1024-M1026 HydrophobicContact CD-CB 4.48Å; K1024-M1026 HydrophobicContact CG-CB 3.8Å; K1024-M1026 HydrophobicContact CG-CG 4.39Å; K1024-M1026 PolarHBondContact O-N 3.3Å; K1024-M1026 VanDerWaalsContact O-N 3.11Å
1025	S	24.6	Very low	26.1	Very low	124 Å²	124	136.6 Å²	136.6	87%	0.867	76%	0.759	S	S	*	*			trans	-79.2	40.6	162	50.7	0	0	0	0	112.2
1026	M	26.8	Very low	26.4	Very low	140 Å²	140	133.9 Å²	133.9	69%	0.69	75%	0.753	S	S	*	*			trans	-94.4	126.6	171.7	-82.2	-162.3	153.6	0	0	111.6	K1024	K1024-M1026 HydrophobicContact CD-CB 4.48Å; K1024-M1026 HydrophobicContact CG-CB 3.8Å; K1024-M1026 HydrophobicContact CG-CG 4.39Å; K1024-M1026 PolarHBondContact O-N 3.3Å; K1024-M1026 VanDerWaalsContact O-N 3.11Å
1027	L	26.2	Very low	26.2	Very low	150 Å²	150	132.9 Å²	132.9	79%	0.785	75%	0.752	S	S	*	*			trans	-42.2	149.2	159.7	-69.5	155.3	0	0	0	111.7	V1029	L1027-V1029 PolarHBondContact O-N 2.62Å
1028	P	24.5	Very low	26.4	Very low	116 Å²	116	137.1 Å²	137.1	75%	0.753	76%	0.758	S	S	*	*			trans	-67.5	94.3	172	28.5	-33.6	0	0	0	110.2	V1030	P1028-V1030 PolarHBondContact O-N 3.07Å
1029	V	25.5	Very low	26.5	Very low	106 Å²	106	141.2 Å²	141.2	64%	0.642	76%	0.763	S	S	*	*			trans	-68.2	97.4	166.8	178.6	0	0	0	0	107.9	L1027 N1031	L1027-V1029 PolarHBondContact O-N 2.62Å; V1029-N1031 PolarHBondContact O-N 3.38Å
1030	V	24.8	Very low	26.3	Very low	95 Å²	95	143 Å²	143	58%	0.576	77%	0.767	S	S	*	*			trans	-79.3	102.4	173.6	-173.9	0	0	0	0	108.5	P1028 Y1032	P1028-V1030 PolarHBondContact O-N 3.07Å; V1030-Y1032 HydrophobicContact CB-CD2 4.44Å; V1030-Y1032 HydrophobicContact CB-CE2 4.17Å; V1030-Y1032 HydrophobicContact CG1-CD2 3.76Å; V1030-Y1032 HydrophobicContact CG1-CE2 3.34Å; V1030-Y1032 PolarHBondContact O-N 3.46Å
1031	N	23.1	Very low	26.3	Very low	125 Å²	125	144.4 Å²	144.4	67%	0.668	77%	0.768	S	S	*	*			trans	-75.7	103.6	178.5	-136.9	10.9	0	0	0	109.6	V1029	V1029-N1031 PolarHBondContact O-N 3.38Å
1032	Y	25.7	Very low	26.1	Very low	210 Å²	210	142.3 Å²	142.3	82%	0.824	76%	0.764	S	S	*	*			trans	-97.4	90	171.9	-79.6	-71.8	0	0	0	110.5	V1030	V1030-Y1032 HydrophobicContact CB-CD2 4.44Å; V1030-Y1032 HydrophobicContact CB-CE2 4.17Å; V1030-Y1032 HydrophobicContact CG1-CD2 3.76Å; V1030-Y1032 HydrophobicContact CG1-CE2 3.34Å; V1030-Y1032 PolarHBondContact O-N 3.46Å
1033	T	28.8	Very low	26	Very low	122 Å²	122	141.6 Å²	141.6	75%	0.748	77%	0.771	S	S	*	*			trans	-68.3	130.8	164.4	49.1	0	0	0	0	110.1	S1035	T1033-S1035 PolarHBondContact O-N 2.83Å
1034	S	24.3	Very low	25.8	Very low	126 Å²	126	140 Å²	140	88%	0.881	77%	0.766	S	S	*	*			trans	-75.7	99.8	-172.7	39.9	0	0	0	0	113.7
1035	S	25.5	Very low	25.6	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	77%	0.77	S	S	*	*			trans	-165.4	100.1	155.5	62.8	0	0	0	0	113.9	T1033	T1033-S1035 PolarHBondContact O-N 2.83Å
1036	S	29.7	Very low	25.6	Very low	103 Å²	103	136 Å²	136	72%	0.72	76%	0.763	S	S	*	*				177.4	119.4	128.5	65.9	0	0	0	0	111
1037	S	24.4	Very low	25.7	Very low	126 Å²	126	134.3 Å²	134.3	88%	0.881	77%	0.765	S	S	*	*			trans	-68.9	123.7	170.7	32.9	0	0	0	0	111.4
1038	K	29.7	Very low	25.7	Very low	183 Å²	183	132 Å²	132	80%	0.796	76%	0.762	S	S	*	*			trans	-138.1	119.8	165.3	-73.9	-172.2	179.9	170.9	0	111	L1040	K1038-L1040 PolarHBondContact O-N 3.33Å
1039	K	25.2	Very low	25.9	Very low	197 Å²	197	134.3 Å²	134.3	86%	0.857	77%	0.767	S	S	*	*			trans	-33.5	118.9	171.6	-84.1	175.4	164.6	178.4	0	112.8	I1041	K1039-I1041 PolarHBondContact O-N 2.83Å
1040	L	24.3	Very low	26	Very low	157 Å²	157	134.5 Å²	134.5	82%	0.822	77%	0.77	S	S	*	*			trans	-73.8	114.4	151.7	-84.5	162.4	0	0	0	107.6	K1038	K1038-L1040 PolarHBondContact O-N 3.33Å
1041	I	26.7	Very low	26.1	Very low	135 Å²	135	134.8 Å²	134.8	69%	0.692	78%	0.777	S	S	*	*			trans	-84.2	117.3	164.2	-66	175.2	0	0	0	106	K1039 L1043	K1039-I1041 PolarHBondContact O-N 2.83Å; I1041-L1043 HydrophobicContact CG2-CD1 4.29Å; I1041-L1043 HydrophobicContact CG2-CG 4.4Å; I1041-L1043 PolarHBondContact O-N 3.12Å
1042	F	23.1	Very low	26.2	Very low	189 Å²	189	134.3 Å²	134.3	83%	0.829	78%	0.783	S	S	*	*			trans	-69.9	119.9	170.7	-76.9	-99.1	0	0	0	109
1043	L	26	Very low	26.4	Very low	158 Å²	158	132.1 Å²	132.1	83%	0.827	78%	0.784	S	S	*	*			trans	-129.9	102.1	166.1	-92.4	160.3	0	0	0	107.7	I1041	I1041-L1043 HydrophobicContact CG2-CD1 4.29Å; I1041-L1043 HydrophobicContact CG2-CG 4.4Å; I1041-L1043 PolarHBondContact O-N 3.12Å
1044	S	24.1	Very low	26.3	Very low	110 Å²	110	130.9 Å²	130.9	77%	0.769	78%	0.78	S	S	*	*			trans	-68.9	139.1	176.2	-48.4	0	0	0	0	110.8
1045	S	24.5	Very low	26.5	Very low	112 Å²	112	132.1 Å²	132.1	78%	0.783	78%	0.775	S	S	*	*			trans	-155.2	105.1	159.5	-62.9	0	0	0	0	105.5
1046	A	25.5	Very low	26.4	Very low	88 Å²	88	133.6 Å²	133.6	73%	0.727	77%	0.774	S	S	*	*				64.7	124.2	58.9	0	0	0	0	0	112.8
1047	S	27.2	Very low	26.4	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	78%	0.783	S	S	*	*			trans	52.8	110.9	156.8	57	0	0	0	0	119.8
1048	S	26.3	Very low	26.4	Very low	102 Å²	102	139.6 Å²	139.6	71%	0.713	78%	0.778	S	S	*	*				-10.9	127.6	124.6	52.8	0	0	0	0	117.3
1049	L	29.5	Very low	26.4	Very low	164 Å²	164	139.2 Å²	139.2	86%	0.859	78%	0.779	S	S	*	*				-170.4	149.1	121.4	-122.9	71.7	0	0	0	110.3
1050	P	28.3	Very low	26.4	Very low	109 Å²	109	135.7 Å²	135.7	71%	0.708	77%	0.774	S	S	*	*			trans	-111.1	180	-176.5	41.3	-33.3	0	0	0	115
1051	S	25.9	Very low	26.6	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	77%	0.772	S	S	*	*			trans	73	138.1	154.6	51.4	0	0	0	0	121.4
1052	S	26.6	Very low	26.6	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	77%	0.772	S	S	*	*			trans	56	143.8	163.9	35	0	0	0	0	117.3
1053	I	29.6	Very low	26.7	Very low	164 Å²	164	133 Å²	133	84%	0.841	77%	0.767	S	S	*	*			cis	-140.4	143.4	44.2	-74.9	163.9	0	0	0	111.3
1054	S	27.2	Very low	26.7	Very low	96 Å²	96	130 Å²	130	67%	0.671	76%	0.759	S	S	*	*			trans	-92	158.4	164.7	48.1	0	0	0	0	110.8
1055	I	27	Very low	26.8	Very low	153 Å²	153	132.1 Å²	132.1	79%	0.785	76%	0.762	S	S	*	*			trans	166.9	122.7	132.8	-84.9	155.1	0	0	0	111.2
1056	N	24.9	Very low	27.1	Very low	138 Å²	138	134 Å²	134	74%	0.738	76%	0.762	S	S	*	*			trans	-9.9	136.7	151.7	-46.9	-32.1	0	0	0	118.5
1057	K	29.7	Very low	27.2	Very low	208 Å²	208	134.7 Å²	134.7	90%	0.904	76%	0.761	S	S	*	*				-157.1	141.3	113.3	-115.7	169.8	-176.5	174.3	0	112.8
1058	L	24.2	Very low	27.1	Very low	148 Å²	148	140.8 Å²	140.8	78%	0.775	77%	0.768	S	S	*	*			trans	-64.4	145.2	172.2	-71.4	68.8	0	0	0	110.1
1059	Q	29.7	Very low	27.2	Very low	175 Å²	175	142.5 Å²	142.5	82%	0.818	77%	0.769	S	S	*	*				-155.3	110.5	124.2	-117.3	171.3	0.4	0	0	112.1
1060	T	24.2	Very low	27.1	Very low	122 Å²	122	141.7 Å²	141.7	75%	0.748	76%	0.759	S	S	*	*			trans	-66.9	123.3	165.6	11.9	0	0	0	0	110
1061	F	28.5	Very low	27.2	Very low	176 Å²	176	144.8 Å²	144.8	77%	0.772	76%	0.762	S	S	*	*			trans	-142.2	96.6	155.4	-95.5	-73.1	0	0	0	112.3
1062	N	27.4	Very low	27.2	Very low	130 Å²	130	150.6 Å²	150.6	70%	0.695	77%	0.768	S	S	*	*			trans	31.3	114.2	131.7	-77.2	-13.5	0	0	0	120.7
1063	T	24.2	Very low	27.3	Very low	120 Å²	120	150.8 Å²	150.8	74%	0.736	76%	0.76	S	S	*	*				64.8	134.2	124.3	65.7	0	0	0	0	122.1
1064	S	26.8	Very low	27.4	Very low	94 Å²	94	148.6 Å²	148.6	66%	0.657	75%	0.75	S	S	*	*			trans	94.4	112.7	137.2	80.9	0	0	0	0	120.3
1065	N	25.7	Very low	27.4	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	75%	0.752	S	S	*	*			trans	70.3	173.6	132.8	-65.9	-30.4	0	0	0	120.9
1066	I	30.3	Very low	27.8	Very low	151 Å²	151	153.1 Å²	153.1	77%	0.774	76%	0.758	S	S	*	*			trans	85.2	68.3	165.9	-44	-174.8	0	0	0	117.2
1067	S	28.2	Very low	27.9	Very low	102 Å²	102	158.7 Å²	158.7	71%	0.713	77%	0.769	S	S	*	*				42.3	123.6	120.8	64.6	0	0	0	0	123.5
1068	R	24.9	Very low	27.8	Very low	233 Å²	233	152 Å²	152	88%	0.879	76%	0.759	S	S	*	*			trans	17.5	125.2	132.8	-64.5	-178.5	-177.3	133.7	2.9	120.1
1069	N	28.4	Very low	28.1	Very low	139 Å²	139	154.5 Å²	154.5	74%	0.743	76%	0.764	S	S	*	*			trans	152.2	156.5	135.2	-81.6	-29.4	0	0	0	107.7
1070	K	28	Very low	27.9	Very low	147 Å²	147	157.3 Å²	157.3	64%	0.639	77%	0.768	S	S	*	*			cis	-170.1	176.6	-13.9	-108.4	173.9	-178.8	177.5	0	106.6
1071	F	30.2	Very low	28.2	Very low	174 Å²	174	158.3 Å²	158.3	76%	0.763	77%	0.768	S	S	*	*			trans	74.2	123.7	166.2	-52.6	-71.2	0	0	0	115
1072	R	26	Very low	28.1	Very low	223 Å²	223	157.2 Å²	157.2	84%	0.842	77%	0.765	S	S	*	*			cis	87.5	141.7	25.8	-153.8	-166.1	-160.1	-155.6	3.5	112.8
1073	N	28.3	Very low	28	Very low	119 Å²	119	162.1 Å²	162.1	64%	0.636	78%	0.776	S	S	*	*			trans	80.5	145	-178	-70	38.9	0	0	0	114.4
1074	D	31	Very low	28	Very low	118 Å²	118	160.6 Å²	160.6	63%	0.631	77%	0.769	S	S	*	*			cis	-153.3	156.3	-0.2	-110.9	-27.3	0	0	0	116.4
1075	N	28.9	Very low	28	Very low	134 Å²	134	160.8 Å²	160.8	72%	0.717	78%	0.777	S	S	*	*			trans	-0	134.7	156	-56.3	-48.6	0	0	0	123.5
1076	K	33.3	Very low	28.1	Very low	209 Å²	209	161 Å²	161	91%	0.909	78%	0.777	S	S	*	*			trans	163.2	100	134.3	-89.8	158.8	-174.9	-179.6	0	108.1
1077	R	27.9	Very low	27.8	Very low	256 Å²	256	158.4 Å²	158.4	97%	0.966	77%	0.771	S	S	*	*				73	104.3	56	-159.5	-175.2	-169.3	-147.9	3	114.2
1078	G	28.5	Very low	27.9	Very low	68 Å²	68	161.1 Å²	161.1	70%	0.701	77%	0.773	S	S	*	*			trans	115.9	100.3	145	0	0	0	0	0	118.6
1079	K	30.6	Very low	28.2	Very low	200 Å²	200	155.6 Å²	155.6	87%	0.87	76%	0.761	S	S	*	*				161.8	95.4	120.9	-88.2	-179.2	179.8	-175.3	0	110.7
1080	Y	23.8	Very low	28.2	Very low	233 Å²	233	154.7 Å²	154.7	91%	0.914	76%	0.756	S	S	*	*			trans	-87.1	140.2	149.4	-93	-97.4	0	0	0	107.1
1081	I	30.7	Very low	28.3	Very low	143 Å²	143	154.9 Å²	154.9	73%	0.733	76%	0.764	S	S	*	*			trans	-112.3	121.4	161.5	-66.3	177.1	0	0	0	106	Y1083	I1081-Y1083 HydrophobicContact CG2-CD2 4.5Å; I1081-Y1083 HydrophobicContact CG2-CE2 4.41Å
1082	E	26.3	Very low	28.2	Very low	154 Å²	154	152.3 Å²	152.3	72%	0.72	77%	0.765	S	S	*	*			trans	-104.9	129.4	176.8	179.1	-177.9	167.5	0	0	107.5	S1084	E1082-S1084 WeakPolarHBondContact CG-OG 3.32Å; E1082-S1084 VanDerWaalsContact OE1-CB 3.31Å; E1082-S1084 WeakPolarHBondContact OE1-CB 3.44Å; E1082-S1084 PolarHBondContact OE1-OG 3.37Å
1083	Y	25.3	Very low	28.4	Very low	233 Å²	233	148 Å²	148	91%	0.914	76%	0.764	S	S	*	*			trans	-96.9	97.2	163.5	-90.1	-84.1	0	0	0	108.3	I1081	I1081-Y1083 HydrophobicContact CG2-CD2 4.5Å; I1081-Y1083 HydrophobicContact CG2-CE2 4.41Å
1084	S	24	Very low	28.1	Very low	87 Å²	87	147 Å²	147	61%	0.608	77%	0.766	S	S	*	*			trans	-131.9	97.1	173.4	-74.4	0	0	0	0	109.5	E1082	E1082-S1084 WeakPolarHBondContact CG-OG 3.32Å; E1082-S1084 VanDerWaalsContact OE1-CB 3.31Å; E1082-S1084 WeakPolarHBondContact OE1-CB 3.44Å; E1082-S1084 PolarHBondContact OE1-OG 3.37Å
1085	A	26.7	Very low	27.9	Very low	98 Å²	98	148.3 Å²	148.3	81%	0.81	77%	0.772	S	S	*	*			trans	-165	145.8	166.1	0	0	0	0	0	106.7
1086	I	28.4	Very low	27.9	Very low	161 Å²	161	149 Å²	149	83%	0.826	77%	0.77	S	S	*	*			cis	-135.1	146.3	23.8	-72.9	171.4	0	0	0	110.4
1087	S	24.5	Very low	27.5	Very low	95 Å²	95	147.6 Å²	147.6	66%	0.664	76%	0.761	S	S	*	*			trans	-88.2	-170	175.1	51.7	0	0	0	0	113.2
1088	Q	29.9	Very low	27.6	Very low	159 Å²	159	143.6 Å²	143.6	74%	0.743	75%	0.75	S	S	*	*			trans	90.4	140.2	171.6	-56.9	172.1	-39.3	0	0	114.9
1089	D	31.1	Very low	27.6	Very low	117 Å²	117	146.2 Å²	146.2	63%	0.626	75%	0.748	S	S	*	*			cis	-156.4	156.4	-11	-109	-28.4	0	0	0	112.3
1090	N	28.5	Very low	27.5	Very low	121 Å²	121	142.6 Å²	142.6	65%	0.647	74%	0.739	S	S	*	*			trans	16.9	120.8	148.7	-47.3	-49.2	0	0	0	120.6
1091	N	30	Very low	27.8	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	73%	0.73	S	S	*	*				178.8	129.1	110.5	-91.8	-25.2	0	0	0	113.4
1092	P	27.8	Very low	27.7	Very low	120 Å²	120	133.4 Å²	133.4	78%	0.779	71%	0.707	S	S	*	*			trans	-105.7	125.4	165.1	34.9	-24.6	0	0	0	111.6
1093	T	29.9	Very low	27.7	Very low	133 Å²	133	132.6 Å²	132.6	82%	0.816	70%	0.702	S	S	*	*			trans	-142.6	136.9	169	-12.3	0	0	0	0	112.7
1094	S	23.4	Very low	27.8	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	69%	0.686	S	S	*	*			trans	-83.4	-171.8	179.8	54.1	0	0	0	0	113.1
1095	L	26.9	Very low	27.8	Very low	146 Å²	146	127.7 Å²	127.7	76%	0.764	69%	0.691	S	S	*	*			trans	95	133.9	173.3	-53.2	161.3	0	0	0	113.1
1096	H	27.8	Very low	27.9	Very low	147 Å²	147	126.7 Å²	126.7	68%	0.681	68%	0.678	S	S	*	*			cis	-159.7	154.9	-13.4	-136.9	-137.9	0	0	0	109
1097	Y	25.4	Very low	27.8	Very low	180 Å²	180	123.5 Å²	123.5	71%	0.706	67%	0.67	S	S	*	*			trans	20.5	136.4	145.4	-74.7	-103.3	0	0	0	119.7
1098	K	29.6	Very low	27.9	Very low	172 Å²	172	126.5 Å²	126.5	75%	0.748	68%	0.677	S	S	*	*				-169.2	141	54.3	-129.7	162.6	-173.2	-177.5	0	110.7
1099	N	29.2	Very low	27.6	Very low	123 Å²	123	125.6 Å²	125.6	66%	0.658	68%	0.677	S	S	*	*			trans	57.3	155.7	143.3	-60.5	10.9	0	0	0	120.3
1100	N	28.9	Very low	27.5	Very low	125 Å²	125	127.1 Å²	127.1	67%	0.668	69%	0.685	S	S	*	*			cis	-165.4	147.2	-25.7	-105	-5.3	0	0	0	108.6
1101	I	29.7	Very low	27.6	Very low	145 Å²	145	130 Å²	130	74%	0.744	70%	0.699	S	S	*	*			trans	94.1	138.8	145.9	-68.8	159.7	0	0	0	120.2
1102	P	28.2	Very low	27.4	Very low	38 Å²	38	132 Å²	132	25%	0.247	70%	0.697	C	S	.	*			trans	-140.3	-179.4	-143.7	-5.2	37.3	0	0	0	120.6	I883 N884	I883-P1102 VanDerWaalsContact CA-CG 3.48Å; I883-P1102 HydrophobicContact CB-CG 3.94Å; I883-P1102 HydrophobicContact CG1-CG 3.79Å; I883-P1102 HydrophobicContact CG2-CG 4.03Å; N884-P1102 HydrophobicContact CB-CB 3.44Å; N884-P1102 VanDerWaalsContact CB-CB 3.44Å; N884-P1102 HydrophobicContact CB-CG 3.55Å; N884-P1102 WeakPolarHBondContact ND2-CB 3.41Å
1103	F	26.2	Very low	27.3	Very low	137 Å²	137	130.3 Å²	130.3	60%	0.601	68%	0.682	S	S	*	*			trans	6.2	124.4	145.6	-81.4	-82.2	0	0	0	118.9	S882 I883 N884	S882-F1103 VanDerWaalsContact CA-O 3.31Å; S882-F1103 WeakPolarHBondContact CA-O 3.4Å; I883-F1103 PolarHBondContact N-O 3.46Å; N884-F1103 VanDerWaalsContact OD1-CD2 3.3Å; N884-F1103 WeakPolarHBondContact OD1-CD2 3.48Å; N884-F1103 VanDerWaalsContact OD1-CE2 3.24Å; N884-F1103 WeakPolarHBondContact OD1-CE2 3.33Å
1104	S	27.6	Very low	27.3	Very low	83 Å²	83	132.5 Å²	132.5	58%	0.58	68%	0.683	S	S	*	*				-158.1	136.3	114.8	39.7	0	0	0	0	111.5
1105	D	25.1	Very low	27.5	Very low	133 Å²	133	134.8 Å²	134.8	71%	0.711	68%	0.684	S	S	*	*			trans	-64.3	144.3	162.4	-57.5	-79.1	0	0	0	110.3
1106	S	26.9	Very low	27.6	Very low	77 Å²	77	134 Å²	134	54%	0.538	68%	0.68	S	S	.	*			trans	-173.6	156.8	131.6	48.2	0	0	0	0	114.2	E880	E880-S1106 VanDerWaalsContact CD-OG 3.23Å; E880-S1106 WeakPolarHBondContact OE1-CB 3.19Å; E880-S1106 WeakPolarHBondContact OE2-CB 3.43Å; E880-S1106 PolarHBondContact OE2-OG 3.15Å
1107	S	26.4	Very low	27.5	Very low	94 Å²	94	136.8 Å²	136.8	66%	0.657	69%	0.69	S	S	*	*			trans	-57.2	151.1	172.3	48.6	0	0	0	0	113.9
1108	I	27	Very low	27.6	Very low	159 Å²	159	131.7 Å²	131.7	82%	0.815	69%	0.692	S	S	*	*				-166.8	148.4	116.9	-98.1	151.2	0	0	0	109.4
1109	N	25.1	Very low	27.7	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	69%	0.693	S	S	*	*			trans	-69.7	-171.3	174.4	-77.6	-31	0	0	0	111.4
1110	D	27.2	Very low	27.8	Very low	148 Å²	148	130.9 Å²	130.9	79%	0.791	70%	0.702	S	S	*	*			trans	78.8	88.9	163.4	-47.9	-25.4	0	0	0	116
1111	L	30.7	Very low	27.7	Very low	181 Å²	181	130.8 Å²	130.8	95%	0.948	70%	0.702	S	S	*	*				-154.1	95.4	127.4	-109.9	161.7	0	0	0	111
1112	Y	26.1	Very low	27.6	Very low	194 Å²	194	130.6 Å²	130.6	76%	0.761	70%	0.703	S	S	*	*			trans	-81.5	138.1	174	-164.1	-110.6	0	0	0	109.6
1113	N	26.8	Very low	27.7	Very low	85 Å²	85	138.4 Å²	138.4	46%	0.455	73%	0.732	S	S	.	*			trans	39.7	111	157.7	-64.9	-13.2	0	0	0	121
1114	Q	28.7	Very low	27.7	Very low	179 Å²	179	138.1 Å²	138.1	84%	0.836	74%	0.742	S	S	*	*			trans	177	143.9	145.5	-98.8	165.8	83.3	0	0	106.4
1115	M	28.2	Very low	27.7	Very low	144 Å²	144	139.2 Å²	139.2	71%	0.709	75%	0.75	S	S	*	*			cis	-152.1	135	7.2	-105.6	-171.3	175.1	0	0	108.3
1116	I	28.3	Very low	27.9	Very low	131 Å²	131	140.1 Å²	140.1	67%	0.672	76%	0.755	S	S	*	*				76.7	112.5	105.5	-64.4	179.7	0	0	0	117.3
1117	F	26.4	Very low	27.9	Very low	205 Å²	205	142.5 Å²	142.5	90%	0.899	77%	0.769	S	S	*	*			trans	31.7	137.5	140.4	-67.4	-95.5	0	0	0	123.2
1118	G	28.7	Very low	28	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	78%	0.776	S	S	*	*			trans	167.1	91.8	157.1	0	0	0	0	0	112.7
1119	P	29.9	Very low	27.9	Very low	117 Å²	117	147.6 Å²	147.6	76%	0.76	78%	0.779	S	S	*	*			trans	-85	143.9	177.7	34.2	-31.7	0	0	0	110.7
1120	D	31.3	Very low	27.9	Very low	160 Å²	160	148.9 Å²	148.9	86%	0.856	79%	0.785	S	S	*	*			trans	-152.2	157.1	152.8	-127.7	-29.6	0	0	0	115.3
1121	N	27.8	Very low	27.8	Very low	124 Å²	124	147.7 Å²	147.7	66%	0.663	78%	0.783	S	S	*	*			trans	-98.3	159.1	-158.4	-63.3	-85.3	0	0	0	113.9
1122	N	28	Very low	27.5	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	78%	0.779	S	S	*	*			trans	56.5	97.9	148.8	-60.1	-28.2	0	0	0	118.6
1123	K	30.1	Very low	27.4	Very low	201 Å²	201	145.4 Å²	145.4	87%	0.874	78%	0.781	S	S	*	*				-178.9	137.2	103.8	-96.6	158.9	-176	174.4	0	114.6
1124	T	26.3	Very low	27.3	Very low	131 Å²	131	147.5 Å²	147.5	80%	0.804	80%	0.797	S	S	*	*			trans	-40.7	131	164.5	48.7	0	0	0	0	115.9
1125	S	27.6	Very low	27.1	Very low	107 Å²	107	145 Å²	145	75%	0.748	79%	0.794	S	S	*	*				-176.5	129.8	126.5	39.4	0	0	0	0	114.4
1126	N	29	Very low	26.9	Very low	151 Å²	151	142.6 Å²	142.6	81%	0.807	79%	0.79	S	S	*	*			trans	55.8	123.8	153.2	-59.6	-11.3	0	0	0	121.7
1127	P	27.2	Very low	27	Very low	128 Å²	128	143.6 Å²	143.6	83%	0.831	80%	0.797	S	S	*	*			trans	-83.7	128.9	172.3	33.8	-32.5	0	0	0	112.3	K1129	P1127-K1129 PolarHBondContact O-N 3.5Å
1128	I	28.8	Very low	26.9	Very low	160 Å²	160	140.3 Å²	140.3	82%	0.821	79%	0.788	S	S	*	*			trans	-81.8	114.3	170.5	-65.9	176.6	0	0	0	109.2
1129	K	24	Very low	27	Very low	200 Å²	200	144.9 Å²	144.9	87%	0.87	79%	0.79	S	S	*	*			trans	-61	136.4	168.1	-86.8	177.8	172.8	173.8	0	110.2	P1127	P1127-K1129 PolarHBondContact O-N 3.5Å
1130	L	25.1	Very low	27	Very low	167 Å²	167	147.7 Å²	147.7	87%	0.874	79%	0.793	S	S	*	*			trans	-128	127.7	164.5	-133.1	140.4	0	0	0	110.1
1131	T	24.2	Very low	26.6	Very low	122 Å²	122	151.5 Å²	151.5	75%	0.748	80%	0.796	S	S	*	*			trans	-100.3	134.7	-157.4	-24.6	0	0	0	0	111.4
1132	V	25.2	Very low	26.6	Very low	141 Å²	141	153.4 Å²	153.4	86%	0.855	81%	0.805	S	S	*	*			trans	-126.4	125.8	162.2	-177	0	0	0	0	108.1	T1134	V1132-T1134 PolarHBondContact O-N 2.59Å
1133	K	24.6	Very low	26.6	Very low	187 Å²	187	152.2 Å²	152.2	81%	0.813	81%	0.808	S	S	*	*			trans	-73.8	123.4	-167	-67.7	176.3	174.9	179.7	0	112.5
1134	T	23.6	Very low	26.3	Very low	129 Å²	129	145.8 Å²	145.8	79%	0.791	80%	0.799	S	S	*	*			trans	-74	144.7	142.3	36.6	0	0	0	0	109.2	V1132	V1132-T1134 PolarHBondContact O-N 2.59Å
1135	V	25.8	Very low	26.5	Very low	126 Å²	126	146.4 Å²	146.4	76%	0.764	80%	0.797	S	S	*	*			trans	-115.4	87.3	167.4	-179.4	0	0	0	0	107.3
1136	C	23.3	Very low	26.3	Very low	94 Å²	94	148.9 Å²	148.9	64%	0.635	80%	0.802	S	S	*	*			trans	-97.8	132.3	154.2	-65.2	0	0	0	0	106.6
1137	N	29.8	Very low	26.3	Very low	151 Å²	151	153.1 Å²	153.1	81%	0.807	81%	0.807	S	S	*	*			trans	-102.4	98.6	162.1	-86.1	7.8	0	0	0	107.2
1138	D	24.9	Very low	26.1	Very low	136 Å²	136	152 Å²	152	73%	0.727	80%	0.803	S	S	*	*			trans	-75.6	128.8	165.8	-58.1	-53.4	0	0	0	109.4
1139	H	31	Very low	26.3	Very low	169 Å²	169	150.5 Å²	150.5	78%	0.782	80%	0.803	S	S	*	*			trans	-149.9	96.8	147.2	-74.1	-53	0	0	0	106.1
1140	Q	28.6	Very low	26.3	Very low	177 Å²	177	145.6 Å²	145.6	83%	0.827	79%	0.794	S	S	*	*				85.6	133.2	75.9	-169.5	171.2	23.1	0	0	111.6
1141	W	24.6	Very low	26.3	Very low	240 Å²	240	145 Å²	145	91%	0.909	79%	0.79	S	S	*	*			trans	-64.9	152.7	-167.4	-68.5	19.8	0	0	0	113.6
1142	N	28	Very low	26.4	Very low	163 Å²	163	145.3 Å²	145.3	87%	0.872	79%	0.786	S	S	*	*				-156.6	144.2	127.4	-100	-26.3	0	0	0	112.3
1143	S	26.2	Very low	26.5	Very low	117 Å²	117	144.3 Å²	144.3	82%	0.818	78%	0.776	S	S	*	*			trans	-72.6	149.2	170.9	50.2	0	0	0	0	112.2
1144	G	24.8	Very low	26.5	Very low	65 Å²	65	141.8 Å²	141.8	67%	0.67	77%	0.771	S	S	*	*			trans	145.2	142.9	157.8	0	0	0	0	0	116.2
1145	D	29.6	Very low	26.9	Very low	145 Å²	145	140.7 Å²	140.7	78%	0.775	77%	0.769	S	S	*	*			trans	71	82.1	145.8	-54.3	-14.2	0	0	0	120.1	W1147	D1145-W1147 PolarHBondContact O-N 2.98Å
1146	N	24.5	Very low	27	Very low	159 Å²	159	140.1 Å²	140.1	85%	0.85	77%	0.771	S	S	*	*			trans	-20.3	117.7	133.3	-69.1	-38.7	0	0	0	114.3
1147	W	28.3	Very low	27.4	Very low	240 Å²	240	141.1 Å²	141.1	91%	0.909	78%	0.776	S	S	*	*			trans	-136.3	117.2	149.3	-81.6	88.7	0	0	0	111.5	D1145	D1145-W1147 PolarHBondContact O-N 2.98Å
1148	S	24	Very low	27.3	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	78%	0.776	S	S	*	*			trans	-74	163.2	-176.4	-60.4	0	0	0	0	112.8
1149	P	31.8	Very low	27.4	Very low	128 Å²	128	141 Å²	141	83%	0.831	78%	0.778	S	S	*	*			trans	-83	141.3	-173.9	33.3	-34.9	0	0	0	112.3
1150	S	23.9	Very low	27.2	Very low	96 Å²	96	137.9 Å²	137.9	67%	0.671	77%	0.771	S	S	*	*			trans	-168.1	136.5	160.1	58.3	0	0	0	0	112.4
1151	L	25.4	Very low	27.1	Very low	154 Å²	154	139.3 Å²	139.3	81%	0.806	77%	0.77	S	S	*	*			trans	67.3	147.3	146.7	-57.1	162.6	0	0	0	115.8
1152	I	26.4	Very low	27.4	Very low	129 Å²	129	133.8 Å²	133.8	66%	0.662	77%	0.768	S	S	*	*			cis	-161.1	-176.8	6	-131.8	166.5	0	0	0	110.3
1153	D	26.6	Very low	27.4	Very low	121 Å²	121	129.2 Å²	129.2	65%	0.647	75%	0.749	S	S	*	*			trans	81.3	89.1	161.3	-73.4	-16.1	0	0	0	122.4
1154	N	26.4	Very low	27.5	Very low	133 Å²	133	132.5 Å²	132.5	71%	0.711	75%	0.751	S	S	*	*				105.8	137.6	101.4	-74.9	-21.1	0	0	0	123.3
1155	S	31	Very low	27.7	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	75%	0.75	S	S	*	*			trans	74.7	82.9	156.2	66.2	0	0	0	0	118.7	P1157	S1155-P1157 WeakPolarHBondContact O-CD 3.31Å
1156	S	27	Very low	27.6	Very low	113 Å²	113	131 Å²	131	79%	0.79	75%	0.751	S	S	*	*			trans	-71.9	132.1	137.8	173.3	0	0	0	0	109.5
1157	P	33.4	Very low	27.8	Very low	115 Å²	115	128 Å²	128	75%	0.747	74%	0.743	S	S	*	*			trans	-102.8	126.8	153.1	32	-24.7	0	0	0	110.8	S1155	S1155-P1157 WeakPolarHBondContact O-CD 3.31Å
1158	H	26.6	Very low	27.6	Very low	174 Å²	174	123.2 Å²	123.2	81%	0.806	74%	0.741	S	S	*	*			trans	-53.4	-179.8	161.7	-86.2	-81.8	0	0	0	113.2
1159	S	27.3	Very low	27.9	Very low	111 Å²	111	123 Å²	123	78%	0.776	74%	0.739	S	S	*	*			trans	88.8	140.7	151.1	97.1	0	0	0	0	114.4
1160	V	26.9	Very low	27.5	Very low	103 Å²	103	124.2 Å²	124.2	62%	0.624	74%	0.737	S	S	*	*			cis	-152.7	168.1	-10	-163.9	0	0	0	0	107.7
1161	Y	27	Very low	27.6	Very low	207 Å²	207	125 Å²	125	81%	0.812	74%	0.742	S	S	*	*			trans	71.4	137.2	166.2	-58.6	-71.3	0	0	0	115.4
1162	S	30.2	Very low	27.6	Very low	125 Å²	125	125.3 Å²	125.3	87%	0.874	74%	0.744	S	S	*	*			cis	-125.3	146.9	35.8	-168.2	0	0	0	0	114.5
1163	S	27.6	Very low	27.6	Very low	67 Å²	67	124.7 Å²	124.7	47%	0.469	75%	0.751	S	S	.	*			trans	-111.4	159.8	176.5	54.3	0	0	0	0	112.6
1164	H	29.6	Very low	27.8	Very low	185 Å²	185	125.3 Å²	125.3	86%	0.856	76%	0.762	S	S	*	*			trans	71.3	146.8	158.1	-52.3	-55.5	0	0	0	122.3
1165	G	28.7	Very low	27.8	Very low	63 Å²	63	126.2 Å²	126.2	65%	0.649	77%	0.767	S	S	*	*			trans	102.8	87.3	165.6	0	0	0	0	0	113.8
1166	S	26.9	Very low	27.8	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	77%	0.766	S	S	*	*				62.1	128.9	56.7	-37.7	0	0	0	0	111.3
1167	S	28.2	Very low	28	Very low	98 Å²	98	130.7 Å²	130.7	69%	0.685	76%	0.763	S	S	*	*			cis	-163.2	158.9	20.1	-52.9	0	0	0	0	112.3
1168	T	25.5	Very low	27.7	Very low	139 Å²	139	130.3 Å²	130.3	85%	0.853	76%	0.755	S	S	*	*			trans	52.7	148.4	142.8	52.1	0	0	0	0	121.4
1169	S	28.6	Very low	27.7	Very low	101 Å²	101	127.7 Å²	127.7	71%	0.706	75%	0.746	S	S	*	*			cis	-164.7	128.6	8.9	39.7	0	0	0	0	109.3
1170	I	24.1	Very low	27.7	Very low	153 Å²	153	127.4 Å²	127.4	79%	0.785	74%	0.74	S	S	*	*				49.4	110.6	99.6	-51.2	178.3	0	0	0	118.3	L1172	I1170-L1172 HydrophobicContact CG2-CG 4.31Å
1171	S	26.9	Very low	27.5	Very low	111 Å²	111	129 Å²	129	78%	0.776	75%	0.745	S	S	*	*			trans	-168.3	104.9	135.7	48.8	0	0	0	0	108.1
1172	L	25.8	Very low	27.3	Very low	162 Å²	162	126.7 Å²	126.7	85%	0.848	75%	0.746	S	S	*	*				70.3	110.3	81.2	-70.1	176.4	0	0	0	114.8	I1170	I1170-L1172 HydrophobicContact CG2-CG 4.31Å
1173	S	24.9	Very low	27.1	Very low	116 Å²	116	127.4 Å²	127.4	81%	0.811	74%	0.74	S	S	*	*			trans	-121.6	135.2	164.5	-54.7	0	0	0	0	109.1
1174	P	30.6	Very low	26.9	Very low	133 Å²	133	129.8 Å²	129.8	86%	0.864	75%	0.752	S	S	*	*			trans	-87.6	171.7	177.7	34.8	-32.9	0	0	0	112.7
1175	N	26.2	Very low	26.6	Very low	153 Å²	153	127.1 Å²	127.1	82%	0.818	75%	0.754	S	S	*	*			trans	-148.4	116.6	-164.9	169.9	82.6	0	0	0	109.5
1176	E	31.9	Very low	26.4	Very low	157 Å²	157	131.2 Å²	131.2	73%	0.734	76%	0.757	S	S	*	*			trans	-138.4	116.3	173.7	-65.5	-162	134.7	0	0	108.7
1177	Q	31	Very low	26.3	Very low	156 Å²	156	133.6 Å²	133.6	73%	0.729	76%	0.756	S	S	*	*				80.8	150.6	94.2	-69.9	166.9	39	0	0	113.5
1178	N	26.8	Very low	26.1	Very low	107 Å²	107	137.7 Å²	137.7	57%	0.572	77%	0.766	S	S	*	*			cis	-174.2	154.3	-37.3	-150.3	0.3	0	0	0	106.9	T129	T129-N1178 WeakPolarHBondContact CG2-ND2 3.35Å
1179	L	26.5	Very low	26.3	Very low	119 Å²	119	139.6 Å²	139.6	62%	0.623	77%	0.766	S	S	*	*			trans	65.1	159.1	162.5	-55.3	159	0	0	0	115.3
1180	T	27.1	Very low	26.1	Very low	105 Å²	105	140.6 Å²	140.6	64%	0.644	77%	0.768	S	S	*	*			cis	-157.2	143.6	-4.5	7.6	0	0	0	0	109.4
1181	D	23.3	Very low	26.2	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	77%	0.769	S	S	*	*			trans	45.2	141.5	135.6	-57.8	-13.1	0	0	0	124.7
1182	L	23.8	Very low	26.2	Very low	158 Å²	158	140.6 Å²	140.6	83%	0.827	77%	0.77	S	S	*	*			trans	85.2	143.6	147.4	-75.8	155.7	0	0	0	121.4
1183	N	24.3	Very low	26.3	Very low	139 Å²	139	138 Å²	138	74%	0.743	77%	0.766	S	S	*	*			trans	82.1	111.9	159.9	-72.2	-11.9	0	0	0	122.2
1184	V	25	Very low	26.6	Very low	118 Å²	118	141 Å²	141	72%	0.715	77%	0.767	S	S	*	*				62.1	96.4	128.3	-172.5	0	0	0	0	117.2	M1186	V1184-M1186 HydrophobicContact CG1-CB 4.37Å
1185	S	23.6	Very low	26.4	Very low	129 Å²	129	141.8 Å²	141.8	90%	0.902	76%	0.763	S	S	*	*			trans	-98.7	104.1	157.1	63.5	0	0	0	0	110.3
1186	M	24.4	Very low	26.6	Very low	148 Å²	148	142.6 Å²	142.6	73%	0.729	77%	0.766	S	S	*	*			trans	-99	130.8	177	-145.7	171.7	81.6	0	0	110.6	V1184	V1184-M1186 HydrophobicContact CG1-CB 4.37Å
1187	Q	24.4	Very low	26.5	Very low	165 Å²	165	144.1 Å²	144.1	77%	0.771	77%	0.773	S	S	*	*			trans	37.1	107.2	149.3	-66	175.1	-26.6	0	0	120.9
1188	M	24.5	Very low	26.2	Very low	184 Å²	184	140.7 Å²	140.7	91%	0.906	77%	0.767	S	S	*	*			trans	171.1	133.2	138.2	-104.3	-177.8	168.9	0	0	107.9
1189	E	28.7	Very low	26.3	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	77%	0.774	S	S	*	*			cis	-133.9	156	0.9	-71.6	171.4	124	0	0	110.6
1190	T	25.3	Very low	26.3	Very low	123 Å²	123	142.3 Å²	142.3	76%	0.755	78%	0.781	S	S	*	*			trans	-88.1	170	-174.5	-2.7	0	0	0	0	113.4
1191	T	25.6	Very low	26.3	Very low	130 Å²	130	145.4 Å²	145.4	80%	0.798	79%	0.793	S	S	*	*			trans	72.8	92.1	170.6	71.6	0	0	0	0	118
1192	V	26.7	Very low	26.4	Very low	133 Å²	133	143.2 Å²	143.2	81%	0.806	79%	0.789	S	S	*	*	S	Bend		-166.6	61.2	112.2	-169	0	0	0	0	108
1193	S	27.5	Very low	26.6	Very low	109 Å²	109	143 Å²	143	76%	0.762	79%	0.788	S	S	*	*	S	Bend	trans	-144.7	-4.1	178.4	-64	0	0	0	0	116
1194	E	30.9	Very low	26.7	Very low	178 Å²	178	145.3 Å²	145.3	83%	0.832	79%	0.792	S	S	*	*	S	Bend	trans	-114.3	10.9	179.7	-71.1	176.7	137.4	0	0	113.8
1195	L	28.1	Very low	26.7	Very low	150 Å²	150	146.8 Å²	146.8	79%	0.785	80%	0.795	S	S	*	*	S	Bend	trans	-115.5	16	-176.5	-111.5	165	0	0	0	114.2
1196	L	28.9	Very low	26.8	Very low	169 Å²	169	146.1 Å²	146.1	89%	0.885	79%	0.79	S	S	*	*	S	Bend	trans	-132.3	6.6	177.9	-80.6	172.2	0	0	0	114.3
1197	E	29.7	Very low	27	Very low	189 Å²	189	149 Å²	149	88%	0.883	79%	0.794	S	S	*	*	S	Bend	trans	-114.1	13.3	-179.7	-149	153.9	-138.8	0	0	112.4
1198	S	25.8	Very low	27.3	Very low	85 Å²	85	147.9 Å²	147.9	59%	0.594	79%	0.793	S	S	*	*	S	Bend	trans	-138.2	36.8	-171.8	50.9	0	0	0	0	114.3
1199	I	27.6	Very low	27.4	Very low	141 Å²	141	145.6 Å²	145.6	72%	0.723	79%	0.785	S	S	*	*	S	Bend	trans	-131.9	113.6	162.8	-57	-179.5	0	0	0	109.4	L1201	I1199-L1201 PolarHBondContact O-N 2.88Å; I1199-L1201 VanDerWaalsContact O-N 3.12Å
1200	P	27	Very low	27.4	Very low	118 Å²	118	144.8 Å²	144.8	77%	0.766	79%	0.787	S	S	*	*			trans	-77.8	99.5	-174.3	30.4	-34.1	0	0	0	112	S1202	P1200-S1202 VanDerWaalsContact C-N 3.34Å; P1200-S1202 PolarHBondContact O-N 2.89Å; P1200-S1202 VanDerWaalsContact O-N 3.16Å
1201	L	26.5	Very low	27.4	Very low	171 Å²	171	142.7 Å²	142.7	90%	0.895	79%	0.789	S	S	*	*			trans	-86.2	67	172.3	-84.2	166.7	0	0	0	112.1	I1199	I1199-L1201 PolarHBondContact O-N 2.88Å; I1199-L1201 VanDerWaalsContact O-N 3.12Å
1202	S	27	Very low	27.5	Very low	92 Å²	92	142.6 Å²	142.6	64%	0.643	79%	0.788	S	S	*	*			trans	-156.8	101.9	170.3	56.4	0	0	0	0	114.9	P1200	P1200-S1202 VanDerWaalsContact C-N 3.34Å; P1200-S1202 PolarHBondContact O-N 2.89Å; P1200-S1202 VanDerWaalsContact O-N 3.16Å
1203	N	27.1	Very low	27.3	Very low	154 Å²	154	144.3 Å²	144.3	82%	0.824	79%	0.787	S	S	*	*			trans	49.8	124.9	137.7	-65.3	-28.4	0	0	0	122.1
1204	K	26	Very low	27.2	Very low	187 Å²	187	147 Å²	147	81%	0.813	79%	0.79	S	S	*	*			trans	83.8	120.7	139.7	-78.2	-173.3	173.5	-170.7	0	120.8
1205	L	26	Very low	26.9	Very low	149 Å²	149	144.4 Å²	144.4	78%	0.78	78%	0.782	S	S	*	*			trans	90.5	130.7	134.7	-69.3	164.6	0	0	0	121
1206	S	25.3	Very low	27	Very low	115 Å²	115	144.3 Å²	144.3	80%	0.804	78%	0.781	S	S	*	*			trans	63.7	135	153.8	40.1	0	0	0	0	121
1207	Y	28.1	Very low	26.8	Very low	207 Å²	207	142.4 Å²	142.4	81%	0.812	77%	0.771	S	S	*	*			trans	-70	155.2	164.5	-81.9	-106.4	0	0	0	111
1208	D	30.8	Very low	26.7	Very low	142 Å²	142	142.6 Å²	142.6	76%	0.759	77%	0.769	S	S	*	*				-153.9	155.3	115.7	-97.5	-27.7	0	0	0	110.3
1209	N	27.1	Very low	26.8	Very low	137 Å²	137	145.7 Å²	145.7	73%	0.733	78%	0.779	S	S	*	*			trans	-75.5	146.1	178.2	-70.2	-38.5	0	0	0	110.9
1210	D	28.7	Very low	26.7	Very low	162 Å²	162	142 Å²	142	87%	0.866	78%	0.776	S	S	*	*				-174.8	138.4	114.4	-92.3	-20.8	0	0	0	110.7
1211	G	26	Very low	26.8	Very low	78 Å²	78	143.3 Å²	143.3	80%	0.804	78%	0.777	S	S	*	*			trans	-86.5	130	-177	0	0	0	0	0	112.3
1212	V	26.4	Very low	26.8	Very low	128 Å²	128	140.1 Å²	140.1	78%	0.776	77%	0.769	S	S	*	*			trans	-130.3	114.8	154.5	-179.6	0	0	0	0	109.5
1213	Q	23.4	Very low	26.9	Very low	170 Å²	170	145.9 Å²	145.9	79%	0.794	78%	0.778	S	S	*	*			trans	-73.5	126.8	172.1	-167.2	176	13.5	0	0	109
1214	M	25.3	Very low	26.9	Very low	164 Å²	164	145.2 Å²	145.2	81%	0.808	77%	0.774	S	S	*	*			trans	-136.4	100.1	161.1	-88.5	-153.3	-101.5	0	0	111
1215	N	24	Very low	27	Very low	125 Å²	125	140.2 Å²	140.2	67%	0.668	76%	0.763	S	S	*	*			trans	-63.7	135.8	157.9	-69	-6.7	0	0	0	108.8
1216	I	30.4	Very low	27.2	Very low	148 Å²	148	139.9 Å²	139.9	76%	0.759	76%	0.762	S	S	*	*			trans	-131.7	81.5	153.1	-55.3	-178.7	0	0	0	107.1
1217	D	25.1	Very low	27.4	Very low	129 Å²	129	139.2 Å²	139.2	69%	0.69	75%	0.753	S	S	*	*			trans	-66	139.6	150	-69	-55.6	0	0	0	108
1218	F	28.1	Very low	27.4	Very low	192 Å²	192	137.6 Å²	137.6	84%	0.842	75%	0.75	S	S	*	*			trans	-155.8	97.8	144.5	-100.7	-65.3	0	0	0	111.5
1219	N	26.9	Very low	27.5	Very low	151 Å²	151	137.6 Å²	137.6	81%	0.807	75%	0.746	S	S	*	*			trans	20	130.8	141.3	-72.5	-21.2	0	0	0	119.4
1220	G	25.9	Very low	27.8	Very low	64 Å²	64	138.9 Å²	138.9	66%	0.66	74%	0.741	S	S	*	*				129.8	133.6	92.5	0	0	0	0	0	118.5
1221	N	28.4	Very low	28.1	Very low	145 Å²	145	138.3 Å²	138.3	78%	0.775	73%	0.734	S	S	*	*			trans	80.9	96.2	148	-57.9	-4.2	0	0	0	119
1222	S	26	Very low	28.5	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	73%	0.727	S	S	*	*			trans	-28.6	132.4	131.8	52	0	0	0	0	115.9
1223	Y	30.9	Very low	29	Very low	214 Å²	214	138.5 Å²	138.5	84%	0.839	72%	0.719	S	S	*	*			trans	-150.2	110.9	136.1	-84.4	-79.3	0	0	0	104.8
1224	D	27.1	Very low	29.6	Very low	140 Å²	140	138 Å²	138	75%	0.749	72%	0.716	S	S	*	*				86.1	139.4	50.3	-164.7	26	0	0	0	113.6
1225	S	27.2	Very low	29.9	Very low	81 Å²	81	136.7 Å²	136.7	57%	0.566	71%	0.712	S	S	*	*			trans	78.7	134.7	165.6	81.8	0	0	0	0	121
1226	N	30.5	Very low	30.4	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	71%	0.711	S	S	*	*			trans	80.2	135.9	144.1	-58.6	-21.1	0	0	0	119.1
1227	T	29.4	Very low	30.6	Very low	102 Å²	102	135.3 Å²	135.3	63%	0.626	71%	0.708	S	S	*	*			cis	-167.6	140.9	2.1	-107.3	0	0	0	0	110.6
1228	F	28.2	Very low	30.9	Very low	172 Å²	172	135.4 Å²	135.4	75%	0.754	71%	0.708	S	S	*	*			trans	42.2	140.5	148.3	-66.9	-114.8	0	0	0	119
1229	E	32.6	Very low	30.9	Very low	142 Å²	142	132.4 Å²	132.4	66%	0.664	70%	0.701	S	S	*	*			cis	-167.5	-172	39	-124.9	143.2	-136.3	0	0	107.6
1230	Y	34.1	Very low	31.1	Very low	164 Å²	164	129.6 Å²	129.6	64%	0.643	69%	0.693	S	S	*	*			cis	-156.1	128.6	7.7	-135.1	-67	0	0	0	107
1231	E	34.7	Very low	31.3	Very low	151 Å²	151	133.2 Å²	133.2	71%	0.706	70%	0.697	S	S	*	*			trans	55.2	149.2	154.7	-77.3	169.4	-175.6	0	0	121.7
1232	D	34.6	Very low	31.4	Very low	123 Å²	123	135.4 Å²	135.4	66%	0.658	70%	0.7	S	S	*	*			cis	-159.2	155.8	4.6	-135.6	-27.6	0	0	0	114.3
1233	S	36	Very low	31.6	Very low	87 Å²	87	138.1 Å²	138.1	61%	0.608	70%	0.701	S	S	*	*			trans	54.7	141.9	145	-63.5	0	0	0	0	122.1
1234	E	35.9	Very low	31.5	Very low	159 Å²	159	133 Å²	133	74%	0.743	70%	0.697	S	S	*	*			cis	-167.9	147.3	-5.9	-113.8	-176.2	165.2	0	0	109.2
1235	L	32.9	Very low	31.5	Very low	137 Å²	137	130.8 Å²	130.8	72%	0.717	69%	0.692	S	S	*	*			trans	54.6	146.9	141.4	-60.7	166.2	0	0	0	120.8
1236	S	34.5	Very low	31.6	Very low	91 Å²	91	135.1 Å²	135.1	64%	0.636	70%	0.703	S	S	*	*			cis	-172.6	133.3	-4.9	49.6	0	0	0	0	112
1237	H	33.8	Very low	31.7	Very low	153 Å²	153	134.5 Å²	134.5	71%	0.708	70%	0.7	S	S	*	*				60.4	128.7	128.1	-72.7	-64.2	0	0	0	124.7
1238	L	30.5	Very low	31.6	Very low	131 Å²	131	138.4 Å²	138.4	69%	0.686	71%	0.709	S	S	*	*				62.6	152.5	125.2	-52.5	171.8	0	0	0	119
1239	D	29	Very low	31.8	Very low	129 Å²	129	136.6 Å²	136.6	69%	0.69	71%	0.712	S	S	*	*			cis	-164.3	176.8	-12.1	-115.4	-8.7	0	0	0	110.1
1240	S	31.7	Very low	31.6	Very low	91 Å²	91	132.9 Å²	132.9	64%	0.636	71%	0.712	S	S	*	*			trans	61.4	113.9	146.2	62	0	0	0	0	121
1241	D	28.8	Very low	31.4	Very low	140 Å²	140	135 Å²	135	75%	0.749	73%	0.725	S	S	*	*				38.7	127	113.4	-43.8	-31.4	0	0	0	119.8
1242	F	31.3	Very low	31.1	Very low	191 Å²	191	134.8 Å²	134.8	84%	0.838	72%	0.724	S	S	*	*				-169.9	166.2	109.7	-118.3	-88.7	0	0	0	112.7
1243	E	29.5	Very low	31	Very low	161 Å²	161	134.8 Å²	134.8	75%	0.752	73%	0.73	S	S	*	*			trans	-77.4	172.4	-170.8	-55.9	168.4	115.2	0	0	115.4
1244	S	28.5	Very low	30.6	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	73%	0.731	S	S	*	*			trans	112.1	129.2	132.6	75.8	0	0	0	0	121.2
1245	S	27.6	Very low	30.4	Very low	93 Å²	93	135.9 Å²	135.9	65%	0.65	73%	0.734	S	S	*	*			trans	64.8	117.7	140.2	60	0	0	0	0	122.8
1246	E	29.6	Very low	30.2	Very low	171 Å²	171	136.2 Å²	136.2	80%	0.799	74%	0.735	S	S	*	*				50.3	122.4	120.8	-56.8	-179.7	166.8	0	0	121
1247	N	32.5	Very low	29.8	Very low	130 Å²	130	137 Å²	137	70%	0.695	74%	0.741	S	S	*	*				159.3	115	117.3	-86	-64.9	0	0	0	109.8
1248	F	26.5	Very low	29.6	Very low	184 Å²	184	137.1 Å²	137.1	81%	0.807	75%	0.746	S	S	*	*				87.7	144.2	82.1	-114.8	-80.3	0	0	0	114.6
1249	T	32.4	Very low	29.5	Very low	134 Å²	134	135 Å²	135	82%	0.822	74%	0.743	S	S	*	*			trans	73.9	137.7	175.7	77.5	0	0	0	0	116.8
1250	G	29.7	Very low	29.6	Very low	64 Å²	64	135.9 Å²	135.9	66%	0.66	75%	0.747	S	S	*	*			cis	173.8	168.4	-9.8	0	0	0	0	0	114.4
1251	F	30.1	Very low	29.6	Very low	209 Å²	209	137.7 Å²	137.7	92%	0.917	75%	0.754	S	S	*	*			trans	79	104.5	160.7	-65.1	-79.5	0	0	0	121.7
1252	Q	28.5	Very low	29.7	Very low	146 Å²	146	137.8 Å²	137.8	68%	0.682	75%	0.754	S	S	*	*			trans	-53.4	160.9	149.4	-127.7	158.1	-42.3	0	0	112.3	D1254	Q1252-D1254 PolarHBondContact NE2-OD1 3.03Å; Q1252-D1254 PolarHBondContact NE2-OD2 3.49Å
1253	P	32.4	Very low	29.6	Very low	122 Å²	122	135.9 Å²	135.9	79%	0.792	75%	0.752	S	S	*	*				-135.5	148.7	81.3	36.6	-23.1	0	0	0	113.1
1254	D	26.8	Very low	29.5	Very low	118 Å²	118	133.7 Å²	133.7	63%	0.631	76%	0.755	S	S	*	*				74.7	146.3	50.4	-83.1	-7.3	0	0	0	116.8	Q1252	Q1252-D1254 PolarHBondContact NE2-OD1 3.03Å; Q1252-D1254 PolarHBondContact NE2-OD2 3.49Å
1255	L	31.7	Very low	29.7	Very low	152 Å²	152	132.3 Å²	132.3	80%	0.796	74%	0.743	S	S	*	*			trans	88.6	95.6	-175	-51.4	173.6	0	0	0	114.1
1256	I	28.6	Very low	29.9	Very low	144 Å²	144	134.5 Å²	134.5	74%	0.738	75%	0.752	S	S	*	*				65.4	95.2	76.5	-60.4	173.7	0	0	0	109.9
1257	S	26.1	Very low	29.9	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	75%	0.75	S	S	*	*				75.4	98.5	83.5	-60	0	0	0	0	114.7
1258	D	30.6	Very low	29.8	Very low	154 Å²	154	132.8 Å²	132.8	82%	0.824	75%	0.753	S	S	*	*			trans	-140.7	112.8	145.4	-79.1	-42.9	0	0	0	104.7
1259	S	28.2	Very low	29.9	Very low	88 Å²	88	129.9 Å²	129.9	62%	0.615	75%	0.75	S	S	*	*				46	91.5	81.8	69.5	0	0	0	0	113.8
1260	D	29.8	Very low	29.8	Very low	147 Å²	147	129.7 Å²	129.7	79%	0.786	75%	0.746	S	S	*	*				175.7	167.9	101.5	-88.4	-22.9	0	0	0	112.8
1261	V	32.6	Very low	29.8	Very low	128 Å²	128	133.8 Å²	133.8	78%	0.776	75%	0.751	S	S	*	*			trans	68	74.5	172.1	-160.2	0	0	0	0	114.6
1262	L	30.8	Very low	29.8	Very low	143 Å²	143	128.8 Å²	128.8	75%	0.749	74%	0.74	S	S	*	*				54.6	110.6	87.9	-68.8	163.8	0	0	0	116.1
1263	N	29	Very low	29.9	Very low	150 Å²	150	127.6 Å²	127.6	80%	0.802	74%	0.744	S	S	*	*			trans	61.1	98.1	138.1	-57.5	-13.4	0	0	0	120
1264	S	27.8	Very low	29.7	Very low	115 Å²	115	128 Å²	128	80%	0.804	74%	0.74	S	S	*	*				157.7	137.9	104.3	-166.4	0	0	0	0	111.7
1265	P	31.6	Very low	29.9	Very low	78 Å²	78	128.8 Å²	128.8	51%	0.506	75%	0.75	S	S	.	*			trans	-91.1	164.7	-168	36.1	-37.3	0	0	0	116	S479	S479-P1265 WeakPolarHBondContact CB-O 3.35Å; S479-P1265 PolarHBondContact OG-O 3.35Å
1266	V	32.3	Very low	29.8	Very low	139 Å²	139	126.7 Å²	126.7	84%	0.842	75%	0.745	S	S	*	*			trans	-119.2	0	165.8	-177.7	0	0	0	0	111.9	S479	S479-V1266 VanDerWaalsContact CB-C 3.46Å; S479-V1266 WeakPolarHBondContact CB-OXT 3.48Å

Retrieved 1,266 of 1,266 residues in 205.4 ms (Link to these results)

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