A0A087XD85_POEFO Loading...

Calmodulin regulated spectrin-associated protein 1b

AlphaFold DB , UniProt , Accession A0A087XD85, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,062 aa.

						>A0A087XD85_POEFO|A0A087XD85
MLHSATDSDADIASGDSVSLARSISKDSLASNVTNVTPKHQTAVHQSSLAAMRRVNGHNLLSHVNMEDGEETPADATVIPKRSDGPAASATAIPRPSSDSTPDADGFYLEPLMPAVLKTAKEKSVCLNKEEESGEGPRSAGRGSLRRGDGSSAAVRRKAPSDLNQTFPAPGEEECLTDERQQADFRPVISSSVNCSSREPAEGFYLHSDSDEPKCVHGPEAELEDLDEEEEDLDEALTTKDSRKGYGEADEEESAKLQEDMNVKEHEDKDFNGASGRSSPCLSTHSQASSMASGSVRMTSFAERKAQQQRFGSNHDLRSSASSSQRTTPDGSESSGPLSSSWRLKRDQSPSSPLGGCNRPGDGGTNVLASEIVQLRMQLEEKRRAIEHQKKKMEVLAARQRQKLGKAAFLHIVKKGGGRSDTLPSSLKADISKDDLNGEKGPLSKDDMCVDTLRGQKEAEGTDALEADKKGNGGSFYLDEELDLNECSRSIELLNEAIGSIQQQMMQLSLQQEMLMKQNVQSPPCATPPPPHAGDKNGDSKTGGFHFVEHLSGSGSAPTRKPPKLSSGRSSRSKPSELKLAKEQSRPASRALTPTQGGSETLASPRQLSGGRSPRCDRNPTAAEMMDRPGSGHVRSATFRLHDEANMRLPTRVDLACVPAPEPLGESGSSTQVEGDVSSSEKEGLLSEEAQRSKTHLIEVDLSELKAPEEEEGTEDAAAEKGDGEQKSVMGFFFKDEQKAEDELAKKRAAFLLKQQKKAEEARIRKQQLEAESELKRDEARRKAEEDRLRKEEEKTRRELIKQEYLRRKQQEMFEEQGLVKPKTPKPKQKHKHKAVIREESATDHFSKCSSTPDNLSNAQSGSNLSLASAATNEADSVNSGGAGSQRCDSVESFPGSRNNSRAAERDWDNGSTASSITSMAEYTGPKLFKEPSAKSNKPIIHNAISHCCLAGKVNEPQKNQILEELEKCESNHLMILFRDGGCQFRALYTYFPDTEEIHKLTGTGPKSISKKMIDKLYKYSSDRKQFTVIPAKTVSVSVDALTIHNHLWQAKRSAVPKKTGK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.3	Very low	36.2	Very low	248 Å²	248	136.7 Å²	136.7	100%	1.222	79%	0.79	S	S	*	*				0	176.3	0	-83.3	176.9	165.6	0	0	108.5
2	L	38	Very low	36.1	Very low	156 Å²	156	137.7 Å²	137.7	82%	0.817	79%	0.788	S	S	*	*			trans	-56.2	155	173.2	-66	160.8	0	0	0	111.8
3	H	32.7	Very low	36	Very low	188 Å²	188	133.4 Å²	133.4	87%	0.87	78%	0.779	S	S	*	*				-163.6	-179.9	119.1	-92.9	-58.6	0	0	0	109.4
4	S	39.1	Very low	35.9	Very low	104 Å²	104	132.7 Å²	132.7	73%	0.727	79%	0.785	S	S	*	*			trans	-152.8	163.1	-150.3	52.7	0	0	0	0	113.4
5	A	40.7	Very low	35.7	Very low	88 Å²	88	128.3 Å²	128.3	73%	0.727	78%	0.778	S	S	*	*			trans	71	160.1	172.7	0	0	0	0	0	113.8
6	T	37.2	Very low	35.5	Very low	126 Å²	126	129.1 Å²	129.1	77%	0.773	78%	0.777	S	S	*	*			cis	-164.8	135.4	-5	9.6	0	0	0	0	105.8
7	D	34.2	Very low	35.6	Very low	141 Å²	141	127.9 Å²	127.9	75%	0.754	78%	0.776	S	S	*	*				91	133.7	83.8	-169.9	24.6	0	0	0	115.6
8	S	38.1	Very low	35.6	Very low	98 Å²	98	127.3 Å²	127.3	69%	0.685	77%	0.773	S	S	*	*			trans	53.4	169.8	168.4	-67.6	0	0	0	0	119
9	D	32.3	Very low	35.4	Very low	145 Å²	145	125.5 Å²	125.5	78%	0.775	77%	0.766	S	S	*	*			cis	-154.6	164.5	9.9	-151.2	2.7	0	0	0	114.3
10	A	41.9	Very low	35.3	Very low	75 Å²	75	126.7 Å²	126.7	62%	0.62	77%	0.767	S	S	*	*			trans	53.1	158.1	147.6	0	0	0	0	0	122.4
11	D	34.4	Very low	35.3	Very low	135 Å²	135	124.8 Å²	124.8	72%	0.722	76%	0.764	S	S	*	*			cis	-163	167.8	-10	-139.5	-20.3	0	0	0	114
12	I	35.3	Very low	35.5	Very low	148 Å²	148	123.7 Å²	123.7	76%	0.759	75%	0.747	S	S	*	*			trans	50.9	143.1	147.4	-79.9	157.5	0	0	0	121.5
13	A	34.5	Very low	35.2	Very low	82 Å²	82	120.9 Å²	120.9	68%	0.678	74%	0.74	S	S	*	*			cis	-173.5	178	-23.5	0	0	0	0	0	106.2
14	S	34.4	Very low	35	Very low	124 Å²	124	119 Å²	119	87%	0.867	74%	0.735	S	S	*	*			cis	-138.4	-159.1	3.3	-57.4	0	0	0	0	107.1
15	G	32.8	Very low	34.5	Very low	66 Å²	66	119.4 Å²	119.4	68%	0.68	74%	0.737	S	S	*	*			cis	-172.7	146.9	-0.5	0	0	0	0	0	107.3
16	D	33.8	Very low	34.2	Very low	142 Å²	142	124.2 Å²	124.2	76%	0.759	74%	0.742	S	S	*	*				85.4	99.3	68.7	-157.1	41.7	0	0	0	112.3	V18	D16-V18 VanDerWaalsContact OD1-CG2 3.26Å; D16-V18 WeakPolarHBondContact OD1-CG2 3.06Å
17	S	36.1	Very low	34	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	74%	0.74	S	S	*	*				-145.6	134.7	67.3	14.9	0	0	0	0	112.1
18	V	35.9	Very low	33.9	Very low	118 Å²	118	123.1 Å²	123.1	72%	0.715	74%	0.74	S	S	*	*				71.8	121.9	78.1	172.2	0	0	0	0	112	D16	D16-V18 VanDerWaalsContact OD1-CG2 3.26Å; D16-V18 WeakPolarHBondContact OD1-CG2 3.06Å
19	S	32.3	Very low	33.8	Very low	92 Å²	92	126.2 Å²	126.2	64%	0.643	75%	0.748	S	S	*	*			cis	-150.2	149.7	15.9	-142.3	0	0	0	0	116
20	L	32.9	Very low	33.8	Very low	149 Å²	149	123.3 Å²	123.3	78%	0.78	74%	0.744	S	S	*	*			trans	14.2	140.3	138.4	-52.7	169.7	0	0	0	119.3
21	A	34.4	Very low	33.4	Very low	87 Å²	87	124.3 Å²	124.3	72%	0.719	75%	0.746	S	S	*	*			cis	62.2	159.4	45.4	0	0	0	0	0	112.8
22	R	34.7	Very low	33.2	Very low	226 Å²	226	124.7 Å²	124.7	85%	0.853	75%	0.748	S	S	*	*			cis	-171.2	150.6	10.8	-149.8	-179.7	-166.1	176.7	4.2	110.3
23	S	30.6	Very low	32.9	Very low	96 Å²	96	123.6 Å²	123.6	67%	0.671	75%	0.748	S	S	*	*			trans	66.4	164.7	142.3	55.8	0	0	0	0	124.8
24	I	30.1	Very low	32.9	Very low	149 Å²	149	124.9 Å²	124.9	76%	0.764	75%	0.748	S	S	*	*			trans	69.5	108.3	154.4	59.2	167.2	0	0	0	125.2
25	S	28.8	Very low	32.6	Very low	112 Å²	112	125.9 Å²	125.9	78%	0.783	74%	0.744	S	S	*	*				66.5	150.1	112.7	-53.2	0	0	0	0	125.4
26	K	33.9	Very low	32.3	Very low	190 Å²	190	129.4 Å²	129.4	83%	0.826	75%	0.752	S	S	*	*			trans	81.3	99.8	157.2	-81.8	-173	169.7	-175.5	0	121.4
27	D	33.5	Very low	32.4	Very low	137 Å²	137	128.7 Å²	128.7	73%	0.733	75%	0.753	S	S	*	*				43.9	111.5	123	-60	-63.7	0	0	0	123.2
28	S	31.9	Very low	32.9	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	75%	0.753	S	S	*	*				87	145.8	127.5	-61.2	0	0	0	0	123.2
29	L	34.4	Very low	32.6	Very low	164 Å²	164	132.4 Å²	132.4	86%	0.859	76%	0.757	S	S	*	*			trans	86.7	94	162.8	-51.8	-171	0	0	0	121.2
30	A	32.4	Very low	32.7	Very low	84 Å²	84	136.4 Å²	136.4	69%	0.694	77%	0.766	S	S	*	*				57	113.9	120.6	0	0	0	0	0	123.7
31	S	34.2	Very low	32.5	Very low	96 Å²	96	138 Å²	138	67%	0.671	77%	0.769	S	S	*	*			trans	63.2	127.1	130.3	71.9	0	0	0	0	119.9
32	N	31.3	Very low	32.5	Very low	143 Å²	143	140.3 Å²	140.3	77%	0.765	77%	0.774	S	S	*	*				-172.8	-174.5	58.7	-83.9	-66.6	0	0	0	112.4
33	V	28.9	Very low	32.4	Very low	125 Å²	125	133.4 Å²	133.4	76%	0.758	77%	0.766	S	S	*	*			trans	93.5	103.6	152.8	-169.1	0	0	0	0	120.1
34	T	32.6	Very low	32.5	Very low	109 Å²	109	134.9 Å²	134.9	67%	0.669	77%	0.77	S	S	*	*			trans	12	158.7	134.2	66.1	0	0	0	0	122.4
35	N	28.4	Very low	32.6	Very low	145 Å²	145	134.9 Å²	134.9	78%	0.775	77%	0.767	S	S	*	*			cis	-171.6	-175.4	-0.9	-109.9	-13.5	0	0	0	111.6
36	V	27.3	Very low	32.5	Very low	140 Å²	140	137.8 Å²	137.8	85%	0.848	77%	0.768	S	S	*	*			trans	106.1	134.1	151.6	-172.2	0	0	0	0	118.7
37	T	34.8	Very low	32.2	Very low	127 Å²	127	133.5 Å²	133.5	78%	0.779	76%	0.762	S	S	*	*			trans	-127.5	168.8	176	58.2	0	0	0	0	111.2
38	P	47.4	Very low	32.1	Very low	119 Å²	119	132.2 Å²	132.2	77%	0.773	76%	0.764	S	S	*	*				-153.9	-158.2	103.3	44.2	-24.6	0	0	0	112.3
39	K	29.2	Very low	31.9	Very low	184 Å²	184	135 Å²	135	80%	0.8	77%	0.769	S	S	*	*			cis	-148.3	-125.7	-2.7	-148.6	160.9	-172.9	174.5	0	113.6
40	H	35	Very low	31.6	Very low	177 Å²	177	131.6 Å²	131.6	82%	0.819	77%	0.765	S	S	*	*			trans	-148	171.9	-167.8	-75.2	-80	0	0	0	110.4
41	Q	28.3	Very low	31.4	Very low	183 Å²	183	132 Å²	132	86%	0.855	77%	0.769	S	S	*	*				-162.1	-172.3	50.2	-148.5	169	47.1	0	0	113
42	T	34.3	Very low	31.1	Very low	134 Å²	134	134.4 Å²	134.4	82%	0.822	77%	0.771	S	S	*	*			trans	-146.4	-179.2	-165.3	57	0	0	0	0	112
43	A	33.4	Very low	31.1	Very low	82 Å²	82	137.7 Å²	137.7	68%	0.678	77%	0.773	S	S	*	*			cis	-166.6	-169.2	20.6	0	0	0	0	0	113.8
44	V	33.2	Very low	31.1	Very low	126 Å²	126	141.9 Å²	141.9	76%	0.764	78%	0.775	S	S	*	*			trans	73.9	118.9	158.8	-136.5	0	0	0	0	121.4
45	H	30.4	Very low	30.9	Very low	150 Å²	150	142.9 Å²	142.9	69%	0.694	78%	0.781	S	S	*	*				166.4	136.9	103.6	-129.4	-93.6	0	0	0	116.8
46	Q	28.3	Very low	31.1	Very low	172 Å²	172	143.9 Å²	143.9	80%	0.804	79%	0.786	S	S	*	*			trans	59.2	-170.1	153	-95.8	166.5	-10.7	0	0	123.4
47	S	27.9	Very low	31.3	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	77%	0.769	S	S	*	*			trans	-160.5	152.8	-135.2	57.2	0	0	0	0	116.7
48	S	30.1	Very low	31.5	Very low	109 Å²	109	140.7 Å²	140.7	76%	0.762	77%	0.766	S	S	*	*				156.4	149.9	123.9	58.9	0	0	0	0	117.6
49	L	29.1	Very low	30.9	Very low	164 Å²	164	140.4 Å²	140.4	86%	0.859	76%	0.757	S	S	*	*			trans	55.1	110.8	145.5	-70.5	167	0	0	0	125.2
50	A	26.6	Very low	31.2	Very low	94 Å²	94	137.4 Å²	137.4	78%	0.777	75%	0.749	S	S	*	*				96.5	148.2	110.2	0	0	0	0	0	125
51	A	28	Very low	31.2	Very low	93 Å²	93	134.8 Å²	134.8	77%	0.769	74%	0.741	S	S	*	*			trans	92.1	76.2	144.4	0	0	0	0	0	124
52	M	28.3	Very low	31.3	Very low	146 Å²	146	131.1 Å²	131.1	72%	0.719	74%	0.735	S	S	*	*				33.3	131.4	126.4	-74	-163.7	-67.7	0	0	125.1
53	R	31.3	Very low	31.3	Very low	212 Å²	212	132.7 Å²	132.7	80%	0.8	73%	0.733	S	S	*	*			trans	64.1	132.1	131	-62.9	176.2	-174.8	159.3	4.2	119.7
54	R	28.8	Very low	31.2	Very low	212 Å²	212	133.9 Å²	133.9	80%	0.8	73%	0.732	S	S	*	*			cis	89.6	150.9	47.9	-72.2	-124.8	-62.9	-121.7	1.1	115.8
55	V	29.5	Very low	31.1	Very low	130 Å²	130	130.7 Å²	130.7	79%	0.788	71%	0.71	S	S	*	*			trans	-131.6	151.4	-142.7	157	0	0	0	0	115.8
56	N	32.3	Very low	31.2	Very low	166 Å²	166	126.4 Å²	126.4	89%	0.888	69%	0.692	S	S	*	*			trans	53.5	154.5	158	-84.2	-30.4	0	0	0	125.3
57	G	32	Very low	31.5	Very low	48 Å²	48	120.1 Å²	120.1	50%	0.495	66%	0.662	S	S	.	*			trans	147.7	77.8	135.1	0	0	0	0	0	122.8	K392	G57-K392 WeakPolarHBondContact O-CE 3.44Å; G57-K392 PolarHBondContact O-NZ 3.19Å
58	H	38	Very low	31.9	Very low	153 Å²	153	121.6 Å²	121.6	71%	0.708	66%	0.662	S	S	*	*			trans	22.2	148.1	143.4	-95.1	-58	0	0	0	127.3	K392	H58-K392 WeakPolarHBondContact O-CE 3.14Å; H58-K392 PolarHBondContact O-NZ 3.39Å
59	N	34	Very low	32.1	Very low	112 Å²	112	120 Å²	120	60%	0.599	66%	0.663	S	S	*	*				83.2	113.1	129.5	-73.6	-7.9	0	0	0	128.7
60	L	36.6	Very low	32.2	Very low	121 Å²	121	121.4 Å²	121.4	63%	0.634	67%	0.665	S	S	*	*				73.9	134.4	110.1	-67.6	173.7	0	0	0	127
61	L	34.5	Very low	32.5	Very low	122 Å²	122	124.1 Å²	124.1	64%	0.639	66%	0.662	S	S	*	*				106.8	140.4	124.2	-95.7	167.1	0	0	0	124.5
62	S	30.1	Very low	32.8	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	66%	0.657	S	S	*	*			trans	71.8	156.4	146.5	52	0	0	0	0	121.8
63	H	34.5	Very low	33.4	Very low	168 Å²	168	120.7 Å²	120.7	78%	0.778	64%	0.64	S	S	*	*			cis	175.8	173.2	-33.4	-131.1	-3.3	0	0	0	108.1
64	V	32.1	Very low	33.4	Very low	107 Å²	107	112.6 Å²	112.6	65%	0.648	62%	0.619	S	S	*	*			cis	-122.3	-126.1	-7.8	-152.3	0	0	0	0	108.3
65	N	31.6	Very low	33.5	Very low	58 Å²	58	108.5 Å²	108.5	31%	0.31	61%	0.613	S	S	.	*			cis	-161.8	162.7	-8.9	-138.6	27.5	0	0	0	110.7	R788	N65-R788 WeakPolarHBondContact O-CD 3.11Å; N65-R788 PolarHBondContact O-NH1 3.49Å
66	M	30.8	Very low	33.5	Very low	61 Å²	61	104.8 Å²	104.8	30%	0.3	60%	0.596	S	S	.	*			trans	62.4	169.9	152.4	-77	156.1	160.9	0	0	119.7	R781 E785 R788	M66-R781 HydrophobicContact CE-CB 3.91Å; M66-R781 VanDerWaalsContact CE-O 3.32Å; M66-R781 WeakPolarHBondContact CE-O 3.36Å; M66-E785 HydrophobicContact CE-CB 3.87Å; M66-E785 HydrophobicContact CE-CG 4.03Å; M66-E785 VanDerWaalsContact CE-OE1 3.3Å; M66-E785 WeakPolarHBondContact CE-OE1 3.47Å; M66-E785 WeakPolarHBondContact CE-OE2 3.17Å; M66-E785 HydrophobicContact CG-CG 4.29Å; M66-E785 VanDerWaalsContact CG-OE1 3.29Å; M66-E785 WeakPolarHBondContact CG-OE1 3.37Å; M66-E785 VanDerWaalsContact SD-CA 3.53Å; M66-E785 HydrophobicContact SD-CB 3.45Å; M66-E785 WeakPolarHBondContact SD-CB 3.32Å; M66-E785 VanDerWaalsContact SD-CD 3.51Å; M66-E785 HydrophobicContact SD-CG 3.63Å; M66-R788 PolarHBondContact O-NH1 3.38Å
67	E	34.4	Very low	33.3	Very low	40 Å²	40	103 Å²	103	19%	0.187	59%	0.591	C	S	.	*			cis	-168.9	167.1	45.2	-128.4	120.8	-88	0	0	112	E785 R788 L789	E67-E785 HydrophobicContact CG-CG 4.14Å; E67-R788 VanDerWaalsContact CD-CZ 3.47Å; E67-R788 VanDerWaalsContact OE1-CB 3.3Å; E67-R788 WeakPolarHBondContact OE1-CB 3.34Å; E67-R788 WeakPolarHBondContact OE1-CD 3.22Å; E67-R788 IonicContact OE1-CZ 2.64Å; E67-R788 IonicContact OE1-NE 3.2Å; E67-R788 PolarHBondContact OE1-NE 3.45Å; E67-R788 IonicContact OE1-NH2 2.76Å; E67-R788 IonicContact OE2-CZ 3.67Å; E67-R788 IonicContact OE2-NE 2.77Å; E67-R788 PolarHBondContact OE2-NE 3.49Å; E67-R788 IonicContact OE2-NH2 3.02Å; E67-R788 PolarHBondContact OE2-NH2 3.08Å; E67-L789 PolarHBondContact OE2-N 3.22Å
68	D	37.9	Very low	33.3	Very low	132 Å²	132	106.7 Å²	106.7	71%	0.706	60%	0.604	S	S	*	*			trans	62.8	163	160.8	-44.6	-42.5	0	0	0	120.6
69	G	32.8	Very low	32.9	Very low	75 Å²	75	107.2 Å²	107.2	77%	0.773	61%	0.61	S	S	*	*			cis	162.1	124	-16.6	0	0	0	0	0	116.1
70	E	31.6	Very low	33.6	Very low	194 Å²	194	106.8 Å²	106.8	91%	0.907	61%	0.614	S	S	*	*			trans	48.1	159.2	176.6	-76.7	-179.9	166.8	0	0	119.3
71	E	32.4	Very low	33.1	Very low	151 Å²	151	110 Å²	110	71%	0.706	62%	0.622	S	S	*	*			cis	-153.7	126.1	-40.3	-166.1	-162.4	147.8	0	0	112.2
72	T	36	Very low	32.9	Very low	108 Å²	108	113.5 Å²	113.5	66%	0.663	63%	0.627	S	S	*	*			trans	43.1	-163.9	153.5	74.1	0	0	0	0	120.9
73	P	39.9	Very low	32.9	Very low	58 Å²	58	113 Å²	113	38%	0.377	62%	0.624	S	S	.	*			cis	-111.2	-122.6	-31.5	38.7	-34.5	0	0	0	117.5	L257	P73-L257 VanDerWaalsContact CD-O 3.25Å; P73-L257 WeakPolarHBondContact CD-O 3.4Å; P73-L257 VanDerWaalsContact CG-C 3.5Å; P73-L257 HydrophobicContact CG-CB 3.75Å; P73-L257 WeakPolarHBondContact CG-O 3.46Å
74	A	31.1	Very low	32.5	Very low	43 Å²	43	111.1 Å²	111.1	36%	0.355	62%	0.62	S	S	.	*			trans	-133.9	175.3	-147.4	0	0	0	0	0	118.4	L257	A74-L257 WeakPolarHBondContact O-CD2 3.32Å
75	D	31.8	Very low	32.4	Very low	125 Å²	125	109.7 Å²	109.7	67%	0.668	63%	0.626	S	S	*	*			trans	-88.2	167.9	-167.6	-174.7	30.4	0	0	0	115	K256	D75-K256 IonicContact OD1-NZ 2.69Å; D75-K256 PolarHBondContact OD1-NZ 2.96Å
76	A	28.8	Very low	33.2	Very low	53 Å²	53	113.1 Å²	113.1	44%	0.438	65%	0.652	S	S	.	*			trans	-153.6	143.1	172.5	0	0	0	0	0	113.3	K256	A76-K256 VanDerWaalsContact O-CE 3.22Å; A76-K256 WeakPolarHBondContact O-CE 3.5Å; A76-K256 PolarHBondContact O-NZ 2.95Å
77	T	28.9	Very low	33.1	Very low	128 Å²	128	114.9 Å²	114.9	79%	0.785	68%	0.676	S	S	*	*			trans	-150	103.9	162.2	-66.7	0	0	0	0	113.1
78	V	31.1	Very low	32.8	Very low	126 Å²	126	117.5 Å²	117.5	76%	0.764	70%	0.704	S	S	*	*			trans	-5.3	137.4	152.4	-179.8	0	0	0	0	119.6
79	I	30.6	Very low	32.3	Very low	164 Å²	164	116.5 Å²	116.5	84%	0.841	71%	0.708	S	S	*	*			trans	-94.9	137.8	161.5	-60.6	171.7	0	0	0	110.3
80	P	47.5	Very low	32.1	Very low	103 Å²	103	117.2 Å²	117.2	67%	0.669	71%	0.706	S	S	*	*			trans	-111.5	140.2	-177.6	37.6	-31.2	0	0	0	116.1
81	K	27.3	Very low	31.9	Very low	187 Å²	187	114.9 Å²	114.9	81%	0.813	71%	0.705	S	S	*	*			trans	162.7	124.6	135.7	-92.3	174.6	180	178.4	0	111.6
82	R	30	Very low	31.6	Very low	196 Å²	196	112.2 Å²	112.2	74%	0.74	71%	0.71	S	S	*	*				72.7	147.6	80.6	-82	-169.2	-177.4	-94.2	6.2	114	D84	R82-D84 IonicContact NH1-OD2 2.97Å; R82-D84 PolarHBondContact NH1-OD2 2.75Å
83	S	29.2	Very low	31.1	Very low	96 Å²	96	114.8 Å²	114.8	67%	0.671	72%	0.718	S	S	*	*			cis	-172.6	159.6	4	36.1	0	0	0	0	111.3
84	D	27.2	Very low	31	Very low	129 Å²	129	117.8 Å²	117.8	69%	0.69	74%	0.737	S	S	*	*			cis	-167.3	123.9	-19.3	-79.2	-33.5	0	0	0	105.4	R82	R82-D84 IonicContact NH1-OD2 2.97Å; R82-D84 PolarHBondContact NH1-OD2 2.75Å
85	G	28.9	Very low	30.8	Very low	77 Å²	77	125.9 Å²	125.9	79%	0.794	76%	0.758	S	S	*	*			trans	-179.2	154.5	179.4	0	0	0	0	0	117.7
86	P	49.1	Very low	31	Very low	130 Å²	130	125.4 Å²	125.4	84%	0.844	76%	0.762	S	S	*	*			trans	-137.9	165.8	-139	41.5	-24	0	0	0	120.9
87	A	27.5	Very low	30.8	Very low	97 Å²	97	127.7 Å²	127.7	80%	0.802	77%	0.774	S	S	*	*			trans	104.5	128.2	142	0	0	0	0	0	122.5
88	A	29.1	Very low	30.7	Very low	95 Å²	95	126.2 Å²	126.2	79%	0.785	77%	0.769	S	S	*	*			trans	88.4	122.3	147.2	0	0	0	0	0	123.2
89	S	27.7	Very low	30.3	Very low	111 Å²	111	126.3 Å²	126.3	78%	0.776	77%	0.766	S	S	*	*			trans	59	103.2	144.4	62.6	0	0	0	0	123.6
90	A	28	Very low	30.3	Very low	90 Å²	90	123 Å²	123	74%	0.744	76%	0.757	S	S	*	*				69.4	143.2	114.4	0	0	0	0	0	124.3
91	T	27.3	Very low	29.7	Very low	145 Å²	145	121.6 Å²	121.6	89%	0.89	75%	0.747	S	S	*	*			trans	83	154.2	152.7	-1.2	0	0	0	0	120.8
92	A	25.6	Very low	30.5	Very low	96 Å²	96	116.4 Å²	116.4	79%	0.793	73%	0.732	S	S	*	*			trans	105.6	93.4	152.3	0	0	0	0	0	121
93	I	26.4	Very low	30.2	Very low	162 Å²	162	112.3 Å²	112.3	83%	0.831	73%	0.725	S	S	*	*			trans	-50.5	156.3	135.2	-83.3	166	0	0	0	110.6
94	P	37.9	Very low	30.5	Very low	120 Å²	120	110 Å²	110	78%	0.779	71%	0.711	S	S	*	*			cis	-142.1	-172.1	33.6	31.4	-5.9	0	0	0	118.7
95	R	26.3	Very low	30.9	Very low	214 Å²	214	111 Å²	111	81%	0.808	72%	0.717	S	S	*	*			trans	-68.2	178	157.9	-46.5	178.1	-174.2	170.9	1.5	111.4
96	P	35.7	Very low	31	Very low	115 Å²	115	110.4 Å²	110.4	75%	0.747	71%	0.71	S	S	*	*				-157.4	167.9	79	42	-21.3	0	0	0	119.6
97	S	25.7	Very low	30.2	Very low	100 Å²	100	114.2 Å²	114.2	70%	0.699	71%	0.714	S	S	*	*			trans	67.6	129.7	136	65.9	0	0	0	0	126.3
98	S	26.7	Very low	30.7	Very low	97 Å²	97	118 Å²	118	68%	0.678	71%	0.709	S	S	*	*				93.9	128.1	120.2	68.2	0	0	0	0	125.2
99	D	23.3	Very low	30.9	Very low	129 Å²	129	121.4 Å²	121.4	69%	0.69	71%	0.713	S	S	*	*			trans	72.7	107.9	137.3	-71.9	25.2	0	0	0	121.6	E220	D99-E220 WeakPolarHBondContact CA-OE1 3.46Å; D99-E220 PolarHBondContact N-OE1 3.04Å; D99-E220 VanDerWaalsContact N-OE1 3.1Å
100	S	29	Very low	31.3	Very low	95 Å²	95	119.9 Å²	119.9	66%	0.664	69%	0.693	S	S	*	*				148.6	162.2	99.3	59.9	0	0	0	0	117.9	E220	S100-E220 WeakPolarHBondContact CA-OE2 3.44Å; S100-E220 PolarHBondContact N-OE1 2.62Å; S100-E220 PolarHBondContact N-OE2 2.89Å
101	T	35.6	Very low	32.3	Very low	72 Å²	72	120.2 Å²	120.2	44%	0.442	69%	0.688	S	S	.	*			trans	-104	-179.8	-179.5	67.1	0	0	0	0	111.8	P219 E220	T101-P219 HydrophobicContact CG2-CG 3.95Å; T101-P219 WeakPolarHBondContact CG2-O 3.38Å; T101-E220 HydrophobicContact CG2-CB 4.03Å
102	P	43.7	Very low	32.6	Very low	78 Å²	78	119.4 Å²	119.4	51%	0.506	68%	0.678	S	S	.	*			cis	-140.5	-138.7	-1.1	33.4	-5.6	0	0	0	114.1
103	D	23.7	Very low	32.8	Very low	110 Å²	110	122.7 Å²	122.7	59%	0.588	68%	0.679	S	S	*	*			trans	82.7	153.1	157.5	-71.9	22.6	0	0	0	124.5	V216 H217	D103-V216 HydrophobicContact CB-CG1 4.06Å; D103-V216 WeakPolarHBondContact OD1-CG1 3.33Å; D103-H217 VanDerWaalsContact C-CD2 3.44Å; D103-H217 VanDerWaalsContact N-CB 3.35Å; D103-H217 PolarHBondContact O-CD2 2.95Å
104	A	36.9	Very low	33.6	Very low	47 Å²	47	120.6 Å²	120.6	39%	0.388	68%	0.675	S	S	.	*			trans	-146.9	-177.6	-140.7	0	0	0	0	0	120.2	V216 H217	A104-V216 HydrophobicContact CB-CB 4.27Å; A104-V216 HydrophobicContact CB-CG1 3.74Å; A104-V216 HydrophobicContact CB-CG2 4.01Å; A104-H217 HydrophobicContact CB-CB 4.22Å; A104-H217 WeakPolarHBondContact CB-CE1 3.48Å; A104-H217 VanDerWaalsContact CB-ND1 3.31Å; A104-H217 WeakPolarHBondContact CB-ND1 3.27Å
105	D	35.6	Very low	33.3	Very low	152 Å²	152	119.2 Å²	119.2	81%	0.813	68%	0.675	S	S	*	*			trans	102.7	148.2	141.2	-137.8	-17.6	0	0	0	119.6
106	G	30.6	Very low	33.7	Very low	63 Å²	63	115.3 Å²	115.3	65%	0.649	67%	0.674	S	S	*	*			trans	158.7	71.1	176	0	0	0	0	0	123.4
107	F	31	Very low	33.5	Very low	210 Å²	210	116.1 Å²	116.1	92%	0.921	67%	0.671	S	S	*	*			trans	67.6	178.4	142.4	-89.9	-95.6	0	0	0	123.5
108	Y	39.2	Very low	34.1	Very low	177 Å²	177	120.3 Å²	120.3	69%	0.694	68%	0.677	S	S	*	*			trans	-158.9	149.5	-139.3	-157.8	-85.1	0	0	0	113.4
109	L	32.9	Very low	34.4	Very low	166 Å²	166	122.4 Å²	122.4	87%	0.869	69%	0.686	S	S	*	*			trans	-178.2	143.5	150.9	-105.5	156.9	0	0	0	115.4
110	E	37.3	Very low	34.9	Very low	79 Å²	79	120.6 Å²	120.6	37%	0.369	69%	0.689	S	S	.	*			trans	-136.5	142.6	175.7	149.4	178.9	-147.6	0	0	109.7	N194 C195	E110-N194 PolarHBondContact O-ND2 3.08Å; E110-C195 PolarHBondContact OE2-SG 2.89Å
111	P	47.8	Very low	35	Very low	98 Å²	98	125.5 Å²	125.5	64%	0.636	70%	0.698	S	S	*	*				-152.6	129.1	124.1	31.4	-10	0	0	0	119.2
112	L	32.8	Very low	35.1	Very low	127 Å²	127	128 Å²	128	67%	0.665	71%	0.705	S	S	*	*				81.4	144.5	128.6	-65	169.8	0	0	0	124.5	V193	L112-V193 HydrophobicContact CD1-CG1 4.2Å
113	M	30.3	Very low	34.8	Very low	166 Å²	166	132 Å²	132	82%	0.818	72%	0.715	S	S	*	*			trans	-126.1	146	177	-99.2	-80.3	-68.5	0	0	111.3
114	P	43	Very low	35.2	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	72%	0.719	S	S	*	*				-144.3	-165.9	118.8	40.7	-24.9	0	0	0	111.3
115	A	32.3	Very low	35	Very low	92 Å²	92	135.5 Å²	135.5	76%	0.76	74%	0.739	S	S	*	*			cis	-152	-167.3	8.9	0	0	0	0	0	111.6
116	V	34.4	Very low	34.7	Very low	131 Å²	131	133.4 Å²	133.4	79%	0.794	74%	0.735	S	S	*	*			trans	-145.7	147.6	-174.8	-168.3	0	0	0	0	112.7
117	L	32.6	Very low	35	Very low	132 Å²	132	137.6 Å²	137.6	69%	0.691	74%	0.742	S	S	*	*			trans	144.1	114	132.1	-74.8	168.7	0	0	0	118.7
118	K	37.8	Very low	34.9	Very low	188 Å²	188	134.1 Å²	134.1	82%	0.817	73%	0.733	S	S	*	*			trans	61.2	176.9	139.2	-56.6	176.5	-178.8	164.8	0	117.2
119	T	32.7	Very low	35	Very low	141 Å²	141	133.7 Å²	133.7	87%	0.865	73%	0.734	S	S	*	*			cis	-135.3	-168.4	8.3	56	0	0	0	0	112
120	A	33	Very low	35.3	Very low	92 Å²	92	133 Å²	133	76%	0.76	73%	0.727	S	S	*	*			trans	-130.6	159	-170.5	0	0	0	0	0	114.6
121	K	31	Very low	35	Very low	197 Å²	197	138 Å²	138	86%	0.857	75%	0.75	S	S	*	*			trans	164.4	172.3	155.6	-96.5	174.6	171.5	178.7	0	110.3
122	E	38.3	Very low	35.2	Very low	126 Å²	126	140.8 Å²	140.8	59%	0.589	76%	0.755	S	S	*	*			cis	177.7	152.5	-40.7	-162.3	-156.9	156.3	0	0	108.9
123	K	38.2	Very low	35.6	Very low	161 Å²	161	139.9 Å²	139.9	70%	0.7	76%	0.759	S	S	*	*			trans	70.8	163.5	167.5	-45.1	-174.7	-149	-71.8	0	116
124	S	31.6	Very low	35.8	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	76%	0.756	S	S	*	*			cis	-174.5	139.3	-28.8	56.2	0	0	0	0	115
125	V	32.3	Very low	35.4	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	77%	0.767	S	S	*	*				74.2	145.3	128.7	169.1	0	0	0	0	123.4
126	C	30.2	Very low	35.2	Very low	109 Å²	109	138.8 Å²	138.8	74%	0.736	77%	0.765	S	S	*	*			trans	75.9	164.7	163.1	-80.5	0	0	0	0	120.3
127	L	36.8	Very low	36.3	Very low	150 Å²	150	138.5 Å²	138.5	79%	0.785	77%	0.766	S	S	*	*			cis	177.5	138.8	-49.8	-113.9	177.5	0	0	0	111.1
128	N	29.1	Very low	36.1	Very low	137 Å²	137	144.1 Å²	144.1	73%	0.733	78%	0.778	S	S	*	*			trans	173.8	152.1	148.6	-91.1	-18	0	0	0	110.2
129	K	40.3	Very low	35.7	Very low	168 Å²	168	140.2 Å²	140.2	73%	0.73	77%	0.774	S	S	*	*			cis	80.9	143.9	42.9	-92.1	-171.2	163.6	-149.3	0	114
130	E	38.7	Very low	35.5	Very low	151 Å²	151	138.6 Å²	138.6	71%	0.706	78%	0.775	S	S	*	*			cis	-164.4	164.6	3.9	57.4	-147.8	121.4	0	0	113.9
131	E	31.5	Very low	35.2	Very low	184 Å²	184	137.5 Å²	137.5	86%	0.86	77%	0.773	S	S	*	*			trans	178.2	154.7	152.7	-107.7	-174.6	113.7	0	0	108.9
132	E	51.5	Low	35.1	Very low	157 Å²	157	140.7 Å²	140.7	73%	0.734	78%	0.779	S	S	*	*			cis	-146.8	-171.6	-3.4	-145.3	-118.2	109.1	0	0	111.5
133	S	42.8	Very low	34.7	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	78%	0.784	S	S	*	*			trans	-89.8	177.2	-149.1	-44.7	0	0	0	0	119
134	G	33.1	Very low	34.3	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	79%	0.789	S	S	*	*			trans	-176	32.5	177	0	0	0	0	0	121.1
135	E	34.7	Very low	34.4	Very low	209 Å²	209	136.8 Å²	136.8	98%	0.977	79%	0.786	S	S	*	*			trans	53.8	170	163.4	-64.4	-157.4	109.7	0	0	122.6
136	G	29.3	Very low	34.5	Very low	70 Å²	70	139 Å²	139	72%	0.722	78%	0.781	S	S	*	*			trans	-147	-124.5	-170.4	0	0	0	0	0	115.6
137	P	56.3	Low	34.7	Very low	125 Å²	125	142.7 Å²	142.7	81%	0.812	78%	0.779	S	S	*	*				-135	147.6	-79.9	38.2	-27.4	0	0	0	116.1
138	R	28.9	Very low	34.2	Very low	250 Å²	250	138.6 Å²	138.6	94%	0.943	77%	0.773	S	S	*	*			trans	-160.6	162.4	160.6	-64	-165.7	-171.1	-133.1	-4.6	110.6
139	S	29.3	Very low	34.3	Very low	105 Å²	105	138.7 Å²	138.7	73%	0.734	77%	0.773	S	S	*	*			cis	-174.6	133.8	-47.6	55	0	0	0	0	109.9
140	A	29	Very low	33.8	Very low	108 Å²	108	132.4 Å²	132.4	89%	0.893	76%	0.757	S	S	*	*			trans	63.5	126.6	159.8	0	0	0	0	0	122.8
141	G	26.6	Very low	33.7	Very low	69 Å²	69	128.9 Å²	128.9	71%	0.711	75%	0.749	S	S	*	*				117.9	113.4	109.7	0	0	0	0	0	121.5
142	R	29.5	Very low	33.7	Very low	263 Å²	263	124.6 Å²	124.6	99%	0.992	74%	0.739	S	S	*	*			trans	65.4	156.2	160	-55.7	176	-178.5	-104.6	0.9	116.3
143	G	28.6	Very low	32.6	Very low	67 Å²	67	121 Å²	121	69%	0.691	74%	0.736	S	S	*	*			cis	156.1	169.7	-8.8	0	0	0	0	0	112.6
144	S	30.2	Very low	32	Very low	115 Å²	115	120.4 Å²	120.4	80%	0.804	74%	0.738	S	S	*	*			trans	72.7	147.4	167.3	-79.2	0	0	0	0	119.7
145	L	32.7	Very low	31.8	Very low	122 Å²	122	123 Å²	123	64%	0.639	74%	0.738	S	S	*	*			cis	-171.2	155.6	-21.9	-147.4	66	0	0	0	113.4
146	R	35.4	Very low	31.6	Very low	178 Å²	178	123.9 Å²	123.9	67%	0.672	73%	0.733	S	S	*	*			trans	69.9	154	158.3	-52.9	-159.3	-174.3	-71.3	-0.4	118.7
147	R	33.9	Very low	31.7	Very low	186 Å²	186	132 Å²	132	70%	0.702	74%	0.741	S	S	*	*			cis	-155.7	157.7	-20.9	-115.6	-160.7	-84.9	-129.8	3.3	107.1	D149	R147-D149 WeakPolarHBondContact CD-OD2 3.3Å; R147-D149 VanDerWaalsContact CG-OD2 3.32Å; R147-D149 WeakPolarHBondContact CG-OD2 3.37Å
148	G	27.2	Very low	30.3	Very low	64 Å²	64	135.4 Å²	135.4	66%	0.66	74%	0.744	S	S	*	*			cis	166.3	-162.7	6.7	0	0	0	0	0	108.4
149	D	31.4	Very low	30.1	Very low	139 Å²	139	127.9 Å²	127.9	74%	0.743	74%	0.735	S	S	*	*			cis	-170.8	131.5	-34.8	-73.1	-32.4	0	0	0	105.2	R147	R147-D149 WeakPolarHBondContact CD-OD2 3.3Å; R147-D149 VanDerWaalsContact CG-OD2 3.32Å; R147-D149 WeakPolarHBondContact CG-OD2 3.37Å
150	G	29.4	Very low	30.8	Very low	37 Å²	37	128.3 Å²	128.3	38%	0.381	74%	0.735	S	S	.	*			cis	-131.8	-65.8	-12.1	0	0	0	0	0	111.8	R635	G150-R635 VanDerWaalsContact O-CD 3.27Å; G150-R635 WeakPolarHBondContact O-CD 3.26Å; G150-R635 PolarHBondContact O-NH1 3.46Å; G150-R635 VanDerWaalsContact O-NH1 3.08Å
151	S	36.9	Very low	30.8	Very low	77 Å²	77	127.9 Å²	127.9	54%	0.538	73%	0.726	S	S	.	*				179.2	148.1	-52.2	-95.6	0	0	0	0	110	V634	S151-V634 WeakPolarHBondContact O-CG1 3.45Å
152	S	30.7	Very low	30.8	Very low	94 Å²	94	131.8 Å²	131.8	66%	0.657	73%	0.73	S	S	*	*			cis	-158.6	174.3	-5.3	-83.3	0	0	0	0	110.1
153	A	28.3	Very low	30.9	Very low	80 Å²	80	125.6 Å²	125.6	66%	0.661	72%	0.716	S	S	*	*			trans	-130.4	-180	-172.6	0	0	0	0	0	115.8
154	A	31.4	Very low	30.8	Very low	96 Å²	96	128.3 Å²	128.3	79%	0.793	72%	0.715	S	S	*	*			trans	81.1	148.2	160	0	0	0	0	0	120.6
155	V	28.8	Very low	30.7	Very low	128 Å²	128	130.5 Å²	130.5	78%	0.776	71%	0.712	S	S	*	*				-179.5	125.8	125.5	145.5	0	0	0	0	113
156	R	29.1	Very low	30.5	Very low	229 Å²	229	130.2 Å²	130.2	86%	0.864	72%	0.716	S	S	*	*			trans	61.5	161.6	161.5	-73.4	172.6	-179.1	-137.6	-3.7	117.7
157	R	31.7	Very low	30.5	Very low	239 Å²	239	130.6 Å²	130.6	90%	0.902	72%	0.723	S	S	*	*			cis	-140.8	-171.7	7.9	-138.2	-174.8	-50.9	174.6	8.3	110.8
158	K	27.5	Very low	30.9	Very low	198 Å²	198	127.4 Å²	127.4	86%	0.861	73%	0.726	S	S	*	*			trans	-140.6	118.4	-167.8	178.4	-177.4	179	-177.9	0	114.1
159	A	24.6	Very low	31	Very low	92 Å²	92	128.6 Å²	128.6	76%	0.76	73%	0.73	S	S	*	*			trans	55.6	177.8	156.5	0	0	0	0	0	118.8
160	P	43.9	Very low	31.5	Very low	113 Å²	113	128 Å²	128	73%	0.734	73%	0.734	S	S	*	*			cis	-128	-166.6	-24.5	38.9	-20.9	0	0	0	113.4
161	S	28	Very low	31.2	Very low	100 Å²	100	129.8 Å²	129.8	70%	0.699	75%	0.752	S	S	*	*			trans	67.9	133.8	150.4	-56.7	0	0	0	0	122.6
162	D	28.5	Very low	30.7	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	77%	0.766	S	S	*	*				165.6	172	118.3	-85.3	-12	0	0	0	110.1
163	L	29.8	Very low	30.4	Very low	133 Å²	133	139.3 Å²	139.3	70%	0.696	78%	0.777	S	S	*	*			cis	-177.9	144.5	-48.9	-169.8	72.8	0	0	0	105.8
164	N	27.7	Very low	30.3	Very low	123 Å²	123	143.7 Å²	143.7	66%	0.658	78%	0.784	S	S	*	*			trans	65	165.4	170.5	-65.6	-25	0	0	0	115.8
165	Q	28.9	Very low	29.9	Very low	162 Å²	162	144.9 Å²	144.9	76%	0.757	79%	0.785	S	S	*	*			cis	-176.7	169.5	-17.4	-98.9	-178.4	-14.1	0	0	105.6
166	T	27.2	Very low	29.6	Very low	116 Å²	116	145.5 Å²	145.5	71%	0.712	78%	0.784	S	S	*	*			cis	-166.3	161.6	-14.4	-101.2	0	0	0	0	109.2
167	F	36.2	Very low	29.4	Very low	185 Å²	185	141.9 Å²	141.9	81%	0.811	79%	0.787	S	S	*	*			trans	-74.7	177.4	172.4	-61	-95.5	0	0	0	113.3
168	P	42.6	Very low	29.1	Very low	119 Å²	119	137.9 Å²	137.9	77%	0.773	78%	0.784	S	S	*	*				-131.8	160.6	88.9	10.3	13.4	0	0	0	112.7
169	A	28.4	Very low	29.1	Very low	90 Å²	90	134.8 Å²	134.8	74%	0.744	77%	0.772	S	S	*	*			cis	79.4	155.8	37	0	0	0	0	0	114.4
170	P	42	Very low	29.2	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	78%	0.779	S	S	*	*			cis	-108	-160.5	-9.1	43.2	-31.8	0	0	0	111.9
171	G	23.2	Very low	28.4	Very low	74 Å²	74	142.4 Å²	142.4	76%	0.763	77%	0.772	S	S	*	*			cis	132.7	73.3	-22.9	0	0	0	0	0	118.2
172	E	26.6	Very low	28.4	Very low	180 Å²	180	146.1 Å²	146.1	84%	0.841	78%	0.778	S	S	*	*			trans	-159.2	150.7	175.1	65.5	-161.1	120.2	0	0	110.1
173	E	25.3	Very low	28.3	Very low	191 Å²	191	142.4 Å²	142.4	89%	0.893	77%	0.769	S	S	*	*			cis	-153.2	-171.9	-16.7	-140.2	177.8	-153.6	0	0	110.6
174	E	25.4	Very low	28.1	Very low	173 Å²	173	142.9 Å²	142.9	81%	0.808	77%	0.772	S	S	*	*			trans	-86.6	143.6	-170.3	-61.9	177.3	85.7	0	0	116.7
175	C	23	Very low	28	Very low	120 Å²	120	145.3 Å²	145.3	81%	0.811	78%	0.777	S	S	*	*			trans	-175	119.6	140.3	-136.3	0	0	0	0	108.4
176	L	23.3	Very low	28.3	Very low	142 Å²	142	148.9 Å²	148.9	74%	0.743	78%	0.784	S	S	*	*				55.6	89.1	62.2	-64	-179.6	0	0	0	115.5
177	T	23.5	Very low	28.9	Very low	152 Å²	152	149 Å²	149	93%	0.933	79%	0.787	S	S	*	*				-167.3	162.5	111.4	10.4	0	0	0	0	111.8
178	D	25	Very low	28.9	Very low	156 Å²	156	146.4 Å²	146.4	83%	0.834	79%	0.785	S	S	*	*			trans	-121.5	-172.3	-171.7	-157.5	-13.3	0	0	0	110.4
179	E	28.1	Very low	28.2	Very low	133 Å²	133	148.7 Å²	148.7	62%	0.621	79%	0.789	S	S	*	*			trans	78.1	117	164.5	-61.6	-136.8	93.4	0	0	119.7	Q181	E179-Q181 WeakPolarHBondContact OE1-CG 3.41Å; E179-Q181 PolarHBondContact OE1-NE2 3.42Å; E179-Q181 PolarHBondContact OE2-NE2 2.91Å
180	R	27.5	Very low	28.2	Very low	239 Å²	239	149.6 Å²	149.6	90%	0.902	79%	0.79	S	S	*	*				-138	136.2	108.1	-149.9	170.7	-177.8	-178.1	-1.4	110.6
181	Q	27.3	Very low	27.6	Very low	125 Å²	125	149.3 Å²	149.3	58%	0.584	79%	0.791	S	S	*	*			trans	-61.8	165.9	-176	-59.6	93.8	5.8	0	0	112.4	E179	E179-Q181 WeakPolarHBondContact OE1-CG 3.41Å; E179-Q181 PolarHBondContact OE1-NE2 3.42Å; E179-Q181 PolarHBondContact OE2-NE2 2.91Å
182	Q	27.2	Very low	27.9	Very low	178 Å²	178	151.1 Å²	151.1	83%	0.832	79%	0.792	S	S	*	*			cis	-162.1	133.1	34.3	-155.6	163.6	-14.4	0	0	108.8
183	A	26.4	Very low	28.3	Very low	74 Å²	74	147.6 Å²	147.6	61%	0.612	78%	0.783	S	S	*	*				49.2	131.8	88.4	0	0	0	0	0	114.8
184	D	26.1	Very low	28.6	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	76%	0.761	S	S	*	*			cis	-159.3	-174.6	11.5	-112.1	-18.1	0	0	0	115.9
185	F	25.7	Very low	28.7	Very low	174 Å²	174	136.6 Å²	136.6	76%	0.763	74%	0.739	S	S	*	*			trans	-52.5	148	-169	-56.4	-95.5	0	0	0	122.7
186	R	35.3	Very low	29.3	Very low	237 Å²	237	135.6 Å²	135.6	89%	0.894	73%	0.733	S	S	*	*			trans	53.1	169.3	138.8	-84	-170.7	174.2	-167.1	-0.1	120.1
187	P	38.4	Very low	30.2	Very low	119 Å²	119	133.9 Å²	133.9	77%	0.773	73%	0.733	S	S	*	*			cis	-126.4	-147.1	6.5	44.6	-27.9	0	0	0	114.5
188	V	35.9	Very low	31	Very low	129 Å²	129	136.8 Å²	136.8	78%	0.782	73%	0.727	S	S	*	*			trans	-103.9	149.4	177	171.8	0	0	0	0	110.3
189	I	28.8	Very low	32	Very low	168 Å²	168	136.2 Å²	136.2	86%	0.862	72%	0.719	S	S	*	*			trans	-157.5	160.7	157	-108.5	154.8	0	0	0	111.1
190	S	28	Very low	32.9	Very low	108 Å²	108	135.6 Å²	135.6	76%	0.755	73%	0.727	S	S	*	*			trans	-110.3	154	-171.4	-53.6	0	0	0	0	114.6
191	S	29.1	Very low	33.6	Very low	120 Å²	120	129.1 Å²	129.1	84%	0.839	73%	0.725	S	S	*	*			trans	173.6	166	147	50.3	0	0	0	0	109.1
192	S	30.3	Very low	33.8	Very low	112 Å²	112	132.3 Å²	132.3	78%	0.783	74%	0.74	S	S	*	*			cis	-160.1	174.4	-38.2	-168.7	0	0	0	0	107.2
193	V	34.3	Very low	34.2	Very low	107 Å²	107	127 Å²	127	65%	0.648	73%	0.732	S	S	*	*			trans	-72.8	168.1	180	-65	0	0	0	0	112.6	L112	L112-V193 HydrophobicContact CD1-CG1 4.2Å
194	N	32.2	Very low	34.2	Very low	81 Å²	81	133.7 Å²	133.7	43%	0.433	75%	0.748	S	S	.	*			cis	-163.1	176.7	29.1	-150.9	7.4	0	0	0	115.3	E110	E110-N194 PolarHBondContact O-ND2 3.08Å
195	C	27.9	Very low	34.3	Very low	52 Å²	52	137.3 Å²	137.3	35%	0.351	75%	0.752	S	S	.	*			trans	66.3	95.1	156.8	-67.8	0	0	0	0	123.5	E110	E110-C195 PolarHBondContact OE2-SG 2.89Å
196	S	34.9	Very low	34.5	Very low	99 Å²	99	136.1 Å²	136.1	69%	0.692	75%	0.753	S	S	*	*				67.8	144.7	115.4	-142.3	0	0	0	0	126.4
197	S	42.4	Very low	34.1	Very low	105 Å²	105	133 Å²	133	73%	0.734	75%	0.748	S	S	*	*			trans	82.2	83	146.8	-164.4	0	0	0	0	124.8
198	R	40.7	Very low	33.6	Very low	213 Å²	213	132 Å²	132	80%	0.804	74%	0.744	S	S	*	*				71.6	149.8	128.9	-162	165.7	-171.1	-176.4	0.3	122.5
199	E	45.6	Very low	33.1	Very low	144 Å²	144	132.8 Å²	132.8	67%	0.673	74%	0.744	S	S	*	*			trans	-24.7	148.1	168.2	-61.1	169.2	103	0	0	117.4
200	P	46.7	Very low	33.1	Very low	121 Å²	121	129.6 Å²	129.6	79%	0.786	74%	0.736	S	S	*	*			cis	-146.7	-170.8	37.8	44	-25.1	0	0	0	118.1
201	A	41.8	Very low	33.1	Very low	103 Å²	103	131 Å²	131	85%	0.851	74%	0.736	S	S	*	*			trans	79.5	179.4	148.8	0	0	0	0	0	119.9
202	E	32.8	Very low	32.9	Very low	192 Å²	192	133.5 Å²	133.5	90%	0.897	73%	0.734	S	S	*	*			trans	-146.7	127.1	-149.4	176.3	-178	-174.1	0	0	111.7
203	G	35	Very low	33.4	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	72%	0.723	S	S	*	*			trans	114.8	153.9	152.4	0	0	0	0	0	119.5
204	F	27.3	Very low	33.1	Very low	215 Å²	215	135.8 Å²	135.8	94%	0.943	73%	0.73	S	S	*	*			trans	81.1	180	165.9	-60.2	-76	0	0	0	119.3
205	Y	28.1	Very low	32.6	Very low	220 Å²	220	136.6 Å²	136.6	86%	0.863	74%	0.74	S	S	*	*				-152.2	157.2	-128.2	-140	-93.6	0	0	0	112.2
206	L	29.8	Very low	32.4	Very low	148 Å²	148	136.8 Å²	136.8	78%	0.775	74%	0.74	S	S	*	*			trans	79.4	-177	167.3	-131.6	71.9	0	0	0	117.9
207	H	26.9	Very low	32	Very low	171 Å²	171	138.3 Å²	138.3	79%	0.792	74%	0.736	S	S	*	*			trans	-109	165	-148.7	-62	-82.4	0	0	0	116.7
208	S	28	Very low	31.1	Very low	98 Å²	98	136 Å²	136	69%	0.685	73%	0.728	S	S	*	*			trans	89	107.4	149	-81.8	0	0	0	0	121.9
209	D	24.8	Very low	31.2	Very low	147 Å²	147	130.4 Å²	130.4	79%	0.786	72%	0.719	S	S	*	*				76.4	150.7	120.7	-53.8	-46.4	0	0	0	123.6
210	S	28.1	Very low	30.2	Very low	100 Å²	100	128.6 Å²	128.6	70%	0.699	71%	0.711	S	S	*	*			trans	76.5	104.5	167.8	-83.9	0	0	0	0	122
211	D	28.4	Very low	29.6	Very low	139 Å²	139	126.7 Å²	126.7	74%	0.743	71%	0.706	S	S	*	*				69.3	119.4	118.9	-53	-46.8	0	0	0	122.6
212	E	25.9	Very low	29.1	Very low	172 Å²	172	129.4 Å²	129.4	80%	0.804	70%	0.701	S	S	*	*				36	158.9	114.1	-89	-121.6	106.3	0	0	121.9
213	P	40.9	Very low	29.1	Very low	84 Å²	84	126.5 Å²	126.5	55%	0.545	69%	0.691	S	S	.	*			cis	-139.3	-177.9	-2.9	38.2	-19.1	0	0	0	115.8
214	K	26.8	Very low	28.8	Very low	183 Å²	183	131.2 Å²	131.2	80%	0.796	70%	0.695	S	S	*	*			trans	66.3	163.7	140.2	-84.7	170.4	171.9	159.8	0	120.3
215	C	22.2	Very low	28.9	Very low	97 Å²	97	127.4 Å²	127.4	66%	0.655	69%	0.685	S	S	*	*			cis	-156.8	147.9	-20.6	-133.5	0	0	0	0	109.4
216	V	24.4	Very low	29	Very low	56 Å²	56	123.1 Å²	123.1	34%	0.339	68%	0.676	S	S	.	*				35.7	117.3	124.9	177.9	0	0	0	0	120.3	D103 A104	D103-V216 HydrophobicContact CB-CG1 4.06Å; D103-V216 WeakPolarHBondContact OD1-CG1 3.33Å; A104-V216 HydrophobicContact CB-CB 4.27Å; A104-V216 HydrophobicContact CB-CG1 3.74Å; A104-V216 HydrophobicContact CB-CG2 4.01Å
217	H	25	Very low	28.8	Very low	132 Å²	132	122.1 Å²	122.1	61%	0.611	67%	0.672	S	S	*	*			trans	33.1	151	143.6	-76.3	31.3	0	0	0	124	D103 A104	D103-H217 VanDerWaalsContact C-CD2 3.44Å; D103-H217 VanDerWaalsContact N-CB 3.35Å; D103-H217 PolarHBondContact O-CD2 2.95Å; A104-H217 HydrophobicContact CB-CB 4.22Å; A104-H217 WeakPolarHBondContact CB-CE1 3.48Å; A104-H217 VanDerWaalsContact CB-ND1 3.31Å; A104-H217 WeakPolarHBondContact CB-ND1 3.27Å
218	G	23.7	Very low	28.9	Very low	56 Å²	56	122 Å²	122	58%	0.577	67%	0.672	S	S	*	*			trans	170.1	108.2	160.6	0	0	0	0	0	113.3
219	P	42.2	Very low	28.9	Very low	95 Å²	95	125.6 Å²	125.6	62%	0.617	68%	0.677	S	S	*	*			trans	-89.2	-147.4	-178.9	36.1	-40.3	0	0	0	114.6	T101	T101-P219 HydrophobicContact CG2-CG 3.95Å; T101-P219 WeakPolarHBondContact CG2-O 3.38Å
220	E	25.2	Very low	29.1	Very low	106 Å²	106	126.4 Å²	126.4	50%	0.495	68%	0.676	S	S	.	*			trans	87.1	136.4	169	-133.7	-176.9	-169.9	0	0	120.9	D99 S100 T101	D99-E220 WeakPolarHBondContact CA-OE1 3.46Å; D99-E220 PolarHBondContact N-OE1 3.04Å; D99-E220 VanDerWaalsContact N-OE1 3.1Å; S100-E220 WeakPolarHBondContact CA-OE2 3.44Å; S100-E220 PolarHBondContact N-OE1 2.62Å; S100-E220 PolarHBondContact N-OE2 2.89Å; T101-E220 HydrophobicContact CG2-CB 4.03Å
221	A	34.2	Very low	29.1	Very low	82 Å²	82	128.9 Å²	128.9	68%	0.678	68%	0.677	S	S	*	*			trans	-85.5	-163.4	162.6	0	0	0	0	0	108.6
222	E	32.1	Very low	29.2	Very low	159 Å²	159	128.7 Å²	128.7	74%	0.743	68%	0.676	S	S	*	*			cis	-153.4	160.6	-0.2	-157.5	173.3	-156.9	0	0	106.5
223	L	32.5	Very low	29.4	Very low	132 Å²	132	125.8 Å²	125.8	69%	0.691	67%	0.665	S	S	*	*				166.9	154.2	125.6	-91.3	171.6	0	0	0	114.9
224	E	28.2	Very low	28.9	Very low	164 Å²	164	129.1 Å²	129.1	77%	0.766	68%	0.678	S	S	*	*			trans	85.7	135	147.9	-82.1	159.7	-160.3	0	0	121.7
225	D	29.2	Very low	29.2	Very low	134 Å²	134	129.1 Å²	129.1	72%	0.717	68%	0.682	S	S	*	*			trans	46.3	100.5	178.4	-57.8	-5.6	0	0	0	118.5
226	L	30.2	Very low	29.6	Very low	131 Å²	131	128.1 Å²	128.1	69%	0.686	68%	0.68	S	S	*	*				75.8	120.2	62.8	-65.5	174.1	0	0	0	112.9
227	D	25.2	Very low	29.7	Very low	127 Å²	127	132.6 Å²	132.6	68%	0.679	70%	0.701	S	S	*	*				33.6	139.9	96.6	-39.1	-15	0	0	0	116
228	E	29.6	Very low	29.8	Very low	169 Å²	169	132.1 Å²	132.1	79%	0.79	71%	0.708	S	S	*	*			cis	-168.9	-147.5	-3.1	-118.5	-176.7	160.5	0	0	105.9
229	E	28.9	Very low	29.9	Very low	173 Å²	173	135.1 Å²	135.1	81%	0.808	72%	0.715	S	S	*	*			trans	84.1	156.2	141.9	-56.8	-149.3	119.2	0	0	122.2
230	E	28	Very low	29.3	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.762	72%	0.724	S	S	*	*			trans	54.4	105.2	176.6	-63.5	-178.2	149.2	0	0	116.8
231	E	29.2	Very low	29.4	Very low	152 Å²	152	139.9 Å²	139.9	71%	0.71	73%	0.73	S	S	*	*				66.3	148.6	56	-49.9	-176.9	162.9	0	0	110.2
232	D	29.9	Very low	28.9	Very low	135 Å²	135	140.2 Å²	140.2	72%	0.722	73%	0.727	S	S	*	*			cis	-120.8	149.6	37.3	-81.9	-47.2	0	0	0	113
233	L	30.9	Very low	28.5	Very low	111 Å²	111	143 Å²	143	58%	0.581	73%	0.731	S	S	*	*				59.7	107.1	64.1	-53.4	-177.9	0	0	0	111.1
234	D	29	Very low	28.4	Very low	154 Å²	154	146.4 Å²	146.4	82%	0.824	74%	0.74	S	S	*	*				65.4	137	86.4	-79	-25.4	0	0	0	114.6
235	E	33.2	Very low	28.4	Very low	184 Å²	184	141.6 Å²	141.6	86%	0.86	74%	0.735	S	S	*	*				-175.1	151.6	129.6	-175.7	160.6	-144.5	0	0	112.4
236	A	30.4	Very low	28.2	Very low	76 Å²	76	147.2 Å²	147.2	63%	0.628	75%	0.748	S	S	*	*			trans	64.7	108.5	162.9	0	0	0	0	0	118.6
237	L	26.7	Very low	28.1	Very low	150 Å²	150	144.1 Å²	144.1	79%	0.785	75%	0.747	S	S	*	*				67.1	122.6	54.4	-55.3	163.4	0	0	0	114.7
238	T	27.3	Very low	28.2	Very low	122 Å²	122	147.5 Å²	147.5	75%	0.748	76%	0.759	S	S	*	*				174.9	125.4	102	34.1	0	0	0	0	115.8
239	T	26.9	Very low	28.3	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.724	75%	0.748	S	S	*	*			trans	64	126.1	139	63.4	0	0	0	0	124.8
240	K	28.6	Very low	28.4	Very low	186 Å²	186	142.1 Å²	142.1	81%	0.809	75%	0.751	S	S	*	*			trans	72.2	146.7	132.3	-83.8	-167.6	167.6	-169.9	0	121.6
241	D	26.7	Very low	28.7	Very low	116 Å²	116	143.5 Å²	143.5	62%	0.62	76%	0.757	S	S	*	*			cis	-157.2	163.8	-2.5	-150.9	-62.4	0	0	0	112.1
242	S	24.4	Very low	28.9	Very low	88 Å²	88	145.7 Å²	145.7	62%	0.615	77%	0.767	S	S	*	*			trans	71.3	103.9	148.9	-82.7	0	0	0	0	123.3
243	R	24.3	Very low	29.2	Very low	217 Å²	217	147.1 Å²	147.1	82%	0.819	77%	0.769	S	S	*	*				145.7	116.4	87.8	-175.4	168.7	-71.7	-157.5	-2.5	117.5
244	K	29	Very low	29.6	Very low	205 Å²	205	148.1 Å²	148.1	89%	0.891	79%	0.786	S	S	*	*			trans	68.4	117.2	155.5	-78	-170.5	171.5	-167.5	0	122
245	G	28.1	Very low	30	Very low	63 Å²	63	144.3 Å²	144.3	65%	0.649	78%	0.776	S	S	*	*				140.4	90.6	103.8	0	0	0	0	0	120.8
246	Y	26.7	Very low	30.2	Very low	252 Å²	252	140.8 Å²	140.8	99%	0.988	76%	0.758	S	S	*	*			trans	62.2	139.7	165.5	-54.2	-87.8	0	0	0	117.1
247	G	27.4	Very low	30.4	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	75%	0.751	S	S	*	*			cis	166.3	112.8	-7.7	0	0	0	0	0	107.9
248	E	27	Very low	30.7	Very low	198 Å²	198	143.7 Å²	143.7	93%	0.925	76%	0.757	S	S	*	*				73	125.4	93.1	-164.1	170.4	-125.2	0	0	112.4
249	A	31.2	Very low	31.2	Very low	69 Å²	69	145.5 Å²	145.5	57%	0.57	76%	0.757	S	S	*	*			cis	149.7	146.6	-10.7	0	0	0	0	0	106.5
250	D	31.6	Very low	31.5	Very low	161 Å²	161	146.8 Å²	146.8	86%	0.861	76%	0.759	S	S	*	*			cis	-132.4	-83	-23.1	-86.4	-44.2	0	0	0	114.8
251	E	34.2	Very low	31.8	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	76%	0.759	S	S	*	*			cis	-141.3	-132.5	3	-58.9	179	99.7	0	0	111
252	E	33.9	Very low	32.1	Very low	198 Å²	198	146.8 Å²	146.8	93%	0.925	77%	0.765	S	S	*	*			trans	-117.5	154.5	-171.8	-60.3	-179.3	124.1	0	0	116.6
253	E	35.1	Very low	32.3	Very low	164 Å²	164	148.1 Å²	148.1	77%	0.766	77%	0.769	S	S	*	*			trans	-169.4	123.8	130.3	-172.4	168.1	-156.8	0	0	109.9
254	S	40	Very low	32.8	Very low	133 Å²	133	146.9 Å²	146.9	93%	0.93	77%	0.77	S	S	*	*			trans	-161	63.1	172.7	-76.7	0	0	0	0	111.8
255	A	38	Very low	32.9	Very low	74 Å²	74	145.4 Å²	145.4	61%	0.612	77%	0.766	S	S	*	*			trans	-149.4	152	172.2	0	0	0	0	0	109.5
256	K	36.6	Very low	33.1	Very low	109 Å²	109	149.9 Å²	149.9	47%	0.474	77%	0.769	S	S	.	*			trans	62.3	137.8	-141.7	-43.4	165.3	177.4	176.1	0	109.1	D75 A76	D75-K256 IonicContact OD1-NZ 2.69Å; D75-K256 PolarHBondContact OD1-NZ 2.96Å; A76-K256 VanDerWaalsContact O-CE 3.22Å; A76-K256 WeakPolarHBondContact O-CE 3.5Å; A76-K256 PolarHBondContact O-NZ 2.95Å
257	L	34.2	Very low	33.3	Very low	93 Å²	93	145.1 Å²	145.1	49%	0.487	76%	0.756	S	S	.	*			cis	-129.4	106.2	31.2	-51.5	159.8	0	0	0	107.9	P73 A74	P73-L257 VanDerWaalsContact CD-O 3.25Å; P73-L257 WeakPolarHBondContact CD-O 3.4Å; P73-L257 VanDerWaalsContact CG-C 3.5Å; P73-L257 HydrophobicContact CG-CB 3.75Å; P73-L257 WeakPolarHBondContact CG-O 3.46Å; A74-L257 WeakPolarHBondContact O-CD2 3.32Å
258	Q	34.1	Very low	33.6	Very low	194 Å²	194	147.6 Å²	147.6	91%	0.907	75%	0.754	S	S	*	*			trans	-155.1	41.6	-178.9	-156.1	-172.7	-26.7	0	0	113.9
259	E	37.3	Very low	34.2	Very low	161 Å²	161	146 Å²	146	75%	0.752	74%	0.744	S	S	*	*			trans	-150.8	100.4	176.6	-169.2	167.8	-152.1	0	0	109.9
260	D	33.9	Very low	34.6	Very low	144 Å²	144	149.4 Å²	149.4	77%	0.77	75%	0.753	S	S	*	*			trans	179.2	59.8	156.2	-106.8	-17.2	0	0	0	111.1
261	M	34.6	Very low	34.8	Very low	165 Å²	165	151.7 Å²	151.7	81%	0.813	76%	0.755	S	S	*	*			trans	-144.9	66	172.5	-139.4	-110.9	74.6	0	0	112.2
262	N	32.4	Very low	34.7	Very low	138 Å²	138	150.2 Å²	150.2	74%	0.738	75%	0.754	S	S	*	*			trans	-164.6	133.7	156.8	-119	-10.7	0	0	0	113.3
263	V	29.8	Very low	34.5	Very low	116 Å²	116	144 Å²	144	70%	0.703	74%	0.743	S	S	*	*			trans	49	118.9	135.9	174.6	0	0	0	0	117.1
264	K	33	Very low	34.2	Very low	191 Å²	191	141.4 Å²	141.4	83%	0.83	75%	0.749	S	S	*	*				-165.3	170.5	58.3	-155.4	152.1	-176.4	170.9	0	114.8
265	E	32.5	Very low	33.6	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.813	75%	0.747	S	S	*	*			trans	-87.3	173.8	172.8	-57.4	161.4	148.3	0	0	113.1
266	H	31.3	Very low	33.1	Very low	157 Å²	157	140.4 Å²	140.4	73%	0.727	75%	0.747	S	S	*	*			trans	97	130.9	152.1	-123.1	-117.5	0	0	0	121.4
267	E	32.1	Very low	32.8	Very low	152 Å²	152	147 Å²	147	71%	0.71	77%	0.769	S	S	*	*			trans	69.3	106.7	143.8	-92	176.4	156.4	0	0	124.2
268	D	33.2	Very low	32.3	Very low	117 Å²	117	147.3 Å²	147.3	63%	0.626	78%	0.779	S	S	*	*				104.1	155.4	102.6	-140.3	17.2	0	0	0	122.6
269	K	38.5	Very low	32.1	Very low	163 Å²	163	143.8 Å²	143.8	71%	0.709	78%	0.776	S	S	*	*			trans	74	115.7	163.8	-71.9	172.2	-177.8	68.1	0	120.5
270	D	40.8	Very low	32.3	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	77%	0.774	S	S	*	*			trans	-46.9	159.3	155.8	-44.5	-98.4	0	0	0	114.1
271	F	36.1	Very low	31.9	Very low	209 Å²	209	139.9 Å²	139.9	92%	0.917	77%	0.774	S	S	*	*				-155.8	148.4	128.1	-106.6	-67.1	0	0	0	113.2
272	N	31.3	Very low	31.6	Very low	162 Å²	162	139.3 Å²	139.3	87%	0.866	77%	0.773	S	S	*	*			trans	-88.5	151.7	-176	-77.6	-68.2	0	0	0	114
273	G	29.7	Very low	31.4	Very low	68 Å²	68	137.6 Å²	137.6	70%	0.701	77%	0.772	S	S	*	*			trans	156.3	116.4	160.9	0	0	0	0	0	112.2
274	A	28.1	Very low	31.5	Very low	108 Å²	108	139.5 Å²	139.5	89%	0.893	78%	0.784	S	S	*	*				65.7	135.8	50	0	0	0	0	0	113
275	S	28.8	Very low	31.2	Very low	128 Å²	128	138.9 Å²	138.9	90%	0.895	78%	0.784	S	S	*	*			cis	-169.5	159.8	-8.2	177.8	0	0	0	0	109.6
276	G	27.7	Very low	31.1	Very low	59 Å²	59	134.3 Å²	134.3	61%	0.608	77%	0.771	S	S	*	*			trans	138.3	117.2	169.1	0	0	0	0	0	113.2
277	R	30.2	Very low	31.2	Very low	246 Å²	246	136.6 Å²	136.6	93%	0.928	78%	0.782	S	S	*	*				57.7	122.3	74.5	-71.5	-178.7	161.8	-169.8	-5.3	112.7
278	S	24.1	Very low	31	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	78%	0.782	S	S	*	*			cis	159.7	128.3	-9.1	39.9	0	0	0	0	105.5
279	S	28.5	Very low	30.9	Very low	120 Å²	120	132.7 Å²	132.7	84%	0.839	79%	0.786	S	S	*	*			trans	35.4	144.5	146.8	-53.2	0	0	0	0	121.1
280	P	41.5	Very low	30.5	Very low	110 Å²	110	129.7 Å²	129.7	71%	0.714	79%	0.786	S	S	*	*			cis	-156.6	167.5	43.7	42.8	-21.9	0	0	0	120
281	C	26.3	Very low	30.1	Very low	114 Å²	114	131.1 Å²	131.1	77%	0.77	79%	0.79	S	S	*	*			trans	62.8	146.7	148.5	-67.9	0	0	0	0	120.3
282	L	27.3	Very low	29.8	Very low	152 Å²	152	125.7 Å²	125.7	80%	0.796	78%	0.784	S	S	*	*			cis	-157	160.7	0.2	-119.4	167.8	0	0	0	110.8
283	S	28	Very low	29.9	Very low	102 Å²	102	123.8 Å²	123.8	71%	0.713	78%	0.783	S	S	*	*			trans	69	99.5	160.7	-61.3	0	0	0	0	121.4
284	T	32.8	Very low	30.4	Very low	156 Å²	156	124.2 Å²	124.2	96%	0.957	79%	0.787	S	S	*	*				-153.1	168.5	115.6	9.7	0	0	0	0	109.3
285	H	27.1	Very low	30.6	Very low	178 Å²	178	124.2 Å²	124.2	82%	0.824	78%	0.781	S	S	*	*			trans	-106.9	130.3	-145.8	-160.9	64.8	0	0	0	116.2
286	S	29	Very low	31	Very low	78 Å²	78	125.1 Å²	125.1	55%	0.545	78%	0.781	S	S	.	*			trans	48.3	117.7	147.7	-59.3	0	0	0	0	121.6
287	Q	33.2	Very low	31.9	Very low	205 Å²	205	132.6 Å²	132.6	96%	0.958	79%	0.791	S	S	*	*				-151.7	151	112.5	-115	172.1	100.1	0	0	110.5
288	A	29	Very low	32.7	Very low	87 Å²	87	129.9 Å²	129.9	72%	0.719	79%	0.791	S	S	*	*			trans	-137.9	148	-163.8	0	0	0	0	0	114.8
289	S	31.7	Very low	33.9	Very low	101 Å²	101	130.8 Å²	130.8	71%	0.706	79%	0.792	S	S	*	*			trans	59.6	104.8	144.8	61.7	0	0	0	0	121.5
290	S	30.3	Very low	35	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	78%	0.781	S	S	*	*				91.2	163.6	109.6	-58.8	0	0	0	0	122.5
291	M	31.1	Very low	35.2	Very low	170 Å²	170	133 Å²	133	84%	0.837	79%	0.787	S	S	*	*			trans	91.2	81.3	158.3	-49.9	-46.7	177.5	0	0	120.4
292	A	29.2	Very low	36.1	Very low	95 Å²	95	131 Å²	131	79%	0.785	78%	0.778	S	S	*	*				57.6	136.9	108.2	0	0	0	0	0	123.3
293	S	33.8	Very low	37	Very low	122 Å²	122	129.4 Å²	129.4	85%	0.853	77%	0.767	S	S	*	*			trans	84.4	105.4	143.2	-148	0	0	0	0	121.3
294	G	40.6	Very low	38.2	Very low	77 Å²	77	134.6 Å²	134.6	79%	0.794	77%	0.771	S	S	*	*				60	88.3	118.4	0	0	0	0	0	120.9
295	S	33.3	Very low	38.9	Very low	108 Å²	108	132.8 Å²	132.8	76%	0.755	75%	0.75	S	S	*	*			trans	-158.2	125.8	143.5	-167.2	0	0	0	0	112.1
296	V	37.3	Very low	39.8	Very low	148 Å²	148	127.3 Å²	127.3	90%	0.897	74%	0.735	S	S	*	*			trans	-85.6	111.5	176.3	178.3	0	0	0	0	109.6
297	R	44.8	Very low	40.7	Very low	215 Å²	215	130.2 Å²	130.2	81%	0.811	74%	0.74	S	S	*	*			trans	-109.4	128.7	169.1	-76.4	-168.6	-74.2	175.8	-4.8	111.3	T299	R297-T299 PolarHBondContact O-N 3Å
298	M	47.1	Very low	41.4	Very low	189 Å²	189	128 Å²	128	93%	0.931	73%	0.73	S	S	*	*			trans	-67.1	109.4	170.6	-72.4	-86.7	-74.9	0	0	110
299	T	50.3	Low	42.1	Very low	120 Å²	120	131.6 Å²	131.6	74%	0.736	73%	0.731	S	S	*	*			trans	-84.9	132	173.7	47.2	0	0	0	0	110.8	R297	R297-T299 PolarHBondContact O-N 3Å
300	S	51.7	Low	42.6	Very low	85 Å²	85	136.9 Å²	136.9	59%	0.594	74%	0.736	S	S	*	*			trans	-90.3	144.1	-167.9	-177.4	0	0	0	0	112.7	A302 E303	S300-A302 PolarHBondContact O-N 2.92Å; S300-E303 PolarHBondContact O-N 2.79Å; S300-E303 VanDerWaalsContact O-N 3.09Å
301	F	45.9	Very low	43.2	Very low	190 Å²	190	141.1 Å²	141.1	83%	0.833	74%	0.742	S	S	*	*	H	α-helix	trans	-53.5	-16.3	178.1	-170.5	-97.9	0	0	0	114.7
302	A	45.5	Very low	43.5	Very low	72 Å²	72	137.2 Å²	137.2	60%	0.595	75%	0.745	S	S	*	*	H	α-helix	trans	-65.5	-35.9	175.5	0	0	0	0	0	113.8	S300 K305	S300-A302 PolarHBondContact O-N 2.92Å; A302-K305 PolarHBondContact O-N 2.89Å
303	E	45.5	Very low	43.6	Very low	120 Å²	120	137.6 Å²	137.6	56%	0.561	74%	0.742	S	S	*	*	H	α-helix	trans	-70.3	-46	-168.8	-171.8	167.6	-157.4	0	0	112.4	S300 K305 A306	S300-E303 PolarHBondContact O-N 2.79Å; S300-E303 VanDerWaalsContact O-N 3.09Å; E303-K305 PolarHBondContact O-N 3.5Å; E303-K305 VanDerWaalsContact O-N 3.09Å; E303-A306 WeakPolarHBondContact O-CB 3.32Å; E303-A306 PolarHBondContact O-N 2.83Å
304	R	52	Low	43.5	Very low	211 Å²	211	138.8 Å²	138.8	80%	0.796	74%	0.739	S	S	*	*	H	α-helix	trans	-59.3	-24.7	178.8	-169.1	172.8	-68	-174.1	-0.9	113.3
305	K	48.8	Very low	43	Very low	118 Å²	118	143.4 Å²	143.4	51%	0.513	74%	0.74	S	S	.	*	H	α-helix	trans	-82.8	-19.9	177.3	-169.2	163.8	-176.5	169.6	0	113.6	A302 E303	A302-K305 PolarHBondContact O-N 2.89Å; E303-K305 PolarHBondContact O-N 3.5Å; E303-K305 VanDerWaalsContact O-N 3.09Å
306	A	46.6	Very low	43	Very low	62 Å²	62	144.8 Å²	144.8	51%	0.512	74%	0.739	S	S	.	*	H	α-helix	trans	-77.9	-39.5	178.6	0	0	0	0	0	112.4	E303 Q308 Q309	E303-A306 WeakPolarHBondContact O-CB 3.32Å; E303-A306 PolarHBondContact O-N 2.83Å; A306-Q308 VanDerWaalsContact C-N 3.35Å; A306-Q308 PolarHBondContact O-N 3.34Å; A306-Q309 PolarHBondContact O-N 2.91Å
307	Q	46.8	Very low	43	Very low	139 Å²	139	144.7 Å²	144.7	65%	0.65	73%	0.732	S	S	*	*	H	α-helix	trans	-64.3	-38.3	178.3	-72.2	171.4	-37.3	0	0	112.1	Q309 R310	Q307-Q309 PolarHBondContact O-N 2.96Å; Q307-R310 PolarHBondContact O-N 2.62Å; Q307-R310 VanDerWaalsContact O-N 3.07Å
308	Q	48.2	Very low	42.4	Very low	159 Å²	159	145.3 Å²	145.3	74%	0.743	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	1.5	178.4	-147.6	176.6	34.4	0	0	114.4	A306	A306-Q308 VanDerWaalsContact C-N 3.35Å; A306-Q308 PolarHBondContact O-N 3.34Å
309	Q	44.2	Very low	41.5	Very low	162 Å²	162	141.7 Å²	141.7	76%	0.757	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-1.1	172.6	-68.8	-76.8	-93.8	0	0	113	A306 Q307	A306-Q309 PolarHBondContact O-N 2.91Å; Q307-Q309 PolarHBondContact O-N 2.96Å
310	R	42.2	Very low	40.6	Very low	212 Å²	212	142.3 Å²	142.3	80%	0.8	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-21.2	-179.9	-80.7	-82.7	-176	141	-1.5	114.2	Q307	Q307-R310 PolarHBondContact O-N 2.62Å; Q307-R310 VanDerWaalsContact O-N 3.07Å
311	F	43.2	Very low	39.5	Very low	190 Å²	190	142.4 Å²	142.4	83%	0.833	74%	0.743	S	S	*	*	S	Bend	trans	-134	113	-179	-62.9	-80.9	0	0	0	109.8
312	G	35.9	Very low	38.7	Very low	87 Å²	87	139 Å²	139	90%	0.897	74%	0.743	S	S	*	*			trans	159.1	59.7	-174.9	0	0	0	0	0	113.5
313	S	31.7	Very low	38.1	Very low	104 Å²	104	141 Å²	141	73%	0.727	75%	0.753	S	S	*	*			trans	-99.8	112.2	177.4	172.3	0	0	0	0	111.6
314	N	32.2	Very low	37.5	Very low	147 Å²	147	141 Å²	141	79%	0.786	77%	0.766	S	S	*	*			trans	47.9	96.3	149.1	-57.2	-75.8	0	0	0	118.8
315	H	29.7	Very low	36.8	Very low	174 Å²	174	140.2 Å²	140.2	81%	0.806	77%	0.771	S	S	*	*				-139.1	119.9	110.8	-165	-25.7	0	0	0	108.9
316	D	34.4	Very low	36.2	Very low	137 Å²	137	145.6 Å²	145.6	73%	0.733	79%	0.788	S	S	*	*			trans	-114.3	115.4	173.6	-178	5.5	0	0	0	108.3
317	L	36.7	Very low	35.7	Very low	146 Å²	146	149.2 Å²	149.2	76%	0.764	80%	0.804	S	S	*	*			trans	-157.6	126.6	156.9	-86.9	-166.1	0	0	0	110
318	R	32.8	Very low	34.9	Very low	227 Å²	227	149.1 Å²	149.1	86%	0.857	81%	0.813	S	S	*	*	S	Bend	trans	75.6	131	174.8	-68.9	-178.7	162.2	-96.1	0.1	118.1
319	S	27.5	Very low	35.2	Very low	114 Å²	114	147.2 Å²	147.2	80%	0.797	82%	0.815	S	S	*	*			trans	77.5	65.7	151.8	-55	0	0	0	0	119.2
320	S	30.1	Very low	34.3	Very low	132 Å²	132	147.4 Å²	147.4	92%	0.923	82%	0.821	S	S	*	*			trans	-74	142.6	147.8	-84.1	0	0	0	0	111.7
321	A	30.2	Very low	33.6	Very low	88 Å²	88	140 Å²	140	73%	0.727	81%	0.811	S	S	*	*			trans	-77.2	162.8	-169.4	0	0	0	0	0	116.2
322	S	29.6	Very low	33	Very low	118 Å²	118	135.8 Å²	135.8	83%	0.825	81%	0.805	S	S	*	*			trans	-156.8	116.4	141.8	-76.4	0	0	0	0	106.8
323	S	31.6	Very low	32.7	Very low	114 Å²	114	140.2 Å²	140.2	80%	0.797	80%	0.802	S	S	*	*			cis	59.6	100.8	44.9	-157.4	0	0	0	0	111.5
324	S	34.2	Very low	32.4	Very low	119 Å²	119	140.5 Å²	140.5	83%	0.832	80%	0.804	S	S	*	*			trans	-83.8	146.7	-169.9	-65.8	0	0	0	0	113
325	Q	35.6	Very low	32.4	Very low	195 Å²	195	139.1 Å²	139.1	91%	0.911	81%	0.806	S	S	*	*			trans	-109.5	119.8	155	-165.2	167.4	11.9	0	0	108.3
326	R	37.3	Very low	32.5	Very low	231 Å²	231	134.1 Å²	134.1	87%	0.872	80%	0.802	S	S	*	*			trans	-77.1	129.4	173.6	-72.3	176.4	66.4	179.7	1.9	109.8
327	T	36.2	Very low	33.1	Very low	138 Å²	138	133 Å²	133	85%	0.847	80%	0.801	S	S	*	*				-164.9	136.5	124.7	25.3	0	0	0	0	111.4
328	T	30.3	Very low	32.8	Very low	137 Å²	137	134.3 Å²	134.3	84%	0.84	81%	0.809	S	S	*	*			trans	-153.1	172.4	173.7	48	0	0	0	0	106.9
329	P	53.8	Low	32.8	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	80%	0.801	S	S	*	*			cis	-125.7	176.2	-35.3	36.4	-21.8	0	0	0	111.6
330	D	26.2	Very low	33.1	Very low	166 Å²	166	127.8 Å²	127.8	89%	0.888	80%	0.798	S	S	*	*				179	159	110	-167	18.6	0	0	0	109.7
331	G	27.1	Very low	33.1	Very low	57 Å²	57	126.9 Å²	126.9	59%	0.588	79%	0.791	S	S	*	*			trans	119.2	54.9	168.9	0	0	0	0	0	118
332	S	30.6	Very low	33.1	Very low	101 Å²	101	133.6 Å²	133.6	71%	0.706	80%	0.798	S	S	*	*			trans	67.7	166.7	154.6	-58.9	0	0	0	0	120.2
333	E	28.6	Very low	33.4	Very low	181 Å²	181	133.2 Å²	133.2	85%	0.846	78%	0.779	S	S	*	*			trans	43.2	126.4	152.1	67.9	-157	81.6	0	0	120.7
334	S	26	Very low	33.4	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	77%	0.769	S	S	*	*			cis	-157.2	173.8	7.6	59.2	0	0	0	0	112.5	G336	S334-G336 PolarHBondContact O-N 2.85Å
335	S	31.6	Very low	33.3	Very low	117 Å²	117	136.2 Å²	136.2	82%	0.818	77%	0.767	S	S	*	*			trans	-52	133.3	155.1	-47.2	0	0	0	0	110.3
336	G	31.5	Very low	33	Very low	70 Å²	70	138 Å²	138	72%	0.722	77%	0.765	S	S	*	*			trans	-93	158.6	160.9	0	0	0	0	0	111.1	S334	S334-G336 PolarHBondContact O-N 2.85Å
337	P	47.9	Very low	32.6	Very low	112 Å²	112	133.8 Å²	133.8	73%	0.727	76%	0.76	S	S	*	*			cis	-112.5	166.3	-15.5	39	-28.1	0	0	0	112.1
338	L	30.6	Very low	32.3	Very low	175 Å²	175	135.9 Å²	135.9	92%	0.916	76%	0.76	S	S	*	*				179	176	123.6	-96.5	173.6	0	0	0	111.3
339	S	31.6	Very low	32.1	Very low	100 Å²	100	134.9 Å²	134.9	70%	0.699	76%	0.759	S	S	*	*			trans	-89.4	140	-165.7	-161.9	0	0	0	0	114.8
340	S	34.6	Very low	31.5	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	76%	0.757	S	S	*	*			trans	31.8	111.1	144.9	62	0	0	0	0	119.6
341	S	30.6	Very low	31.6	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	75%	0.753	S	S	*	*			trans	-145.4	110.3	143.4	-168.9	0	0	0	0	113.3
342	W	28.8	Very low	31.9	Very low	228 Å²	228	134.8 Å²	134.8	86%	0.864	76%	0.763	S	S	*	*			trans	-126.8	105.5	145.1	-83.3	84.6	0	0	0	106.3
343	R	37	Very low	32.5	Very low	111 Å²	111	135.7 Å²	135.7	42%	0.419	77%	0.766	S	S	.	*				160.2	117.2	111.2	-76.1	-145.8	-176.9	-62.3	-10.6	114.9	L565 S566	R343-L565 HydrophobicContact CB-CD1 4.44Å; R343-L565 VanDerWaalsContact CD-CD1 3.43Å; R343-L565 VanDerWaalsContact CD-CD2 3.41Å; R343-S566 PolarHBondContact NE-OG 3.48Å; R343-S566 VanDerWaalsContact NH2-CB 3.3Å; R343-S566 PolarHBondContact NH2-OG 3.15Å; R343-S566 VanDerWaalsContact NH2-OG 3.1Å
344	L	31.4	Very low	32.6	Very low	112 Å²	112	135.6 Å²	135.6	59%	0.586	77%	0.77	S	S	*	*			trans	66	102.2	132	-134.6	79.4	0	0	0	121.5	L565	L344-L565 HydrophobicContact CB-CD1 4.33Å; L344-L565 HydrophobicContact CD2-CD1 3.93Å; L344-L565 HydrophobicContact CD2-CD2 4.26Å; L344-L565 HydrophobicContact CD2-CG 4.16Å
345	K	32.3	Very low	32.8	Very low	184 Å²	184	133.9 Å²	133.9	80%	0.8	77%	0.77	S	S	*	*			trans	52	102.3	134.8	-65.2	-169.4	170.4	-153.7	0	121.1
346	R	28.2	Very low	33	Very low	232 Å²	232	132.2 Å²	132.2	88%	0.875	77%	0.771	S	S	*	*				-159.4	114.3	123.5	-149	160.8	-65.9	143.9	5.7	106.6
347	D	29.2	Very low	32.9	Very low	143 Å²	143	135 Å²	135	77%	0.765	78%	0.778	S	S	*	*				73.7	135.1	66.7	-150	-13.6	0	0	0	113
348	Q	30.5	Very low	32.7	Very low	181 Å²	181	137.3 Å²	137.3	85%	0.846	78%	0.784	S	S	*	*			trans	69.5	114.2	-172.3	-52.6	-179.9	119.7	0	0	118.2
349	S	26.4	Very low	33	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	78%	0.784	S	S	*	*			trans	-79.6	163.1	146.6	-45	0	0	0	0	109.3
350	P	40.9	Very low	33.8	Very low	113 Å²	113	142 Å²	142	73%	0.734	79%	0.792	S	S	*	*				-148.4	170.2	82	40.7	-23.9	0	0	0	116.4
351	S	28.3	Very low	34.4	Very low	114 Å²	114	141 Å²	141	80%	0.797	80%	0.798	S	S	*	*			trans	64.2	113.3	153.9	-56.8	0	0	0	0	120.8
352	S	33.6	Very low	35	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	79%	0.79	S	S	*	*			trans	-63.9	161.8	143	-42.5	0	0	0	0	110.2
353	P	42.6	Very low	36.1	Very low	120 Å²	120	133.1 Å²	133.1	78%	0.779	78%	0.778	S	S	*	*				-147	154.2	84.9	39.5	-23.7	0	0	0	116.5
354	L	31.1	Very low	36.8	Very low	179 Å²	179	129.5 Å²	129.5	94%	0.937	78%	0.775	S	S	*	*			trans	45.4	130.6	133.7	-166.1	70.4	0	0	0	121.1
355	G	29.4	Very low	38	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	77%	0.773	S	S	*	*			trans	126.8	113.8	152.6	0	0	0	0	0	113.9
356	G	36.1	Very low	39.1	Very low	82 Å²	82	125.4 Å²	125.4	85%	0.845	77%	0.766	S	S	*	*			trans	-101.2	148.8	174.5	0	0	0	0	0	112.5
357	C	29.9	Very low	40.7	Very low	128 Å²	128	118.3 Å²	118.3	87%	0.865	75%	0.748	S	S	*	*			trans	-158.9	145.8	154.6	-166	0	0	0	0	109.9
358	N	44.6	Very low	42.7	Very low	160 Å²	160	116.5 Å²	116.5	86%	0.856	74%	0.738	S	S	*	*			trans	-78.4	130.8	177.9	-69.2	-39.6	0	0	0	111.4
359	R	36.6	Very low	44.4	Very low	241 Å²	241	110.4 Å²	110.4	91%	0.909	72%	0.718	S	S	*	*			trans	-139.9	141.6	149.4	-80.5	-159.9	174.2	-148.7	-1.8	110.8
360	P	47.8	Very low	46.8	Very low	133 Å²	133	108.3 Å²	108.3	86%	0.864	70%	0.704	S	S	*	*			trans	-80	137.4	179.4	32.8	-33.8	0	0	0	110.7
361	G	47.3	Very low	48.8	Very low	83 Å²	83	107.5 Å²	107.5	86%	0.856	69%	0.69	S	S	*	*			trans	171.8	25.8	-178.4	0	0	0	0	0	120.2
362	D	43.2	Very low	51.4	Low	118 Å²	118	106.3 Å²	106.3	63%	0.631	67%	0.674	S	S	*	*			trans	-148.3	113.1	158.3	-170.3	4.5	0	0	0	111.9	G364	D362-G364 PolarHBondContact OD1-N 2.89Å
363	G	51.5	Low	53.8	Low	58 Å²	58	105.6 Å²	105.6	60%	0.598	66%	0.664	S	S	*	*			trans	-102.3	-4.5	173.9	0	0	0	0	0	114.2
364	G	51.3	Low	55.7	Low	35 Å²	35	104.6 Å²	104.6	36%	0.361	65%	0.649	S	S	.	*	H	α-helix	trans	-75.5	-32.7	-169.1	0	0	0	0	0	114.5	D362 N366 V367 L368	D362-G364 PolarHBondContact OD1-N 2.89Å; G364-N366 PolarHBondContact O-N 3.44Å; G364-V367 PolarHBondContact O-N 3.3Å; G364-L368 PolarHBondContact O-N 2.95Å
365	T	56.8	Low	58.6	Low	87 Å²	87	100.8 Å²	100.8	53%	0.534	63%	0.629	S	S	.	*	H	α-helix	trans	-64.1	-40.4	-172.9	51.2	0	0	0	0	113.7	A369	T365-A369 PolarHBondContact O-N 3.02Å
366	N	55.8	Low	61.2	Low	123 Å²	123	105.4 Å²	105.4	66%	0.658	62%	0.624	S	S	*	*	H	α-helix	trans	-74	-28.4	-179.8	-71.9	-58.2	0	0	0	113.3	G364 A369 S370	G364-N366 PolarHBondContact O-N 3.44Å; N366-A369 PolarHBondContact O-N 3.5Å; N366-S370 PolarHBondContact O-N 3.21Å
367	V	62.9	Low	63.6	Low	82 Å²	82	107.4 Å²	107.4	50%	0.497	61%	0.613	S	S	.	*	H	α-helix	trans	-65.5	-50.3	178.1	179.2	0	0	0	0	110.2	G364 A369 S370 E371	G364-V367 PolarHBondContact O-N 3.3Å; V367-A369 VanDerWaalsContact C-N 3.29Å; V367-A369 PolarHBondContact O-N 2.8Å; V367-S370 WeakPolarHBondContact O-CB 3.11Å; V367-S370 PolarHBondContact O-N 3.13Å; V367-S370 VanDerWaalsContact O-N 3.08Å; V367-E371 PolarHBondContact O-N 3.42Å
368	L	69.4	Low	66.4	Low	106 Å²	106	105.5 Å²	105.5	56%	0.555	59%	0.591	S	S	*	*	H	α-helix	trans	-62.6	-35.2	178.2	-64.6	172.7	0	0	0	112.4	G364 I372	G364-L368 PolarHBondContact O-N 2.95Å; L368-I372 WeakPolarHBondContact O-CD1 3.28Å; L368-I372 VanDerWaalsContact O-CG1 3.27Å; L368-I372 WeakPolarHBondContact O-CG1 3.43Å; L368-I372 PolarHBondContact O-N 2.93Å; L368-I372 VanDerWaalsContact O-N 3.08Å
369	A	67.3	Low	68.6	Low	52 Å²	52	103.8 Å²	103.8	43%	0.43	58%	0.581	S	S	.	*	H	α-helix	trans	-64.3	-42.3	173.3	0	0	0	0	0	111.9	T365 N366 V367 I372 V373	T365-A369 PolarHBondContact O-N 3.02Å; N366-A369 PolarHBondContact O-N 3.5Å; V367-A369 VanDerWaalsContact C-N 3.29Å; V367-A369 PolarHBondContact O-N 2.8Å; A369-I372 PolarHBondContact O-N 3.23Å; A369-V373 WeakPolarHBondContact O-CG2 3.45Å; A369-V373 PolarHBondContact O-N 3.37Å; A369-V373 VanDerWaalsContact O-N 3.13Å
370	S	75.9	Confident	71	Confident	74 Å²	74	95.6 Å²	95.6	52%	0.517	55%	0.553	S	S	.	*	H	α-helix	trans	-63.5	-45.9	175.7	-166.5	0	0	0	0	112	N366 V367 I372 V373 Q374	N366-S370 PolarHBondContact O-N 3.21Å; V367-S370 WeakPolarHBondContact O-CB 3.11Å; V367-S370 PolarHBondContact O-N 3.13Å; V367-S370 VanDerWaalsContact O-N 3.08Å; S370-I372 VanDerWaalsContact C-N 3.33Å; S370-I372 PolarHBondContact O-N 3.08Å; S370-V373 PolarHBondContact O-N 3.15Å; S370-V373 VanDerWaalsContact O-N 3.11Å; S370-Q374 WeakPolarHBondContact O-CB 3.15Å; S370-Q374 PolarHBondContact O-N 3.42Å
371	E	83.5	Confident	72.9	Confident	96 Å²	96	94.9 Å²	94.9	45%	0.449	54%	0.538	S	S	.	.	H	α-helix	trans	-58.7	-41.8	175.9	-71.9	-179.1	170.8	0	0	112.2	V367 V373 Q374 L375	V367-E371 PolarHBondContact O-N 3.42Å; E371-V373 VanDerWaalsContact C-N 3.34Å; E371-V373 PolarHBondContact O-N 2.87Å; E371-Q374 PolarHBondContact O-N 2.99Å; E371-L375 WeakPolarHBondContact O-CB 3.38Å; E371-L375 VanDerWaalsContact O-CG 3.31Å; E371-L375 WeakPolarHBondContact O-CG 3.46Å; E371-L375 PolarHBondContact O-N 3.33Å
372	I	83.9	Confident	75	Confident	89 Å²	89	97 Å²	97	46%	0.456	52%	0.524	S	S	.	.	H	α-helix	trans	-64.6	-37.3	176.4	-70.3	165.8	0	0	0	111.5	L368 A369 S370 R376	L368-I372 WeakPolarHBondContact O-CD1 3.28Å; L368-I372 VanDerWaalsContact O-CG1 3.27Å; L368-I372 WeakPolarHBondContact O-CG1 3.43Å; L368-I372 PolarHBondContact O-N 2.93Å; L368-I372 VanDerWaalsContact O-N 3.08Å; A369-I372 PolarHBondContact O-N 3.23Å; S370-I372 VanDerWaalsContact C-N 3.33Å; S370-I372 PolarHBondContact O-N 3.08Å; I372-R376 VanDerWaalsContact O-CG 3.25Å; I372-R376 WeakPolarHBondContact O-CG 3.42Å; I372-R376 PolarHBondContact O-N 3.18Å; I372-R376 VanDerWaalsContact O-N 3.1Å
373	V	82.1	Confident	77.4	Confident	97 Å²	97	97.2 Å²	97.2	59%	0.588	52%	0.516	S	S	*	.	H	α-helix	trans	-69.2	-41.5	174.1	172.5	0	0	0	0	111.1	A369 S370 E371 R376 M377	A369-V373 WeakPolarHBondContact O-CG2 3.45Å; A369-V373 PolarHBondContact O-N 3.37Å; A369-V373 VanDerWaalsContact O-N 3.13Å; S370-V373 PolarHBondContact O-N 3.15Å; S370-V373 VanDerWaalsContact O-N 3.11Å; E371-V373 VanDerWaalsContact C-N 3.34Å; E371-V373 PolarHBondContact O-N 2.87Å; V373-R376 WeakPolarHBondContact O-CB 3.45Å; V373-R376 PolarHBondContact O-N 3.35Å; V373-M377 PolarHBondContact O-N 3.46Å
374	Q	84.2	Confident	79.3	Confident	100 Å²	100	102 Å²	102	47%	0.467	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-40.3	177.8	-166.6	173.7	14.9	0	0	111.9	S370 E371 M377 Q378	S370-Q374 WeakPolarHBondContact O-CB 3.15Å; S370-Q374 PolarHBondContact O-N 3.42Å; E371-Q374 PolarHBondContact O-N 2.99Å; Q374-M377 HydrophobicContact CG-CE 4.49Å; Q374-M377 PolarHBondContact O-N 2.81Å; Q374-Q378 WeakPolarHBondContact O-CB 3.46Å; Q374-Q378 WeakPolarHBondContact O-CG 3.26Å; Q374-Q378 PolarHBondContact O-N 2.84Å
375	L	90.5	Very high	81	Confident	99 Å²	99	102.6 Å²	102.6	52%	0.518	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-40.1	172.5	-74.9	169.4	0	0	0	112.1	E371 Q378 L379	E371-L375 WeakPolarHBondContact O-CB 3.38Å; E371-L375 VanDerWaalsContact O-CG 3.31Å; E371-L375 WeakPolarHBondContact O-CG 3.46Å; E371-L375 PolarHBondContact O-N 3.33Å; L375-Q378 PolarHBondContact O-N 2.76Å; L375-L379 WeakPolarHBondContact O-CB 3.35Å; L375-L379 VanDerWaalsContact O-CG 3.26Å; L375-L379 WeakPolarHBondContact O-CG 3.49Å; L375-L379 PolarHBondContact O-N 2.88Å
376	R	85.5	Confident	82.5	Confident	170 Å²	170	103.8 Å²	103.8	64%	0.642	52%	0.519	S	S	*	.	H	α-helix	trans	-62.5	-44.5	173.1	-73.2	168.9	-175.1	-147.9	1.7	111.6	I372 V373 L379 E380	I372-R376 VanDerWaalsContact O-CG 3.25Å; I372-R376 WeakPolarHBondContact O-CG 3.42Å; I372-R376 PolarHBondContact O-N 3.18Å; I372-R376 VanDerWaalsContact O-N 3.1Å; V373-R376 WeakPolarHBondContact O-CB 3.45Å; V373-R376 PolarHBondContact O-N 3.35Å; R376-L379 PolarHBondContact O-N 3.47Å; R376-E380 WeakPolarHBondContact O-CB 3.41Å; R376-E380 PolarHBondContact O-N 3.07Å
377	M	86.7	Confident	84.1	Confident	125 Å²	125	102.1 Å²	102.1	62%	0.616	51%	0.508	S	S	*	.	H	α-helix	trans	-61.5	-45.9	176.7	-175.2	176.8	70.5	0	0	111.6	V373 Q374 E380 E381	V373-M377 PolarHBondContact O-N 3.46Å; Q374-M377 HydrophobicContact CG-CE 4.49Å; Q374-M377 PolarHBondContact O-N 2.81Å; M377-E380 PolarHBondContact O-N 3.07Å; M377-E381 WeakPolarHBondContact O-CB 3.46Å; M377-E381 PolarHBondContact O-N 3.38Å
378	Q	88.4	Confident	85.5	Confident	88 Å²	88	103.2 Å²	103.2	41%	0.411	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-41.2	175.9	-73.8	179.2	2.6	0	0	112.2	Q374 L375 E381 K382	Q374-Q378 WeakPolarHBondContact O-CB 3.46Å; Q374-Q378 WeakPolarHBondContact O-CG 3.26Å; Q374-Q378 PolarHBondContact O-N 2.84Å; L375-Q378 PolarHBondContact O-N 2.76Å; Q378-E381 PolarHBondContact O-N 2.91Å; Q378-K382 WeakPolarHBondContact O-CG 3.28Å; Q378-K382 PolarHBondContact O-N 2.83Å
379	L	89.8	Confident	86.5	Confident	124 Å²	124	104.9 Å²	104.9	65%	0.649	51%	0.512	S	S	*	.	H	α-helix	trans	-65.9	-39.6	177.1	-74.7	169.1	0	0	0	112.2	L375 R376 K382 R383	L375-L379 WeakPolarHBondContact O-CB 3.35Å; L375-L379 VanDerWaalsContact O-CG 3.26Å; L375-L379 WeakPolarHBondContact O-CG 3.49Å; L375-L379 PolarHBondContact O-N 2.88Å; R376-L379 PolarHBondContact O-N 3.47Å; L379-K382 PolarHBondContact O-N 3.22Å; L379-R383 VanDerWaalsContact O-CB 3.27Å; L379-R383 WeakPolarHBondContact O-CB 3.46Å; L379-R383 PolarHBondContact O-N 2.85Å
380	E	88.4	Confident	87.8	Confident	69 Å²	69	108.4 Å²	108.4	32%	0.322	52%	0.517	S	S	.	.	H	α-helix	trans	-66.7	-38.3	173.3	176.9	57.3	-160.3	0	0	111.7	R376 M377 R383 R384	R376-E380 WeakPolarHBondContact O-CB 3.41Å; R376-E380 PolarHBondContact O-N 3.07Å; M377-E380 PolarHBondContact O-N 3.07Å; E380-R383 WeakPolarHBondContact O-CB 3.45Å; E380-R383 PolarHBondContact O-N 2.85Å; E380-R383 VanDerWaalsContact OE2-CD 3.28Å; E380-R383 WeakPolarHBondContact OE2-CD 3.27Å; E380-R383 IonicContact OE2-NE 2.75Å; E380-R383 PolarHBondContact OE2-NE 2.89Å; E380-R384 VanDerWaalsContact O-CG 3.31Å; E380-R384 WeakPolarHBondContact O-CG 3.3Å; E380-R384 PolarHBondContact O-N 2.89Å; E380-R384 IonicContact OE1-CZ 3.92Å; E380-R384 IonicContact OE1-NE 3.14Å; E380-R384 PolarHBondContact OE1-NE 2.79Å; E380-R384 IonicContact OE1-NH2 2.76Å; E380-R384 PolarHBondContact OE1-NH2 3.19Å
381	E	86.2	Confident	88.6	Confident	118 Å²	118	111.9 Å²	111.9	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-63.9	-46.2	172.5	-170.2	-166.5	-167.7	0	0	111.8	M377 Q378 R383 R384 A385	M377-E381 WeakPolarHBondContact O-CB 3.46Å; M377-E381 PolarHBondContact O-N 3.38Å; Q378-E381 PolarHBondContact O-N 2.91Å; E381-R383 VanDerWaalsContact C-N 3.32Å; E381-R383 PolarHBondContact O-N 3.01Å; E381-R384 PolarHBondContact O-N 2.94Å; E381-A385 WeakPolarHBondContact O-CB 3.42Å; E381-A385 PolarHBondContact O-N 2.99Å
382	K	91.1	Very high	89.1	Confident	127 Å²	127	110.4 Å²	110.4	55%	0.552	52%	0.515	S	S	*	.	H	α-helix	trans	-62	-39.6	174.4	-65.1	-45.1	176.7	-159	0	111.5	Q378 L379 A385 I386	Q378-K382 WeakPolarHBondContact O-CG 3.28Å; Q378-K382 PolarHBondContact O-N 2.83Å; L379-K382 PolarHBondContact O-N 3.22Å; K382-A385 PolarHBondContact O-N 2.92Å; K382-I386 WeakPolarHBondContact O-CD1 3.27Å; K382-I386 VanDerWaalsContact O-CG1 3.25Å; K382-I386 WeakPolarHBondContact O-CG1 3.26Å; K382-I386 PolarHBondContact O-N 3.2Å
383	R	94.9	Very high	89.1	Confident	122 Å²	122	112.2 Å²	112.2	46%	0.46	52%	0.524	S	S	.	.	H	α-helix	trans	-58.4	-50.2	173.5	167.9	178.1	153.4	57.5	28.3	111.1	L379 E380 E381 A385 I386 E387	L379-R383 VanDerWaalsContact O-CB 3.27Å; L379-R383 WeakPolarHBondContact O-CB 3.46Å; L379-R383 PolarHBondContact O-N 2.85Å; E380-R383 WeakPolarHBondContact O-CB 3.45Å; E380-R383 PolarHBondContact O-N 2.85Å; E380-R383 VanDerWaalsContact OE2-CD 3.28Å; E380-R383 WeakPolarHBondContact OE2-CD 3.27Å; E380-R383 IonicContact OE2-NE 2.75Å; E380-R383 PolarHBondContact OE2-NE 2.89Å; E381-R383 VanDerWaalsContact C-N 3.32Å; E381-R383 PolarHBondContact O-N 3.01Å; R383-A385 PolarHBondContact O-N 3.18Å; R383-I386 PolarHBondContact O-N 3.39Å; R383-E387 IonicContact CZ-OE1 3.96Å; R383-E387 IonicContact CZ-OE2 2.62Å; R383-E387 IonicContact NH1-OE1 2.61Å; R383-E387 PolarHBondContact NH1-OE1 3.38Å; R383-E387 IonicContact NH1-OE2 2.86Å; R383-E387 VanDerWaalsContact NH2-CD 3.28Å; R383-E387 IonicContact NH2-OE1 3.4Å; R383-E387 PolarHBondContact NH2-OE1 2.95Å; R383-E387 IonicContact NH2-OE2 3.14Å; R383-E387 PolarHBondContact NH2-OE2 2.99Å; R383-E387 WeakPolarHBondContact O-CG 3.24Å; R383-E387 PolarHBondContact O-N 3.33Å
384	R	91.4	Very high	89.5	Confident	159 Å²	159	113.3 Å²	113.3	60%	0.6	52%	0.522	S	S	*	.	H	α-helix	trans	-60.5	-41.4	175.6	-70.9	172.1	-170.6	-164.2	2.4	112.5	E380 E381 I386 E387 H388	E380-R384 VanDerWaalsContact O-CG 3.31Å; E380-R384 WeakPolarHBondContact O-CG 3.3Å; E380-R384 PolarHBondContact O-N 2.89Å; E380-R384 IonicContact OE1-CZ 3.92Å; E380-R384 IonicContact OE1-NE 3.14Å; E380-R384 PolarHBondContact OE1-NE 2.79Å; E380-R384 IonicContact OE1-NH2 2.76Å; E380-R384 PolarHBondContact OE1-NH2 3.19Å; E381-R384 PolarHBondContact O-N 2.94Å; R384-I386 PolarHBondContact O-N 3.3Å; R384-E387 PolarHBondContact O-N 3.11Å; R384-H388 VanDerWaalsContact O-CB 3.24Å; R384-H388 WeakPolarHBondContact O-CB 3.21Å; R384-H388 PolarHBondContact O-N 3.42Å
385	A	87	Confident	89.9	Confident	47 Å²	47	113 Å²	113	39%	0.388	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-41.6	176.2	0	0	0	0	0	112.3	E381 K382 R383 H388 Q389	E381-A385 WeakPolarHBondContact O-CB 3.42Å; E381-A385 PolarHBondContact O-N 2.99Å; K382-A385 PolarHBondContact O-N 2.92Å; R383-A385 PolarHBondContact O-N 3.18Å; A385-H388 PolarHBondContact O-N 3.3Å; A385-Q389 WeakPolarHBondContact O-CG 3.48Å; A385-Q389 PolarHBondContact O-N 3.41Å
386	I	87.3	Confident	89.7	Confident	112 Å²	112	113.8 Å²	113.8	57%	0.574	53%	0.531	S	S	*	.	H	α-helix	trans	-65.9	-44.6	175.4	-69.3	163	0	0	0	111	K382 R383 R384 H388 Q389 K390	K382-I386 WeakPolarHBondContact O-CD1 3.27Å; K382-I386 VanDerWaalsContact O-CG1 3.25Å; K382-I386 WeakPolarHBondContact O-CG1 3.26Å; K382-I386 PolarHBondContact O-N 3.2Å; R383-I386 PolarHBondContact O-N 3.39Å; R384-I386 PolarHBondContact O-N 3.3Å; I386-H388 VanDerWaalsContact C-N 3.34Å; I386-H388 PolarHBondContact O-N 3.39Å; I386-Q389 PolarHBondContact O-N 3.33Å; I386-K390 VanDerWaalsContact O-CB 3.3Å; I386-K390 WeakPolarHBondContact O-CB 3.37Å; I386-K390 PolarHBondContact O-N 2.9Å
387	E	89.9	Confident	89.9	Confident	89 Å²	89	108.1 Å²	108.1	42%	0.416	52%	0.521	S	S	.	.	H	α-helix	trans	-65.3	-36.9	177.8	-72.2	-178.8	158.6	0	0	112	R383 R384 K390 K391	R383-E387 IonicContact CZ-OE1 3.96Å; R383-E387 IonicContact CZ-OE2 2.62Å; R383-E387 IonicContact NH1-OE1 2.61Å; R383-E387 PolarHBondContact NH1-OE1 3.38Å; R383-E387 IonicContact NH1-OE2 2.86Å; R383-E387 VanDerWaalsContact NH2-CD 3.28Å; R383-E387 IonicContact NH2-OE1 3.4Å; R383-E387 PolarHBondContact NH2-OE1 2.95Å; R383-E387 IonicContact NH2-OE2 3.14Å; R383-E387 PolarHBondContact NH2-OE2 2.99Å; R383-E387 WeakPolarHBondContact O-CG 3.24Å; R383-E387 PolarHBondContact O-N 3.33Å; R384-E387 PolarHBondContact O-N 3.11Å; E387-K390 PolarHBondContact O-N 2.98Å; E387-K391 WeakPolarHBondContact O-CB 3.17Å; E387-K391 PolarHBondContact O-N 2.89Å
388	H	91.7	Very high	89.9	Confident	104 Å²	104	105 Å²	105	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-44.5	173.3	176.8	-147.4	0	0	0	112.6	R384 A385 I386 K391 K392	R384-H388 VanDerWaalsContact O-CB 3.24Å; R384-H388 WeakPolarHBondContact O-CB 3.21Å; R384-H388 PolarHBondContact O-N 3.42Å; A385-H388 PolarHBondContact O-N 3.3Å; I386-H388 VanDerWaalsContact C-N 3.34Å; I386-H388 PolarHBondContact O-N 3.39Å; H388-K391 PolarHBondContact O-N 2.82Å; H388-K392 PolarHBondContact CE1-NZ 2.68Å; H388-K392 VanDerWaalsContact CE1-NZ 3.33Å; H388-K392 WeakPolarHBondContact NE2-CE 3.44Å; H388-K392 PolarHBondContact NE2-NZ 3.49Å; H388-K392 PolarHBondContact O-N 3.19Å
389	Q	91.4	Very high	90.1	Very high	142 Å²	142	108.5 Å²	108.5	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-65.1	-41.4	173.9	-76.9	-171.5	-24.8	0	0	112	A385 I386 K391 K392 M393	A385-Q389 WeakPolarHBondContact O-CG 3.48Å; A385-Q389 PolarHBondContact O-N 3.41Å; I386-Q389 PolarHBondContact O-N 3.33Å; Q389-K391 PolarHBondContact O-N 2.99Å; Q389-K392 PolarHBondContact O-N 2.79Å; Q389-M393 PolarHBondContact O-N 2.96Å
390	K	94.1	Very high	89.9	Confident	125 Å²	125	108.5 Å²	108.5	54%	0.543	52%	0.521	S	S	.	.	H	α-helix	trans	-56.7	-49.4	172.6	179.7	-170.5	169.9	-168.7	0	110.9	I386 E387 K392 M393 E394	I386-K390 VanDerWaalsContact O-CB 3.3Å; I386-K390 WeakPolarHBondContact O-CB 3.37Å; I386-K390 PolarHBondContact O-N 2.9Å; E387-K390 PolarHBondContact O-N 2.98Å; K390-K392 VanDerWaalsContact C-N 3.3Å; K390-K392 PolarHBondContact O-N 2.88Å; K390-M393 PolarHBondContact O-N 3.46Å; K390-E394 VanDerWaalsContact O-CB 3.31Å; K390-E394 WeakPolarHBondContact O-CB 3.12Å; K390-E394 PolarHBondContact O-N 2.85Å
391	K	93.3	Very high	89.9	Confident	147 Å²	147	114.9 Å²	114.9	64%	0.639	54%	0.542	S	S	*	.	H	α-helix	trans	-60.1	-38	179	-169.8	174.6	-176.8	178.7	0	112.2	E387 H388 Q389 E394 V395	E387-K391 WeakPolarHBondContact O-CB 3.17Å; E387-K391 PolarHBondContact O-N 2.89Å; H388-K391 PolarHBondContact O-N 2.82Å; Q389-K391 PolarHBondContact O-N 2.99Å; K391-E394 PolarHBondContact O-N 3.02Å; K391-V395 WeakPolarHBondContact O-CG2 3.48Å; K391-V395 PolarHBondContact O-N 2.84Å
392	K	93.8	Very high	90	Very high	65 Å²	65	114.7 Å²	114.7	28%	0.283	54%	0.541	S	S	.	.	H	α-helix	trans	-66.9	-46	174.4	-76.7	177.8	170	173.6	0	112.7	G57 H58 H388 Q389 K390 E394 V395 L396	G57-K392 WeakPolarHBondContact O-CE 3.44Å; G57-K392 PolarHBondContact O-NZ 3.19Å; H58-K392 WeakPolarHBondContact O-CE 3.14Å; H58-K392 PolarHBondContact O-NZ 3.39Å; H388-K392 PolarHBondContact CE1-NZ 2.68Å; H388-K392 VanDerWaalsContact CE1-NZ 3.33Å; H388-K392 WeakPolarHBondContact NE2-CE 3.44Å; H388-K392 PolarHBondContact NE2-NZ 3.49Å; H388-K392 PolarHBondContact O-N 3.19Å; Q389-K392 PolarHBondContact O-N 2.79Å; K390-K392 VanDerWaalsContact C-N 3.3Å; K390-K392 PolarHBondContact O-N 2.88Å; K392-E394 VanDerWaalsContact C-N 3.31Å; K392-E394 PolarHBondContact O-N 3.49Å; K392-V395 PolarHBondContact O-N 3.42Å; K392-L396 WeakPolarHBondContact O-CG 3.35Å; K392-L396 PolarHBondContact O-N 2.66Å
393	M	83.7	Confident	89.9	Confident	128 Å²	128	115.8 Å²	115.8	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-61.1	-39.6	174.5	-179.6	172.4	59.3	0	0	111.9	Q389 K390 L396 A397	Q389-M393 PolarHBondContact O-N 2.96Å; K390-M393 PolarHBondContact O-N 3.46Å; M393-L396 PolarHBondContact O-N 3.45Å; M393-A397 WeakPolarHBondContact O-CB 3.39Å; M393-A397 PolarHBondContact O-N 2.93Å
394	E	91.3	Very high	89.5	Confident	120 Å²	120	115.2 Å²	115.2	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-65.3	-42.6	176.6	-174.9	169.8	-176.3	0	0	112.1	K390 K391 K392 A397 A398	K390-E394 VanDerWaalsContact O-CB 3.31Å; K390-E394 WeakPolarHBondContact O-CB 3.12Å; K390-E394 PolarHBondContact O-N 2.85Å; K391-E394 PolarHBondContact O-N 3.02Å; K392-E394 VanDerWaalsContact C-N 3.31Å; K392-E394 PolarHBondContact O-N 3.49Å; E394-A397 PolarHBondContact O-N 2.85Å; E394-A398 VanDerWaalsContact O-CB 3.31Å; E394-A398 WeakPolarHBondContact O-CB 3.42Å; E394-A398 PolarHBondContact O-N 2.8Å
395	V	90.9	Very high	89.2	Confident	93 Å²	93	109.5 Å²	109.5	56%	0.564	54%	0.542	S	S	*	.	H	α-helix	trans	-62.9	-40.4	172.6	167.9	0	0	0	0	111.7	K391 K392 A398 R399	K391-V395 WeakPolarHBondContact O-CG2 3.48Å; K391-V395 PolarHBondContact O-N 2.84Å; K392-V395 PolarHBondContact O-N 3.42Å; V395-A398 PolarHBondContact O-N 2.91Å; V395-R399 WeakPolarHBondContact O-CB 3.44Å; V395-R399 PolarHBondContact O-N 2.87Å
396	L	87.6	Confident	89.2	Confident	115 Å²	115	113.3 Å²	113.3	60%	0.602	55%	0.549	S	S	*	.	H	α-helix	trans	-65.2	-44.7	175.2	-70.4	172.1	0	0	0	111.8	K392 M393 A398 R399 Q400	K392-L396 WeakPolarHBondContact O-CG 3.35Å; K392-L396 PolarHBondContact O-N 2.66Å; M393-L396 PolarHBondContact O-N 3.45Å; L396-A398 PolarHBondContact O-N 3.12Å; L396-R399 WeakPolarHBondContact O-CB 3.21Å; L396-R399 PolarHBondContact O-N 2.85Å; L396-Q400 PolarHBondContact O-N 2.87Å
397	A	89.2	Confident	88.8	Confident	52 Å²	52	109.9 Å²	109.9	43%	0.43	54%	0.538	S	S	.	.	H	α-helix	trans	-64.1	-39.1	176.1	0	0	0	0	0	112.3	M393 E394 Q400 R401	M393-A397 WeakPolarHBondContact O-CB 3.39Å; M393-A397 PolarHBondContact O-N 2.93Å; E394-A397 PolarHBondContact O-N 2.85Å; A397-Q400 PolarHBondContact O-N 2.82Å; A397-R401 WeakPolarHBondContact O-CB 3.11Å; A397-R401 PolarHBondContact O-N 2.84Å
398	A	86.3	Confident	88.1	Confident	58 Å²	58	108 Å²	108	48%	0.479	54%	0.538	S	S	.	.	H	α-helix	trans	-63.3	-40.9	172.6	0	0	0	0	0	111.6	E394 V395 L396 R401 Q402	E394-A398 VanDerWaalsContact O-CB 3.31Å; E394-A398 WeakPolarHBondContact O-CB 3.42Å; E394-A398 PolarHBondContact O-N 2.8Å; V395-A398 PolarHBondContact O-N 2.91Å; L396-A398 PolarHBondContact O-N 3.12Å; A398-R401 PolarHBondContact O-N 2.95Å; A398-Q402 WeakPolarHBondContact O-CB 3.35Å; A398-Q402 PolarHBondContact O-N 3.08Å
399	R	92.2	Very high	87.7	Confident	163 Å²	163	109.3 Å²	109.3	62%	0.615	54%	0.542	S	S	*	.	H	α-helix	trans	-65.9	-39.2	175.4	-158.6	-180	-154.9	-167.3	6.5	112.1	V395 L396 Q402 K403	V395-R399 WeakPolarHBondContact O-CB 3.44Å; V395-R399 PolarHBondContact O-N 2.87Å; L396-R399 WeakPolarHBondContact O-CB 3.21Å; L396-R399 PolarHBondContact O-N 2.85Å; R399-Q402 PolarHBondContact O-N 2.96Å; R399-K403 PolarHBondContact O-N 2.86Å
400	Q	86.8	Confident	87.3	Confident	124 Å²	124	108 Å²	108	58%	0.579	54%	0.54	S	S	*	.	H	α-helix	trans	-65.7	-46.6	173.7	-170.9	-177.1	11.9	0	0	111.1	L396 A397 Q402 K403 L404	L396-Q400 PolarHBondContact O-N 2.87Å; A397-Q400 PolarHBondContact O-N 2.82Å; Q400-Q402 VanDerWaalsContact C-N 3.27Å; Q400-Q402 PolarHBondContact O-N 2.57Å; Q400-K403 PolarHBondContact O-N 2.91Å; Q400-K403 VanDerWaalsContact O-N 3.17Å; Q400-L404 HydrophobicContact CG-CD1 4.18Å; Q400-L404 WeakPolarHBondContact O-CG 3.43Å; Q400-L404 PolarHBondContact O-N 3.39Å
401	R	87.9	Confident	86.4	Confident	203 Å²	203	109 Å²	109	77%	0.766	55%	0.546	S	S	*	.	H	α-helix	trans	-58.4	-38.6	173	-176.1	-179.2	-71.3	-165.9	-1.6	111.6	A397 A398 G405	A397-R401 WeakPolarHBondContact O-CB 3.11Å; A397-R401 PolarHBondContact O-N 2.84Å; A398-R401 PolarHBondContact O-N 2.95Å; R401-G405 PolarHBondContact O-N 2.94Å
402	Q	88.4	Confident	85.5	Confident	113 Å²	113	107.8 Å²	107.8	53%	0.528	55%	0.545	S	S	.	.	H	α-helix	trans	-68	-41.7	175.3	-163.6	-166.1	42.2	0	0	112.1	A398 R399 Q400 G405 K406	A398-Q402 WeakPolarHBondContact O-CB 3.35Å; A398-Q402 PolarHBondContact O-N 3.08Å; R399-Q402 PolarHBondContact O-N 2.96Å; Q400-Q402 VanDerWaalsContact C-N 3.27Å; Q400-Q402 PolarHBondContact O-N 2.57Å; Q402-G405 PolarHBondContact O-N 3.26Å; Q402-K406 WeakPolarHBondContact O-CB 3.47Å; Q402-K406 WeakPolarHBondContact O-CG 3.2Å; Q402-K406 PolarHBondContact O-N 2.95Å
403	K	88.8	Confident	84.5	Confident	151 Å²	151	108.4 Å²	108.4	66%	0.657	55%	0.554	S	S	*	*	H	α-helix	trans	-60.3	-50.3	173.5	-79.2	-173.5	172.4	-170	0	111.3	R399 Q400 G405 K406 A407	R399-K403 PolarHBondContact O-N 2.86Å; Q400-K403 PolarHBondContact O-N 2.91Å; Q400-K403 VanDerWaalsContact O-N 3.17Å; K403-G405 PolarHBondContact O-N 3.45Å; K403-K406 PolarHBondContact O-N 3.22Å; K403-A407 PolarHBondContact O-N 2.94Å
404	L	86.3	Confident	83.9	Confident	110 Å²	110	111.3 Å²	111.3	58%	0.576	56%	0.563	S	S	*	*	H	α-helix	trans	-63.8	-39.4	178.2	-68.2	172.6	0	0	0	112	Q400 A407 A408	Q400-L404 HydrophobicContact CG-CD1 4.18Å; Q400-L404 WeakPolarHBondContact O-CG 3.43Å; Q400-L404 PolarHBondContact O-N 3.39Å; L404-A407 PolarHBondContact O-N 3.4Å; L404-A408 WeakPolarHBondContact O-CB 3.33Å; L404-A408 PolarHBondContact O-N 3.04Å
405	G	86.4	Confident	82.5	Confident	39 Å²	39	114.7 Å²	114.7	40%	0.402	58%	0.576	S	S	.	*	H	α-helix	trans	-63.9	-40.2	174	0	0	0	0	0	112.9	R401 Q402 K403 F409	R401-G405 PolarHBondContact O-N 2.94Å; Q402-G405 PolarHBondContact O-N 3.26Å; K403-G405 PolarHBondContact O-N 3.45Å; G405-F409 VanDerWaalsContact O-CB 3.23Å; G405-F409 WeakPolarHBondContact O-CB 3.27Å; G405-F409 PolarHBondContact O-N 2.87Å
406	K	85.8	Confident	80.5	Confident	126 Å²	126	113 Å²	113	55%	0.548	58%	0.577	S	S	.	*	H	α-helix	trans	-65.4	-41.4	172.8	-76.5	178.7	175.9	-173.9	0	112.1	Q402 K403 F409 L410	Q402-K406 WeakPolarHBondContact O-CB 3.47Å; Q402-K406 WeakPolarHBondContact O-CG 3.2Å; Q402-K406 PolarHBondContact O-N 2.95Å; K403-K406 PolarHBondContact O-N 3.22Å; K406-F409 PolarHBondContact O-N 2.83Å; K406-L410 WeakPolarHBondContact O-CB 3.33Å; K406-L410 WeakPolarHBondContact O-CG 3.37Å; K406-L410 PolarHBondContact O-N 3.32Å
407	A	78.8	Confident	78.7	Confident	41 Å²	41	111.1 Å²	111.1	34%	0.339	59%	0.586	S	S	.	*	H	α-helix	trans	-64.3	-47.7	175.1	0	0	0	0	0	111.7	K403 L404 F409 L410 H411	K403-A407 PolarHBondContact O-N 2.94Å; L404-A407 PolarHBondContact O-N 3.4Å; A407-F409 VanDerWaalsContact C-N 3.34Å; A407-F409 PolarHBondContact O-N 3.27Å; A407-L410 WeakPolarHBondContact O-CB 3.19Å; A407-L410 PolarHBondContact O-N 3.42Å; A407-L410 VanDerWaalsContact O-N 3.17Å; A407-H411 PolarHBondContact O-CD2 3.48Å; A407-H411 PolarHBondContact O-N 2.86Å
408	A	76.3	Confident	76.6	Confident	50 Å²	50	111.2 Å²	111.2	41%	0.413	59%	0.592	S	S	.	*	H	α-helix	trans	-60.8	-41.7	176	0	0	0	0	0	112.1	L404 H411 I412	L404-A408 WeakPolarHBondContact O-CB 3.33Å; L404-A408 PolarHBondContact O-N 3.04Å; A408-H411 PolarHBondContact O-N 3.11Å; A408-I412 VanDerWaalsContact O-CG1 3.29Å; A408-I412 WeakPolarHBondContact O-CG1 3.34Å; A408-I412 PolarHBondContact O-N 3Å
409	F	82.6	Confident	74.7	Confident	131 Å²	131	120.1 Å²	120.1	58%	0.575	61%	0.613	S	S	*	*	H	α-helix	trans	-61.1	-44.8	172.6	178.4	-100.1	0	0	0	111.9	G405 K406 A407 H411 I412 V413	G405-F409 VanDerWaalsContact O-CB 3.23Å; G405-F409 WeakPolarHBondContact O-CB 3.27Å; G405-F409 PolarHBondContact O-N 2.87Å; K406-F409 PolarHBondContact O-N 2.83Å; A407-F409 VanDerWaalsContact C-N 3.34Å; A407-F409 PolarHBondContact O-N 3.27Å; F409-H411 VanDerWaalsContact C-N 3.34Å; F409-H411 PolarHBondContact O-N 3.06Å; F409-I412 PolarHBondContact O-N 2.92Å; F409-V413 HydrophobicContact CD1-CG2 4.16Å; F409-V413 HydrophobicContact CD2-CG2 4.23Å; F409-V413 HydrophobicContact CE1-CG2 3.76Å; F409-V413 HydrophobicContact CE2-CG2 3.84Å; F409-V413 HydrophobicContact CG-CG2 4.39Å; F409-V413 HydrophobicContact CZ-CG2 3.59Å; F409-V413 WeakPolarHBondContact O-CB 3Å; F409-V413 WeakPolarHBondContact O-CG2 3.49Å; F409-V413 PolarHBondContact O-N 3.46Å
410	L	82.9	Confident	72.2	Confident	115 Å²	115	118.1 Å²	118.1	60%	0.602	62%	0.624	S	S	*	*	H	α-helix	trans	-62	-38.2	174.7	-79.9	162.2	0	0	0	112.4	K406 A407 K414	K406-L410 WeakPolarHBondContact O-CB 3.33Å; K406-L410 WeakPolarHBondContact O-CG 3.37Å; K406-L410 PolarHBondContact O-N 3.32Å; A407-L410 WeakPolarHBondContact O-CB 3.19Å; A407-L410 PolarHBondContact O-N 3.42Å; A407-L410 VanDerWaalsContact O-N 3.17Å; L410-K414 WeakPolarHBondContact O-CB 3.33Å; L410-K414 PolarHBondContact O-N 3.24Å
411	H	74.5	Confident	69.8	Low	145 Å²	145	119.2 Å²	119.2	67%	0.671	63%	0.634	S	S	*	*	H	α-helix	trans	-65.3	-41.1	172.2	-79	-72.8	0	0	0	112.4	A407 A408 F409 K415	A407-H411 PolarHBondContact O-CD2 3.48Å; A407-H411 PolarHBondContact O-N 2.86Å; A408-H411 PolarHBondContact O-N 3.11Å; F409-H411 VanDerWaalsContact C-N 3.34Å; F409-H411 PolarHBondContact O-N 3.06Å; H411-K415 WeakPolarHBondContact O-CB 3.44Å; H411-K415 PolarHBondContact O-N 2.73Å
412	I	74.6	Confident	67.4	Low	122 Å²	122	115.6 Å²	115.6	63%	0.626	64%	0.635	S	S	*	*	H	α-helix	trans	-65.6	-47.1	177	-69.4	163	0	0	0	110.6	A408 F409 K415 G416	A408-I412 VanDerWaalsContact O-CG1 3.29Å; A408-I412 WeakPolarHBondContact O-CG1 3.34Å; A408-I412 PolarHBondContact O-N 3Å; F409-I412 PolarHBondContact O-N 2.92Å; I412-K415 PolarHBondContact O-N 3.14Å; I412-G416 PolarHBondContact O-N 2.95Å
413	V	73.4	Confident	64.6	Low	77 Å²	77	118 Å²	118	47%	0.467	65%	0.65	S	S	.	*	H	α-helix	trans	-67.2	-42.5	179.1	172.9	0	0	0	0	111.5	F409 K415 G416 G417	F409-V413 HydrophobicContact CD1-CG2 4.16Å; F409-V413 HydrophobicContact CD2-CG2 4.23Å; F409-V413 HydrophobicContact CE1-CG2 3.76Å; F409-V413 HydrophobicContact CE2-CG2 3.84Å; F409-V413 HydrophobicContact CG-CG2 4.39Å; F409-V413 HydrophobicContact CZ-CG2 3.59Å; F409-V413 WeakPolarHBondContact O-CB 3Å; F409-V413 WeakPolarHBondContact O-CG2 3.49Å; F409-V413 PolarHBondContact O-N 3.46Å; V413-K415 VanDerWaalsContact C-N 3.32Å; V413-K415 PolarHBondContact O-N 2.83Å; V413-G416 CarbonylContact O-C 3.5Å; V413-G416 PolarHBondContact O-N 3.02Å; V413-G417 PolarHBondContact O-N 3.28Å
414	K	71.1	Confident	62.2	Low	190 Å²	190	117 Å²	117	83%	0.826	66%	0.66	S	S	*	*	H	α-helix	trans	-70.4	-26.3	177.5	-169.5	163.4	-177.6	171.3	0	112.9	L410	L410-K414 WeakPolarHBondContact O-CB 3.33Å; L410-K414 PolarHBondContact O-N 3.24Å
415	K	61.4	Low	59.4	Low	190 Å²	190	116.9 Å²	116.9	83%	0.826	67%	0.668	S	S	*	*	H	α-helix	trans	-81.8	-25.6	169.8	-170.5	172.2	-179.2	178.6	0	112.9	H411 I412 V413 G417	H411-K415 WeakPolarHBondContact O-CB 3.44Å; H411-K415 PolarHBondContact O-N 2.73Å; I412-K415 PolarHBondContact O-N 3.14Å; V413-K415 VanDerWaalsContact C-N 3.32Å; V413-K415 PolarHBondContact O-N 2.83Å; K415-G417 VanDerWaalsContact C-N 3.3Å
416	G	50.2	Low	56.5	Low	57 Å²	57	119.8 Å²	119.8	59%	0.588	68%	0.682	S	S	*	*	S	Bend	trans	-82.4	1.6	175.6	0	0	0	0	0	114.9	I412 V413 G418	I412-G416 PolarHBondContact O-N 2.95Å; V413-G416 CarbonylContact O-C 3.5Å; V413-G416 PolarHBondContact O-N 3.02Å; G416-G418 PolarHBondContact O-N 3.34Å
417	G	48.4	Very low	53.7	Low	76 Å²	76	121.2 Å²	121.2	78%	0.784	70%	0.695	S	S	*	*	S	Bend	trans	-71.1	45.7	175.9	0	0	0	0	0	114.3	V413 K415	V413-G417 PolarHBondContact O-N 3.28Å; K415-G417 VanDerWaalsContact C-N 3.3Å
418	G	46.8	Very low	51.4	Low	55 Å²	55	128.4 Å²	128.4	57%	0.567	72%	0.718	S	S	*	*	S	Bend	trans	173.5	89.9	-176.5	0	0	0	0	0	114.4	G416	G416-G418 PolarHBondContact O-N 3.34Å
419	R	44.7	Very low	49.3	Very low	245 Å²	245	130.3 Å²	130.3	93%	0.925	73%	0.734	S	S	*	*			trans	30.1	104	149.2	-66.2	170.1	158.6	-92.2	1.6	118.3
420	S	39.9	Very low	46.7	Very low	121 Å²	121	130.7 Å²	130.7	85%	0.846	74%	0.742	S	S	*	*			trans	-177.4	159.1	138	27.9	0	0	0	0	112.9
421	D	36.9	Very low	44.3	Very low	146 Å²	146	132.4 Å²	132.4	78%	0.781	75%	0.75	S	S	*	*			trans	-96.2	167.2	-171.3	-66.4	-83.3	0	0	0	114.9
422	T	37.4	Very low	42.1	Very low	128 Å²	128	130.7 Å²	130.7	79%	0.785	75%	0.754	S	S	*	*	S	Bend	trans	50	134.4	148.4	50.2	0	0	0	0	122.7
423	L	30.3	Very low	40	Very low	162 Å²	162	132.9 Å²	132.9	85%	0.848	76%	0.759	S	S	*	*			trans	11.5	127.8	147	-66	169.3	0	0	0	119.6	S425	L423-S425 PolarHBondContact O-N 3.18Å
424	P	38.4	Very low	37.9	Very low	132 Å²	132	134.5 Å²	134.5	86%	0.857	77%	0.766	S	S	*	*			trans	-75.7	126.5	179.5	31.5	-34.5	0	0	0	113.1
425	S	25.7	Very low	36	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	76%	0.757	S	S	*	*			trans	-156.9	133.5	167.2	-167.3	0	0	0	0	113.7	L423	L423-S425 PolarHBondContact O-N 3.18Å
426	S	26.3	Very low	34.5	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	76%	0.755	S	S	*	*			trans	59.3	92.6	151.9	-61.7	0	0	0	0	122.2
427	L	28.1	Very low	33.6	Very low	157 Å²	157	133.7 Å²	133.7	82%	0.822	77%	0.765	S	S	*	*				57.8	126	110.4	-77.2	166.9	0	0	0	122.9
428	K	30.3	Very low	32.6	Very low	191 Å²	191	133.4 Å²	133.4	83%	0.83	76%	0.762	S	S	*	*			trans	101.8	157.7	143.6	-74.6	-170	174.4	-164.3	0	120.9
429	A	32.1	Very low	32	Very low	91 Å²	91	137.4 Å²	137.4	75%	0.752	77%	0.766	S	S	*	*			trans	67.9	108.4	-170.4	0	0	0	0	0	113
430	D	28	Very low	31.4	Very low	139 Å²	139	133.8 Å²	133.8	74%	0.743	76%	0.757	S	S	*	*			cis	78.6	112.3	36.7	-68.1	-50.9	0	0	0	116.7
431	I	31.7	Very low	30.9	Very low	150 Å²	150	131.7 Å²	131.7	77%	0.769	76%	0.755	S	S	*	*			trans	59.8	99	137.9	-50.9	165.3	0	0	0	118.7
432	S	27.9	Very low	31.1	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	76%	0.755	S	S	*	*				175.3	122.3	108.1	58.3	0	0	0	0	109.3
433	K	31.7	Very low	30.7	Very low	168 Å²	168	132.7 Å²	132.7	73%	0.73	76%	0.761	S	S	*	*			cis	94.5	112.4	48.5	-175	-175.4	175	-178.3	0	111.4
434	D	28.8	Very low	30.7	Very low	112 Å²	112	130.5 Å²	130.5	60%	0.599	76%	0.759	S	S	*	*			trans	64	154.2	150.4	-59	13.8	0	0	0	118.7
435	D	30.4	Very low	30.5	Very low	120 Å²	120	132 Å²	132	64%	0.642	75%	0.752	S	S	*	*			cis	-157.7	169	-13.1	-120.1	-17.3	0	0	0	114.9
436	L	31.5	Very low	30.5	Very low	148 Å²	148	132.5 Å²	132.5	78%	0.775	75%	0.746	S	S	*	*			trans	25.2	147	142.3	-61.7	165.7	0	0	0	123.5
437	N	29.3	Very low	30.6	Very low	152 Å²	152	135.2 Å²	135.2	81%	0.813	75%	0.753	S	S	*	*				129.5	106.8	123.5	-158.9	16.6	0	0	0	111.3
438	G	29.5	Very low	30.7	Very low	69 Å²	69	135.1 Å²	135.1	71%	0.711	75%	0.75	S	S	*	*				127.7	168.3	73.7	0	0	0	0	0	107.4
439	E	33.4	Very low	30.5	Very low	140 Å²	140	131 Å²	131	65%	0.654	74%	0.744	S	S	*	*			cis	-156.6	158.4	-5.3	-125.7	-91.9	109.5	0	0	107.6
440	K	30.9	Very low	30.6	Very low	168 Å²	168	132.7 Å²	132.7	73%	0.73	75%	0.745	S	S	*	*			trans	15.3	131.3	170	-70.4	172.9	-170.5	71.7	0	122.2
441	G	29.9	Very low	30.4	Very low	78 Å²	78	133 Å²	133	80%	0.804	75%	0.747	S	S	*	*			trans	-162.9	107.1	151.8	0	0	0	0	0	112.9
442	P	40.8	Very low	30.5	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	75%	0.747	S	S	*	*			trans	-105.9	129	-176.2	35.5	-28.5	0	0	0	113.6
443	L	29.5	Very low	30.9	Very low	174 Å²	174	133 Å²	133	91%	0.911	74%	0.744	S	S	*	*			trans	-158.2	141.1	170.1	-155	66.8	0	0	0	115.4
444	S	31.2	Very low	30.7	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	75%	0.748	S	S	*	*			trans	52.3	144.8	162.6	-141.3	0	0	0	0	122.9
445	K	32.8	Very low	30.6	Very low	164 Å²	164	133.4 Å²	133.4	71%	0.713	75%	0.754	S	S	*	*			trans	-105.4	162.7	166.1	-100.1	170.6	147.6	-80.5	0	110.8
446	D	26.8	Very low	30.3	Very low	118 Å²	118	137.3 Å²	137.3	63%	0.631	77%	0.768	S	S	*	*			trans	25.2	123.4	136.2	-36.3	-26.6	0	0	0	120.9
447	D	28.3	Very low	30.3	Very low	156 Å²	156	138 Å²	138	83%	0.834	77%	0.765	S	S	*	*			trans	159.6	145.9	140.7	-97.3	-15.7	0	0	0	109.1
448	M	29.1	Very low	30	Very low	154 Å²	154	138.1 Å²	138.1	76%	0.759	76%	0.761	S	S	*	*			cis	-139.8	170.2	-12.1	-92.9	-178.2	93.8	0	0	105.8
449	C	28	Very low	29.9	Very low	105 Å²	105	139.1 Å²	139.1	71%	0.709	76%	0.762	S	S	*	*			cis	-156.3	145.1	35.4	-165	0	0	0	0	112.2
450	V	33.8	Very low	29.3	Very low	127 Å²	127	142.3 Å²	142.3	77%	0.77	78%	0.777	S	S	*	*			trans	-102.9	144.3	158.2	-77	0	0	0	0	108.3
451	D	24.2	Very low	29	Very low	145 Å²	145	137.7 Å²	137.7	78%	0.775	78%	0.778	S	S	*	*			trans	-132.8	104.7	164.1	-160.8	-4.5	0	0	0	111.3
452	T	33.1	Very low	28.7	Very low	126 Å²	126	140.2 Å²	140.2	77%	0.773	78%	0.777	S	S	*	*			trans	-150	98.7	168	47.9	0	0	0	0	109.7
453	L	36.2	Very low	28.1	Very low	132 Å²	132	141.5 Å²	141.5	69%	0.691	78%	0.778	S	S	*	*			trans	-119.3	152.1	148.9	-80	87.9	0	0	0	107.2
454	R	27.3	Very low	28	Very low	220 Å²	220	137.2 Å²	137.2	83%	0.83	77%	0.767	S	S	*	*			cis	-146.9	178.3	27.1	-162.3	165.7	-70.6	-87.9	-3.1	111.1
455	G	26.4	Very low	28.2	Very low	69 Å²	69	140.2 Å²	140.2	71%	0.711	77%	0.773	S	S	*	*			trans	-66.2	-167.8	173.3	0	0	0	0	0	114.4
456	Q	25	Very low	28	Very low	203 Å²	203	140.9 Å²	140.9	95%	0.949	78%	0.779	S	S	*	*			cis	-155.5	179	25.4	-172	166.7	-31	0	0	111.5
457	K	30.3	Very low	28.3	Very low	163 Å²	163	139.9 Å²	139.9	71%	0.709	79%	0.787	S	S	*	*			trans	-102.5	154	-179.7	-166.3	-152	170.7	-157.9	0	110.8
458	E	24.3	Very low	28.4	Very low	154 Å²	154	138.3 Å²	138.3	72%	0.72	78%	0.779	S	S	*	*			trans	75.4	149.9	169.2	-52.7	-174.5	-175.5	0	0	116.1
459	A	26.5	Very low	28.7	Very low	90 Å²	90	138.6 Å²	138.6	74%	0.744	78%	0.776	S	S	*	*			cis	-169	173.8	-23.7	0	0	0	0	0	109.7
460	E	21.2	Very low	29	Very low	206 Å²	206	143.4 Å²	143.4	96%	0.963	79%	0.785	S	S	*	*			trans	70	158.7	166.1	-160.7	168.5	-126.5	0	0	117.5
461	G	23.9	Very low	28.7	Very low	72 Å²	72	141.2 Å²	141.2	74%	0.742	79%	0.788	S	S	*	*			trans	125.3	90.4	170.2	0	0	0	0	0	116.1
462	T	24	Very low	28.9	Very low	130 Å²	130	142.1 Å²	142.1	80%	0.798	79%	0.792	S	S	*	*			trans	-70.6	134.5	175	44	0	0	0	0	114.6
463	D	27.5	Very low	28.8	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	79%	0.793	S	S	*	*				169.1	124.3	121.8	-87.4	-14.4	0	0	0	110.1
464	A	28.8	Very low	28.5	Very low	84 Å²	84	136.5 Å²	136.5	69%	0.694	79%	0.791	S	S	*	*				64	123.7	84.4	0	0	0	0	0	112.7
465	L	34.1	Very low	28.9	Very low	177 Å²	177	131 Å²	131	93%	0.927	79%	0.786	S	S	*	*			cis	-134.2	157.2	40.1	-74.3	160	0	0	0	115.5
466	E	29.7	Very low	28.8	Very low	178 Å²	178	136.1 Å²	136.1	83%	0.832	79%	0.79	S	S	*	*			trans	-87.6	146.9	175.9	-87.2	-81	176.7	0	0	113.5
467	A	32.9	Very low	29.5	Very low	97 Å²	97	137.7 Å²	137.7	80%	0.802	79%	0.789	S	S	*	*			trans	-172.3	96.7	145.8	0	0	0	0	0	115.4
468	D	29.1	Very low	29.9	Very low	123 Å²	123	135.8 Å²	135.8	66%	0.658	79%	0.785	S	S	*	*			trans	86.1	143.7	136.3	-156.2	24.7	0	0	0	123
469	K	36	Very low	30.8	Very low	160 Å²	160	134.2 Å²	134.2	70%	0.696	78%	0.782	S	S	*	*			trans	59.4	72.9	161.3	-88.2	162.4	-156.9	72.8	0	122.2
470	K	33.8	Very low	31.9	Very low	207 Å²	207	138.3 Å²	138.3	90%	0.9	79%	0.786	S	S	*	*				55.1	95.3	109.5	-171.4	-176.3	-179.9	178.4	0	117.9
471	G	28.3	Very low	33.3	Very low	81 Å²	81	136.3 Å²	136.3	84%	0.835	78%	0.776	S	S	*	*			trans	-151.3	67.6	167	0	0	0	0	0	113.8	G473	G471-G473 PolarHBondContact O-N 2.9Å
472	N	29.4	Very low	34.6	Very low	163 Å²	163	139.7 Å²	139.7	87%	0.872	78%	0.777	S	S	*	*			trans	-69.9	118.2	178.9	-178.8	18.5	0	0	0	111.6	G474	N472-G474 PolarHBondContact OD1-N 2.84Å
473	G	29	Very low	36	Very low	77 Å²	77	138 Å²	138	79%	0.794	76%	0.763	S	S	*	*			trans	-140.6	42.7	176.5	0	0	0	0	0	112.2	G471	G471-G473 PolarHBondContact O-N 2.9Å
474	G	30.1	Very low	37.6	Very low	63 Å²	63	138 Å²	138	65%	0.649	76%	0.762	S	S	*	*			trans	-56.7	137.2	-178.2	0	0	0	0	0	114	N472	N472-G474 PolarHBondContact OD1-N 2.84Å
475	S	36.1	Very low	39.5	Very low	104 Å²	104	137.9 Å²	137.9	73%	0.727	75%	0.75	S	S	*	*			trans	-59.8	139.1	174.7	178.9	0	0	0	0	112
476	F	25.3	Very low	41.2	Very low	178 Å²	178	134.3 Å²	134.3	78%	0.781	73%	0.729	S	S	*	*			trans	-144.8	75.7	152.1	-139.8	-104.9	0	0	0	111	L478	F476-L478 VanDerWaalsContact C-N 3.25Å; F476-L478 HydrophobicContact CD1-CB 3.61Å; F476-L478 HydrophobicContact CE1-CB 3.38Å; F476-L478 HydrophobicContact CE1-CD2 3.85Å; F476-L478 HydrophobicContact CE1-CG 4.14Å; F476-L478 HydrophobicContact CZ-CB 4.26Å; F476-L478 HydrophobicContact CZ-CD2 4.41Å; F476-L478 PolarHBondContact O-N 3.31Å; F476-L478 VanDerWaalsContact O-N 3.13Å
477	Y	39.8	Very low	42.9	Very low	235 Å²	235	129.3 Å²	129.3	92%	0.922	71%	0.712	S	S	*	*			trans	-74.1	87.3	155.4	-111.7	-90.9	0	0	0	107.5
478	L	38.6	Very low	45.2	Very low	123 Å²	123	127 Å²	127	64%	0.644	69%	0.691	S	S	*	*			trans	-119.2	130.2	159.7	-160.7	79.6	0	0	0	109.2	F476	F476-L478 VanDerWaalsContact C-N 3.25Å; F476-L478 HydrophobicContact CD1-CB 3.61Å; F476-L478 HydrophobicContact CE1-CB 3.38Å; F476-L478 HydrophobicContact CE1-CD2 3.85Å; F476-L478 HydrophobicContact CE1-CG 4.14Å; F476-L478 HydrophobicContact CZ-CB 4.26Å; F476-L478 HydrophobicContact CZ-CD2 4.41Å; F476-L478 PolarHBondContact O-N 3.31Å; F476-L478 VanDerWaalsContact O-N 3.13Å
479	D	43.6	Very low	47.8	Very low	122 Å²	122	126.6 Å²	126.6	65%	0.652	68%	0.68	S	S	*	*			trans	-33.5	129.3	163.8	-169.5	70.8	0	0	0	114.7	E481	D479-E481 WeakPolarHBondContact OD2-CA 3.32Å; D479-E481 WeakPolarHBondContact OD2-CB 3.47Å; D479-E481 PolarHBondContact OD2-N 2.88Å
480	E	48.9	Very low	50	Low	176 Å²	176	121.3 Å²	121.3	82%	0.822	66%	0.663	S	S	*	*			trans	-104.1	59	159	-76.7	-169.1	139.1	0	0	109.1	L482	E480-L482 PolarHBondContact O-N 3.47Å; E480-L482 VanDerWaalsContact O-N 3.13Å
481	E	50	Low	52.6	Low	163 Å²	163	115.8 Å²	115.8	76%	0.762	64%	0.642	S	S	*	*			trans	-55.8	112.2	144.5	179.9	162.4	-116.1	0	0	106.5	D479 D483	D479-E481 WeakPolarHBondContact OD2-CA 3.32Å; D479-E481 WeakPolarHBondContact OD2-CB 3.47Å; D479-E481 PolarHBondContact OD2-N 2.88Å; E481-D483 PolarHBondContact O-N 3.13Å
482	L	51.7	Low	55.6	Low	144 Å²	144	116.7 Å²	116.7	75%	0.754	63%	0.625	S	S	*	*			trans	-68.3	97.2	-178.9	-75.3	173.2	0	0	0	108.7	E480 L484	E480-L482 PolarHBondContact O-N 3.47Å; E480-L482 VanDerWaalsContact O-N 3.13Å; L482-L484 PolarHBondContact O-N 3.44Å
483	D	52.3	Low	58.5	Low	93 Å²	93	113.3 Å²	113.3	50%	0.497	61%	0.606	S	S	.	*			trans	-41.5	122.5	-179.7	-178	3.1	0	0	0	110.9	E481 N485 E486	E481-D483 PolarHBondContact O-N 3.13Å; D483-N485 PolarHBondContact O-N 2.93Å; D483-N485 WeakPolarHBondContact OD1-CB 3.41Å; D483-N485 PolarHBondContact OD1-N 3.4Å; D483-N485 WeakPolarHBondContact OD2-CB 3.2Å; D483-E486 WeakPolarHBondContact O-CB 3.47Å; D483-E486 PolarHBondContact O-N 2.9Å
484	L	62.3	Low	61.4	Low	149 Å²	149	114.4 Å²	114.4	78%	0.78	59%	0.593	S	S	*	*	H	α-helix	trans	-56.4	-25.5	177.7	-73.7	165.1	0	0	0	111.7	L482 C487 S488	L482-L484 PolarHBondContact O-N 3.44Å; L484-C487 WeakPolarHBondContact O-CB 3.47Å; L484-C487 PolarHBondContact O-N 3.16Å; L484-S488 PolarHBondContact O-N 2.9Å
485	N	67.4	Low	64.1	Low	83 Å²	83	115.9 Å²	115.9	44%	0.444	59%	0.586	S	S	.	*	H	α-helix	trans	-62.6	-36.5	172.6	-155.9	15.8	0	0	0	112.6	D483 C487 S488 R489	D483-N485 PolarHBondContact O-N 2.93Å; D483-N485 WeakPolarHBondContact OD1-CB 3.41Å; D483-N485 PolarHBondContact OD1-N 3.4Å; D483-N485 WeakPolarHBondContact OD2-CB 3.2Å; N485-C487 VanDerWaalsContact C-N 3.28Å; N485-C487 PolarHBondContact O-N 2.82Å; N485-S488 PolarHBondContact O-N 3.17Å; N485-R489 VanDerWaalsContact O-CB 3.31Å; N485-R489 WeakPolarHBondContact O-CB 3.48Å; N485-R489 PolarHBondContact O-N 3.17Å
486	E	70.9	Confident	66.9	Low	102 Å²	102	117.4 Å²	117.4	48%	0.477	58%	0.582	S	S	.	*	H	α-helix	trans	-70.5	-28.9	176.1	-166.1	63	-169.4	0	0	111.3	D483 R489 S490	D483-E486 WeakPolarHBondContact O-CB 3.47Å; D483-E486 PolarHBondContact O-N 2.9Å; E486-R489 IonicContact OE2-NE 2.87Å; E486-R489 PolarHBondContact OE2-NE 2.87Å; E486-S490 VanDerWaalsContact O-CB 3.3Å; E486-S490 WeakPolarHBondContact O-CB 3.41Å; E486-S490 PolarHBondContact O-N 2.96Å; E486-S490 PolarHBondContact O-OG 2.83Å
487	C	65.3	Low	70.1	Confident	72 Å²	72	111.1 Å²	111.1	49%	0.486	56%	0.563	S	S	.	*	H	α-helix	trans	-71.5	-43.2	169.4	-157.9	0	0	0	0	111.5	L484 N485 S490 I491	L484-C487 WeakPolarHBondContact O-CB 3.47Å; L484-C487 PolarHBondContact O-N 3.16Å; N485-C487 VanDerWaalsContact C-N 3.28Å; N485-C487 PolarHBondContact O-N 2.82Å; C487-S490 WeakPolarHBondContact O-CB 3.25Å; C487-S490 PolarHBondContact O-N 3.19Å; C487-I491 WeakPolarHBondContact O-CG1 3.38Å; C487-I491 PolarHBondContact O-N 2.9Å
488	S	81.5	Confident	72.5	Confident	50 Å²	50	103.4 Å²	103.4	35%	0.35	54%	0.537	S	S	.	.	H	α-helix	trans	-59.1	-52.1	173.5	-163.7	0	0	0	0	111.3	L484 N485 S490 I491 E492	L484-S488 PolarHBondContact O-N 2.9Å; N485-S488 PolarHBondContact O-N 3.17Å; S488-S490 PolarHBondContact O-N 3.45Å; S488-I491 CarbonylContact O-C 3.59Å; S488-I491 WeakPolarHBondContact O-CA 3.5Å; S488-I491 WeakPolarHBondContact O-CB 3.41Å; S488-I491 PolarHBondContact O-N 3.41Å; S488-E492 WeakPolarHBondContact CB-OE1 3.39Å; S488-E492 WeakPolarHBondContact O-CG 3.26Å; S488-E492 PolarHBondContact O-N 2.85Å; S488-E492 PolarHBondContact OG-OE1 3.29Å
489	R	84.1	Confident	75	Confident	113 Å²	113	99.2 Å²	99.2	43%	0.426	52%	0.523	S	S	.	.	H	α-helix	trans	-55.6	-37	176	-157.7	-167.8	-48.8	-74.1	0.6	112.1	N485 E486 L493	N485-R489 VanDerWaalsContact O-CB 3.31Å; N485-R489 WeakPolarHBondContact O-CB 3.48Å; N485-R489 PolarHBondContact O-N 3.17Å; E486-R489 IonicContact OE2-NE 2.87Å; E486-R489 PolarHBondContact OE2-NE 2.87Å; R489-L493 WeakPolarHBondContact O-CB 3.48Å; R489-L493 WeakPolarHBondContact O-CD1 3.49Å; R489-L493 VanDerWaalsContact O-CG 3.28Å; R489-L493 WeakPolarHBondContact O-CG 3.41Å; R489-L493 PolarHBondContact O-N 2.92Å
490	S	81.4	Confident	77.4	Confident	50 Å²	50	96 Å²	96	35%	0.35	51%	0.511	S	S	.	.	H	α-helix	trans	-70.1	-32.5	174.6	-67.2	0	0	0	0	113.7	E486 C487 S488 L494	E486-S490 VanDerWaalsContact O-CB 3.3Å; E486-S490 WeakPolarHBondContact O-CB 3.41Å; E486-S490 PolarHBondContact O-N 2.96Å; E486-S490 PolarHBondContact O-OG 2.83Å; C487-S490 WeakPolarHBondContact O-CB 3.25Å; C487-S490 PolarHBondContact O-N 3.19Å; S488-S490 PolarHBondContact O-N 3.45Å; S490-L494 WeakPolarHBondContact O-CB 3.29Å; S490-L494 PolarHBondContact O-N 3.25Å
491	I	87.9	Confident	79.6	Confident	90 Å²	90	92.4 Å²	92.4	46%	0.462	50%	0.496	S	S	.	.	H	α-helix	trans	-75.3	-39.9	174.4	-69	162.7	0	0	0	110.5	C487 S488 L494 N495	C487-I491 WeakPolarHBondContact O-CG1 3.38Å; C487-I491 PolarHBondContact O-N 2.9Å; S488-I491 CarbonylContact O-C 3.59Å; S488-I491 WeakPolarHBondContact O-CA 3.5Å; S488-I491 WeakPolarHBondContact O-CB 3.41Å; S488-I491 PolarHBondContact O-N 3.41Å; I491-L494 WeakPolarHBondContact O-CB 3.37Å; I491-L494 PolarHBondContact O-N 3.41Å; I491-N495 WeakPolarHBondContact O-CB 3.48Å; I491-N495 VanDerWaalsContact O-CG 3.29Å; I491-N495 PolarHBondContact O-N 2.81Å; I491-N495 PolarHBondContact O-ND2 2.88Å
492	E	91.6	Very high	81.3	Confident	101 Å²	101	88.6 Å²	88.6	47%	0.472	48%	0.478	S	S	.	.	H	α-helix	trans	-59.6	-50.1	174.1	-70.9	152.8	-137.8	0	0	111.2	S488 L494 N495 E496	S488-E492 WeakPolarHBondContact CB-OE1 3.39Å; S488-E492 WeakPolarHBondContact O-CG 3.26Å; S488-E492 PolarHBondContact O-N 2.85Å; S488-E492 PolarHBondContact OG-OE1 3.29Å; E492-L494 VanDerWaalsContact C-N 3.26Å; E492-L494 PolarHBondContact O-N 2.82Å; E492-N495 PolarHBondContact O-N 2.9Å; E492-N495 VanDerWaalsContact O-N 3.1Å; E492-E496 PolarHBondContact O-N 3.43Å
493	L	90.4	Very high	83.3	Confident	91 Å²	91	87.8 Å²	87.8	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-60.4	-32.1	174.4	-74.5	166.8	0	0	0	113.1	R489 A497	R489-L493 WeakPolarHBondContact O-CB 3.48Å; R489-L493 WeakPolarHBondContact O-CD1 3.49Å; R489-L493 VanDerWaalsContact O-CG 3.28Å; R489-L493 WeakPolarHBondContact O-CG 3.41Å; R489-L493 PolarHBondContact O-N 2.92Å; L493-A497 WeakPolarHBondContact O-CB 3.48Å; L493-A497 PolarHBondContact O-N 3.42Å; L493-A497 VanDerWaalsContact O-N 3.12Å
494	L	90.8	Very high	85.1	Confident	101 Å²	101	89.2 Å²	89.2	53%	0.529	47%	0.474	S	S	.	.	H	α-helix	trans	-72.1	-40.8	174	179.1	60.5	0	0	0	111.5	S490 I491 E492 A497 I498	S490-L494 WeakPolarHBondContact O-CB 3.29Å; S490-L494 PolarHBondContact O-N 3.25Å; I491-L494 WeakPolarHBondContact O-CB 3.37Å; I491-L494 PolarHBondContact O-N 3.41Å; E492-L494 VanDerWaalsContact C-N 3.26Å; E492-L494 PolarHBondContact O-N 2.82Å; L494-A497 PolarHBondContact O-N 2.58Å; L494-I498 HydrophobicContact CD1-CD1 4.13Å; L494-I498 HydrophobicContact CD1-CG1 4.43Å; L494-I498 HydrophobicContact CG-CD1 3.96Å; L494-I498 WeakPolarHBondContact O-CB 3.28Å; L494-I498 VanDerWaalsContact O-CG1 3.26Å; L494-I498 WeakPolarHBondContact O-CG1 3.33Å; L494-I498 PolarHBondContact O-N 3.08Å
495	N	86.6	Confident	86.2	Confident	94 Å²	94	86.1 Å²	86.1	50%	0.503	46%	0.457	S	S	.	.	H	α-helix	trans	-66.8	-39	176.8	-72	-31.3	0	0	0	111.8	I491 E492 I498 G499	I491-N495 WeakPolarHBondContact O-CB 3.48Å; I491-N495 VanDerWaalsContact O-CG 3.29Å; I491-N495 PolarHBondContact O-N 2.81Å; I491-N495 PolarHBondContact O-ND2 2.88Å; E492-N495 PolarHBondContact O-N 2.9Å; E492-N495 VanDerWaalsContact O-N 3.1Å; N495-I498 PolarHBondContact O-N 3.29Å; N495-G499 PolarHBondContact O-N 2.95Å
496	E	93.7	Very high	87.4	Confident	135 Å²	135	88.3 Å²	88.3	63%	0.631	47%	0.466	S	S	*	.	H	α-helix	trans	-61.5	-47.3	172.1	-169.1	-167.9	169.5	0	0	111.2	E492 I498 G499 S500	E492-E496 PolarHBondContact O-N 3.43Å; E496-I498 VanDerWaalsContact C-N 3.33Å; E496-I498 PolarHBondContact O-N 2.85Å; E496-G499 WeakPolarHBondContact O-CA 3.35Å; E496-G499 PolarHBondContact O-N 2.93Å; E496-G499 VanDerWaalsContact O-N 3.12Å; E496-S500 PolarHBondContact O-N 3.34Å
497	A	92.4	Very high	88.3	Confident	46 Å²	46	89.8 Å²	89.8	38%	0.38	47%	0.473	S	S	.	.	H	α-helix	trans	-61.5	-39.5	176.3	0	0	0	0	0	112.5	L493 L494 S500 I501	L493-A497 WeakPolarHBondContact O-CB 3.48Å; L493-A497 PolarHBondContact O-N 3.42Å; L493-A497 VanDerWaalsContact O-N 3.12Å; L494-A497 PolarHBondContact O-N 2.58Å; A497-S500 PolarHBondContact O-N 3.01Å; A497-I501 WeakPolarHBondContact O-CD1 3.37Å; A497-I501 VanDerWaalsContact O-CG1 3.28Å; A497-I501 WeakPolarHBondContact O-CG1 3.16Å; A497-I501 PolarHBondContact O-N 3.23Å
498	I	90.8	Very high	89.5	Confident	73 Å²	73	90.6 Å²	90.6	37%	0.374	47%	0.472	S	S	.	.	H	α-helix	trans	-65.2	-40	173.4	-73	166.3	0	0	0	111	L494 N495 E496 Q502	L494-I498 HydrophobicContact CD1-CD1 4.13Å; L494-I498 HydrophobicContact CD1-CG1 4.43Å; L494-I498 HydrophobicContact CG-CD1 3.96Å; L494-I498 WeakPolarHBondContact O-CB 3.28Å; L494-I498 VanDerWaalsContact O-CG1 3.26Å; L494-I498 WeakPolarHBondContact O-CG1 3.33Å; L494-I498 PolarHBondContact O-N 3.08Å; N495-I498 PolarHBondContact O-N 3.29Å; E496-I498 VanDerWaalsContact C-N 3.33Å; E496-I498 PolarHBondContact O-N 2.85Å; I498-Q502 WeakPolarHBondContact O-CG 3.42Å; I498-Q502 PolarHBondContact O-N 3.18Å
499	G	92.4	Very high	89.8	Confident	35 Å²	35	91.2 Å²	91.2	36%	0.361	48%	0.476	S	S	.	.	H	α-helix	trans	-60.8	-48.3	174	0	0	0	0	0	112.2	N495 E496 I501 Q502 Q503	N495-G499 PolarHBondContact O-N 2.95Å; E496-G499 WeakPolarHBondContact O-CA 3.35Å; E496-G499 PolarHBondContact O-N 2.93Å; E496-G499 VanDerWaalsContact O-N 3.12Å; G499-I501 PolarHBondContact O-N 3.39Å; G499-Q502 PolarHBondContact O-N 2.78Å; G499-Q502 VanDerWaalsContact O-N 3.16Å; G499-Q503 PolarHBondContact O-N 3.4Å
500	S	93.9	Very high	90.1	Very high	56 Å²	56	91.1 Å²	91.1	39%	0.392	48%	0.484	S	S	.	.	H	α-helix	trans	-58.3	-47	176.1	-175	0	0	0	0	112.3	E496 A497 Q502 Q503 Q504	E496-S500 PolarHBondContact O-N 3.34Å; A497-S500 PolarHBondContact O-N 3.01Å; S500-Q502 VanDerWaalsContact C-N 3.32Å; S500-Q502 PolarHBondContact O-N 2.92Å; S500-Q503 PolarHBondContact O-N 3.16Å; S500-Q504 WeakPolarHBondContact O-CG 3.46Å; S500-Q504 PolarHBondContact O-N 3.01Å
501	I	94.6	Very high	90.3	Very high	99 Å²	99	94.8 Å²	94.8	51%	0.508	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-39.6	175.7	-69.8	165.1	0	0	0	111.5	A497 G499 M505	A497-I501 WeakPolarHBondContact O-CD1 3.37Å; A497-I501 VanDerWaalsContact O-CG1 3.28Å; A497-I501 WeakPolarHBondContact O-CG1 3.16Å; A497-I501 PolarHBondContact O-N 3.23Å; G499-I501 PolarHBondContact O-N 3.39Å; I501-M505 HydrophobicContact CG2-CE 4.37Å; I501-M505 WeakPolarHBondContact O-CB 3.43Å; I501-M505 PolarHBondContact O-N 3.09Å
502	Q	85.1	Confident	89.8	Confident	83 Å²	83	96 Å²	96	39%	0.388	50%	0.499	S	S	.	.	H	α-helix	trans	-69.5	-36.6	176.5	-73.6	-171.5	73	0	0	112.7	I498 G499 S500 M505 M506	I498-Q502 WeakPolarHBondContact O-CG 3.42Å; I498-Q502 PolarHBondContact O-N 3.18Å; G499-Q502 PolarHBondContact O-N 2.78Å; G499-Q502 VanDerWaalsContact O-N 3.16Å; S500-Q502 VanDerWaalsContact C-N 3.32Å; S500-Q502 PolarHBondContact O-N 2.92Å; Q502-M505 PolarHBondContact O-N 3.33Å; Q502-M506 WeakPolarHBondContact O-CB 3.3Å; Q502-M506 PolarHBondContact O-N 3.42Å
503	Q	93	Very high	89.4	Confident	127 Å²	127	95.3 Å²	95.3	59%	0.593	50%	0.495	S	S	*	.	H	α-helix	trans	-66.1	-45	175	-168.9	178.4	38.1	0	0	111.4	G499 S500 M505 M506 Q507	G499-Q503 PolarHBondContact O-N 3.4Å; S500-Q503 PolarHBondContact O-N 3.16Å; Q503-M505 VanDerWaalsContact C-N 3.34Å; Q503-M505 PolarHBondContact O-N 2.88Å; Q503-M506 PolarHBondContact O-N 3.47Å; Q503-Q507 WeakPolarHBondContact O-CB 3.35Å; Q503-Q507 PolarHBondContact O-N 2.87Å
504	Q	91.2	Very high	88.7	Confident	123 Å²	123	96.9 Å²	96.9	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-60.5	-42.1	173.7	-73.5	-176.4	-14.9	0	0	112.1	S500 M506 Q507 L508	S500-Q504 WeakPolarHBondContact O-CG 3.46Å; S500-Q504 PolarHBondContact O-N 3.01Å; Q504-M506 VanDerWaalsContact C-N 3.35Å; Q504-M506 PolarHBondContact O-N 3.29Å; Q504-Q507 PolarHBondContact O-N 3.49Å; Q504-L508 WeakPolarHBondContact O-CB 3.48Å; Q504-L508 PolarHBondContact O-N 2.97Å
505	M	85.8	Confident	88.1	Confident	85 Å²	85	97.9 Å²	97.9	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-40.3	177.4	-164.8	-173.3	-46.5	0	0	112	I501 Q502 Q503 S509	I501-M505 HydrophobicContact CG2-CE 4.37Å; I501-M505 WeakPolarHBondContact O-CB 3.43Å; I501-M505 PolarHBondContact O-N 3.09Å; Q502-M505 PolarHBondContact O-N 3.33Å; Q503-M505 VanDerWaalsContact C-N 3.34Å; Q503-M505 PolarHBondContact O-N 2.88Å; M505-S509 PolarHBondContact O-N 3.1Å; M505-S509 PolarHBondContact O-OG 3.49Å
506	M	91.9	Very high	87.2	Confident	128 Å²	128	100.1 Å²	100.1	63%	0.631	52%	0.516	S	S	*	.	H	α-helix	trans	-67.4	-42.4	175.1	-175.8	-179	74.3	0	0	112.2	Q502 Q503 Q504 L508 S509 L510	Q502-M506 WeakPolarHBondContact O-CB 3.3Å; Q502-M506 PolarHBondContact O-N 3.42Å; Q503-M506 PolarHBondContact O-N 3.47Å; Q504-M506 VanDerWaalsContact C-N 3.35Å; Q504-M506 PolarHBondContact O-N 3.29Å; M506-L508 VanDerWaalsContact C-N 3.34Å; M506-S509 WeakPolarHBondContact CA-OG 3.29Å; M506-S509 PolarHBondContact O-N 2.82Å; M506-S509 PolarHBondContact O-OG 2.88Å; M506-L510 WeakPolarHBondContact O-CB 3.09Å; M506-L510 PolarHBondContact O-N 3.43Å
507	Q	89.1	Confident	86	Confident	134 Å²	134	100.2 Å²	100.2	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-65.1	-39.3	177.5	-167.5	175.5	25.7	0	0	111.4	Q503 Q504 L510 Q511	Q503-Q507 WeakPolarHBondContact O-CB 3.35Å; Q503-Q507 PolarHBondContact O-N 2.87Å; Q504-Q507 PolarHBondContact O-N 3.49Å; Q507-L510 PolarHBondContact O-N 2.92Å; Q507-Q511 WeakPolarHBondContact O-CB 3.42Å; Q507-Q511 PolarHBondContact O-N 2.85Å
508	L	91.4	Very high	84.6	Confident	89 Å²	89	104.9 Å²	104.9	47%	0.466	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-41.2	173.9	-175.9	64.1	0	0	0	112.1	Q504 M506 L510 Q511 Q512	Q504-L508 WeakPolarHBondContact O-CB 3.48Å; Q504-L508 PolarHBondContact O-N 2.97Å; M506-L508 VanDerWaalsContact C-N 3.34Å; L508-L510 VanDerWaalsContact C-N 3.35Å; L508-Q511 PolarHBondContact O-N 3.48Å; L508-Q512 WeakPolarHBondContact O-CG 3.49Å; L508-Q512 PolarHBondContact O-N 2.86Å
509	S	88.6	Confident	82.6	Confident	62 Å²	62	108.4 Å²	108.4	43%	0.434	55%	0.548	S	S	.	.	H	α-helix	trans	-65.8	-37.2	174.9	57.6	0	0	0	0	112.3	M505 M506 Q512 E513	M505-S509 PolarHBondContact O-N 3.1Å; M505-S509 PolarHBondContact O-OG 3.49Å; M506-S509 WeakPolarHBondContact CA-OG 3.29Å; M506-S509 PolarHBondContact O-N 2.82Å; M506-S509 PolarHBondContact O-OG 2.88Å; S509-Q512 PolarHBondContact O-N 3.33Å; S509-E513 WeakPolarHBondContact O-CB 3.38Å; S509-E513 PolarHBondContact O-N 2.9Å
510	L	89.3	Confident	80.6	Confident	112 Å²	112	112.8 Å²	112.8	59%	0.586	57%	0.568	S	S	*	*	H	α-helix	trans	-68.4	-37.2	175.8	-168.5	70.6	0	0	0	111.5	M506 Q507 L508 E513 M514	M506-L510 WeakPolarHBondContact O-CB 3.09Å; M506-L510 PolarHBondContact O-N 3.43Å; Q507-L510 PolarHBondContact O-N 2.92Å; L508-L510 VanDerWaalsContact C-N 3.35Å; L510-E513 PolarHBondContact O-N 2.75Å; L510-M514 WeakPolarHBondContact O-CB 3.39Å; L510-M514 PolarHBondContact O-N 3.03Å
511	Q	86	Confident	78.8	Confident	126 Å²	126	118.6 Å²	118.6	59%	0.589	59%	0.588	S	S	*	*	H	α-helix	trans	-63.1	-42.2	172.4	-174.7	179.5	63.3	0	0	111.5	Q507 L508 L515	Q507-Q511 WeakPolarHBondContact O-CB 3.42Å; Q507-Q511 PolarHBondContact O-N 2.85Å; L508-Q511 PolarHBondContact O-N 3.48Å; Q511-L515 WeakPolarHBondContact O-CB 3.3Å; Q511-L515 PolarHBondContact O-N 2.8Å
512	Q	76.3	Confident	75.9	Confident	115 Å²	115	119.1 Å²	119.1	54%	0.537	60%	0.601	S	S	.	*	H	α-helix	trans	-64.6	-43.2	173.9	-73.2	178.7	-5.3	0	0	112.1	L508 S509 L515 M516	L508-Q512 WeakPolarHBondContact O-CG 3.49Å; L508-Q512 PolarHBondContact O-N 2.86Å; S509-Q512 PolarHBondContact O-N 3.33Å; Q512-L515 PolarHBondContact O-N 3.28Å; Q512-M516 WeakPolarHBondContact O-CG 3.44Å; Q512-M516 PolarHBondContact O-N 3.24Å
513	E	84.7	Confident	73.8	Confident	87 Å²	87	120.6 Å²	120.6	41%	0.407	62%	0.618	S	S	.	*	H	α-helix	trans	-63.3	-42.7	177.3	-167.6	-169.5	155.8	0	0	111.8	S509 L510 M516 K517	S509-E513 WeakPolarHBondContact O-CB 3.38Å; S509-E513 PolarHBondContact O-N 2.9Å; L510-E513 PolarHBondContact O-N 2.75Å; E513-M516 PolarHBondContact O-N 3Å; E513-K517 HydrophobicContact CG-CD 4.26Å; E513-K517 WeakPolarHBondContact O-CB 3.27Å; E513-K517 WeakPolarHBondContact O-CG 3.31Å; E513-K517 PolarHBondContact O-N 2.9Å; E513-K517 VanDerWaalsContact OE1-CE 3.27Å; E513-K517 WeakPolarHBondContact OE1-CE 3.33Å; E513-K517 IonicContact OE1-NZ 3.83Å; E513-K517 PolarHBondContact OE1-NZ 2.9Å
514	M	75.7	Confident	71.4	Confident	125 Å²	125	121 Å²	121	62%	0.616	63%	0.632	S	S	*	*	H	α-helix	trans	-64.5	-41.6	176.3	-166.5	176.1	76.8	0	0	111.4	L510 M516 K517 Q518	L510-M514 WeakPolarHBondContact O-CB 3.39Å; L510-M514 PolarHBondContact O-N 3.03Å; M514-M516 VanDerWaalsContact C-N 3.34Å; M514-M516 PolarHBondContact O-N 3.41Å; M514-K517 PolarHBondContact O-N 2.9Å; M514-Q518 VanDerWaalsContact O-CB 3.3Å; M514-Q518 WeakPolarHBondContact O-CB 3.42Å; M514-Q518 PolarHBondContact O-N 3.42Å
515	L	78.1	Confident	68.5	Low	121 Å²	121	121 Å²	121	63%	0.634	64%	0.644	S	S	*	*	H	α-helix	trans	-64.3	-37.6	175.2	-163.6	75.6	0	0	0	112	Q511 Q512 N519	Q511-L515 WeakPolarHBondContact O-CB 3.3Å; Q511-L515 PolarHBondContact O-N 2.8Å; Q512-L515 PolarHBondContact O-N 3.28Å; L515-N519 PolarHBondContact O-N 3.02Å
516	M	67.1	Low	66.1	Low	142 Å²	142	121.4 Å²	121.4	70%	0.7	66%	0.66	S	S	*	*	H	α-helix	trans	-68.6	-41.3	174	-74.1	-174.9	69.4	0	0	112.3	Q512 E513 M514 N519	Q512-M516 WeakPolarHBondContact O-CG 3.44Å; Q512-M516 PolarHBondContact O-N 3.24Å; E513-M516 PolarHBondContact O-N 3Å; M514-M516 VanDerWaalsContact C-N 3.34Å; M514-M516 PolarHBondContact O-N 3.41Å; M516-N519 PolarHBondContact O-N 2.86Å
517	K	69.3	Low	63.2	Low	136 Å²	136	121.7 Å²	121.7	59%	0.591	67%	0.67	S	S	*	*	H	α-helix	trans	-68.1	-40.2	177.6	-77.7	174.5	168.4	173.5	0	112.5	E513 M514 N519 V520	E513-K517 HydrophobicContact CG-CD 4.26Å; E513-K517 WeakPolarHBondContact O-CB 3.27Å; E513-K517 WeakPolarHBondContact O-CG 3.31Å; E513-K517 PolarHBondContact O-N 2.9Å; E513-K517 VanDerWaalsContact OE1-CE 3.27Å; E513-K517 WeakPolarHBondContact OE1-CE 3.33Å; E513-K517 IonicContact OE1-NZ 3.83Å; E513-K517 PolarHBondContact OE1-NZ 2.9Å; M514-K517 PolarHBondContact O-N 2.9Å; K517-N519 PolarHBondContact O-N 3.09Å; K517-V520 PolarHBondContact O-N 3.38Å
518	Q	61.4	Low	60.6	Low	144 Å²	144	120.5 Å²	120.5	67%	0.673	67%	0.673	S	S	*	*	H	α-helix	trans	-63.8	-25.2	177.5	-169.2	172.5	9.1	0	0	112.7	M514 V520	M514-Q518 VanDerWaalsContact O-CB 3.3Å; M514-Q518 WeakPolarHBondContact O-CB 3.42Å; M514-Q518 PolarHBondContact O-N 3.42Å; Q518-V520 VanDerWaalsContact C-N 3.33Å; Q518-V520 PolarHBondContact O-N 2.74Å
519	N	50.7	Low	58	Low	148 Å²	148	121.9 Å²	121.9	79%	0.791	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	10.6	-179.6	-153.7	6.5	0	0	0	114.2	L515 M516 K517	L515-N519 PolarHBondContact O-N 3.02Å; M516-N519 PolarHBondContact O-N 2.86Å; K517-N519 PolarHBondContact O-N 3.09Å
520	V	50.4	Low	55.8	Low	126 Å²	126	124.4 Å²	124.4	76%	0.764	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	-6.6	177.8	176.8	0	0	0	0	112.2	K517 Q518	K517-V520 PolarHBondContact O-N 3.38Å; Q518-V520 VanDerWaalsContact C-N 3.33Å; Q518-V520 PolarHBondContact O-N 2.74Å
521	Q	55	Low	53.4	Low	178 Å²	178	124 Å²	124	83%	0.832	71%	0.707	S	S	*	*			trans	-136.8	80.6	-171.9	-159.2	142.3	46.1	0	0	113.3
522	S	34.1	Very low	50.9	Low	110 Å²	110	127 Å²	127	77%	0.769	72%	0.72	S	S	*	*			trans	-104	146.6	163.1	52.1	0	0	0	0	110.9
523	P	40.2	Very low	48.9	Very low	115 Å²	115	126.7 Å²	126.7	75%	0.747	74%	0.737	S	S	*	*			trans	-77.3	155.4	-177.8	-13	29.7	0	0	0	112.8	C525	P523-C525 PolarHBondContact O-N 3.23Å
524	P	44.2	Very low	46.5	Very low	136 Å²	136	126.3 Å²	126.3	88%	0.883	76%	0.757	S	S	*	*			trans	-72.6	126.1	172.6	30.4	-33.2	0	0	0	110.7
525	C	28.3	Very low	44.4	Very low	123 Å²	123	126.6 Å²	126.6	83%	0.831	76%	0.761	S	S	*	*			trans	-139.2	125.8	173.2	-164.3	0	0	0	0	112.5	P523	P523-C525 PolarHBondContact O-N 3.23Å
526	A	35.5	Very low	42.5	Very low	92 Å²	92	128.8 Å²	128.8	76%	0.76	77%	0.765	S	S	*	*			trans	11.6	118.5	163.6	0	0	0	0	0	120.4
527	T	31.3	Very low	40.9	Very low	135 Å²	135	130.3 Å²	130.3	83%	0.828	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-85.4	135.7	149.8	-46.5	0	0	0	0	109.2
528	P	34.7	Very low	39.2	Very low	108 Å²	108	127.2 Å²	127.2	70%	0.701	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-76.8	153.2	173.6	31.9	-35.2	0	0	0	112.3
529	P	37.5	Very low	37.9	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-85.2	153.5	-178.6	34.2	-35.5	0	0	0	113.6
530	P	41.4	Very low	37.2	Very low	115 Å²	115	125.2 Å²	125.2	75%	0.747	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-80.6	161.2	166.8	35	-34.7	0	0	0	112
531	P	39.8	Very low	36.4	Very low	104 Å²	104	128.1 Å²	128.1	68%	0.675	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.9	143.3	179.2	33.4	-34.4	0	0	0	113.1
532	H	32.9	Very low	35.4	Very low	188 Å²	188	125.9 Å²	125.9	87%	0.87	79%	0.786	S	S	*	*				170.4	165.7	115.5	-88.7	-66.3	0	0	0	111.5
533	A	35.4	Very low	35.1	Very low	108 Å²	108	124.2 Å²	124.2	89%	0.893	79%	0.786	S	S	*	*			trans	-71.8	151.5	-163.9	0	0	0	0	0	115.2
534	G	32.9	Very low	34.6	Very low	80 Å²	80	121.7 Å²	121.7	83%	0.825	78%	0.78	S	S	*	*			trans	175.3	96.7	175.3	0	0	0	0	0	114
535	D	32.8	Very low	33.8	Very low	130 Å²	130	124.5 Å²	124.5	70%	0.695	78%	0.779	S	S	*	*			trans	-36.3	148.6	175	-128.7	-9.4	0	0	0	118.9
536	K	37.4	Very low	34	Very low	167 Å²	167	126.8 Å²	126.8	73%	0.726	78%	0.777	S	S	*	*			trans	70.2	110.3	147	-70.2	153.5	-175.4	150.7	0	122.8
537	N	33.5	Very low	33.6	Very low	174 Å²	174	130.7 Å²	130.7	93%	0.93	78%	0.777	S	S	*	*				74.4	149.6	119.9	-158.2	32.9	0	0	0	119.7
538	G	34.1	Very low	33.6	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	77%	0.769	S	S	*	*			trans	125.8	107.1	161.8	0	0	0	0	0	117.2
539	D	33.3	Very low	33.2	Very low	155 Å²	155	131 Å²	131	83%	0.829	77%	0.768	S	S	*	*			trans	-62.5	152.7	177.5	-109.9	-63.2	0	0	0	118.1
540	S	37.6	Very low	33	Very low	94 Å²	94	132.5 Å²	132.5	66%	0.657	76%	0.764	S	S	*	*			trans	83.9	119.7	132.4	78.2	0	0	0	0	124.3
541	K	33	Very low	32.4	Very low	188 Å²	188	134.4 Å²	134.4	82%	0.817	77%	0.767	S	S	*	*				83	150.4	113.5	-167.4	178.7	-175.1	-180	0	121.8
542	T	34	Very low	31.9	Very low	131 Å²	131	135.1 Å²	135.1	80%	0.804	77%	0.774	S	S	*	*			trans	69.1	145.2	172.7	11.7	0	0	0	0	115.3
543	G	28.3	Very low	31.6	Very low	74 Å²	74	130 Å²	130	76%	0.763	77%	0.772	S	S	*	*			cis	97.1	131.6	10.8	0	0	0	0	0	111.4
544	G	29.3	Very low	31.4	Very low	62 Å²	62	131.2 Å²	131.2	64%	0.639	78%	0.775	S	S	*	*			cis	-174.6	-149	2.1	0	0	0	0	0	110
545	F	27.8	Very low	31.1	Very low	196 Å²	196	130.7 Å²	130.7	86%	0.86	77%	0.769	S	S	*	*			trans	70.6	123.2	174.7	-64.5	-89.9	0	0	0	115.7
546	H	30.5	Very low	31.1	Very low	171 Å²	171	130.4 Å²	130.4	79%	0.792	78%	0.777	S	S	*	*				69.2	115.1	73.7	-89.8	-85	0	0	0	114.8
547	F	27.8	Very low	31	Very low	173 Å²	173	126.7 Å²	126.7	76%	0.759	78%	0.778	S	S	*	*				-167.1	179.4	97.4	-165.6	-116.4	0	0	0	110.8	E549	F547-E549 HydrophobicContact CE1-CB 4.48Å
548	V	32.3	Very low	31.4	Very low	109 Å²	109	123.7 Å²	123.7	66%	0.661	77%	0.767	S	S	*	*			trans	-109.6	-179.6	-178.4	176.3	0	0	0	0	109.2
549	E	25.4	Very low	31.3	Very low	142 Å²	142	126.4 Å²	126.4	66%	0.664	77%	0.77	S	S	*	*			trans	138	84.1	147.5	-157.2	84.9	-116.2	0	0	114.2	F547	F547-E549 HydrophobicContact CE1-CB 4.48Å
550	H	33.3	Very low	31.4	Very low	150 Å²	150	130.6 Å²	130.6	69%	0.694	77%	0.774	S	S	*	*			trans	50.6	144.6	137.3	-68.2	-83.5	0	0	0	125.2
551	L	29.2	Very low	31.4	Very low	155 Å²	155	135.9 Å²	135.9	81%	0.812	79%	0.785	S	S	*	*			trans	85.8	106.1	153.2	-67.6	156.1	0	0	0	122.2
552	S	29.3	Very low	31.7	Very low	118 Å²	118	132.7 Å²	132.7	83%	0.825	78%	0.784	S	S	*	*				42.4	116.1	128.4	-54.4	0	0	0	0	122.7
553	G	27.3	Very low	31.9	Very low	81 Å²	81	131.8 Å²	131.8	84%	0.835	78%	0.78	S	S	*	*			trans	163.5	119.2	153.1	0	0	0	0	0	117
554	S	29.6	Very low	32.5	Very low	134 Å²	134	137.7 Å²	137.7	94%	0.937	79%	0.785	S	S	*	*			trans	-53.7	148.8	172.4	-175.7	0	0	0	0	114
555	G	28.3	Very low	32.7	Very low	68 Å²	68	139.7 Å²	139.7	70%	0.701	78%	0.78	S	S	*	*			cis	153.2	156.8	-0.8	0	0	0	0	0	112.3
556	S	32.4	Very low	32.7	Very low	125 Å²	125	133.8 Å²	133.8	87%	0.874	76%	0.763	S	S	*	*			trans	-156.9	153.4	175.1	60.8	0	0	0	0	113.1
557	A	34.8	Very low	32.7	Very low	89 Å²	89	130.5 Å²	130.5	74%	0.736	76%	0.76	S	S	*	*			trans	-98.6	160.9	172.2	0	0	0	0	0	110.4
558	P	42.4	Very low	32.9	Very low	110 Å²	110	126 Å²	126	71%	0.714	76%	0.762	S	S	*	*				-156.8	138.4	93.3	37.3	-17.1	0	0	0	118.4
559	T	31.7	Very low	33.1	Very low	129 Å²	129	132.2 Å²	132.2	79%	0.791	77%	0.774	S	S	*	*			trans	65.9	160.4	138.7	68.6	0	0	0	0	123.3
560	R	35.4	Very low	33.3	Very low	244 Å²	244	130.1 Å²	130.1	92%	0.921	78%	0.775	S	S	*	*			trans	68.6	113.6	164.6	-73	-175.8	163.3	-177.7	-5.4	119.4
561	K	37.8	Very low	33.3	Very low	204 Å²	204	127.7 Å²	127.7	89%	0.887	77%	0.774	S	S	*	*			trans	-88.6	149.5	163.2	-56	164.6	-177.1	166.7	0	108.4
562	P	39.3	Very low	33.5	Very low	122 Å²	122	130.3 Å²	130.3	79%	0.792	77%	0.774	S	S	*	*				-152.1	-168	87.1	41.2	-23.2	0	0	0	113.3
563	P	37.7	Very low	33.7	Very low	112 Å²	112	129 Å²	129	73%	0.727	76%	0.764	S	S	*	*			cis	-115.4	155.9	-40	32.6	-19.5	0	0	0	112.4
564	K	40	Very low	33.9	Very low	198 Å²	198	132.4 Å²	132.4	86%	0.861	76%	0.756	S	S	*	*			trans	-78.6	137.3	162.8	-66.2	178.2	176.4	-178.6	0	110
565	L	33.4	Very low	34.4	Very low	103 Å²	103	131.5 Å²	131.5	54%	0.539	75%	0.747	S	S	.	*			trans	-166.1	144.4	143.1	-72.2	-171.1	0	0	0	109.8	R343 L344	R343-L565 HydrophobicContact CB-CD1 4.44Å; R343-L565 VanDerWaalsContact CD-CD1 3.43Å; R343-L565 VanDerWaalsContact CD-CD2 3.41Å; L344-L565 HydrophobicContact CB-CD1 4.33Å; L344-L565 HydrophobicContact CD2-CD1 3.93Å; L344-L565 HydrophobicContact CD2-CD2 4.26Å; L344-L565 HydrophobicContact CD2-CG 4.16Å
566	S	28.8	Very low	34.5	Very low	72 Å²	72	134.1 Å²	134.1	50%	0.503	76%	0.755	S	S	.	*			cis	-164.3	138.1	-36.9	64	0	0	0	0	112.8	R343	R343-S566 PolarHBondContact NE-OG 3.48Å; R343-S566 VanDerWaalsContact NH2-CB 3.3Å; R343-S566 PolarHBondContact NH2-OG 3.15Å; R343-S566 VanDerWaalsContact NH2-OG 3.1Å
567	S	31.1	Very low	34.3	Very low	103 Å²	103	136.4 Å²	136.4	72%	0.72	75%	0.751	S	S	*	*			trans	52.2	97.2	141.2	179	0	0	0	0	122.2
568	G	30.4	Very low	34	Very low	79 Å²	79	138.2 Å²	138.2	81%	0.814	75%	0.748	S	S	*	*			trans	68.3	-178.6	138.4	0	0	0	0	0	117.7
569	R	37.3	Very low	33.4	Very low	239 Å²	239	141.1 Å²	141.1	90%	0.902	75%	0.749	S	S	*	*			cis	-135	-180	-9.9	-61.4	177.9	168.3	179.7	-5	106.3
570	S	29.7	Very low	33.2	Very low	98 Å²	98	142.6 Å²	142.6	69%	0.685	75%	0.752	S	S	*	*			cis	-168.6	169.3	22.6	-165.9	0	0	0	0	111
571	S	33.1	Very low	32.8	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	75%	0.746	S	S	*	*			trans	11.2	141.6	148	61.1	0	0	0	0	120.1
572	R	33.9	Very low	32.5	Very low	211 Å²	211	134 Å²	134	80%	0.796	74%	0.739	S	S	*	*				-176	148.1	51	-159.2	-174.4	170.7	152.9	-3.2	112.9
573	S	32.6	Very low	32	Very low	89 Å²	89	134.9 Å²	134.9	62%	0.622	73%	0.733	S	S	*	*			trans	2.7	147.9	160.7	66.1	0	0	0	0	123.5
574	K	32.8	Very low	31.6	Very low	154 Å²	154	138.4 Å²	138.4	67%	0.67	74%	0.739	S	S	*	*			trans	-153	168.1	130.2	-107.2	177.7	177.8	-172.5	0	110.8
575	P	39.1	Very low	31.1	Very low	114 Å²	114	134.3 Å²	134.3	74%	0.74	74%	0.736	S	S	*	*			trans	-104.4	-179.3	-149	41.2	-40.8	0	0	0	116.3
576	S	31.6	Very low	31	Very low	124 Å²	124	140.4 Å²	140.4	87%	0.867	75%	0.752	S	S	*	*			trans	-150.3	142.4	163.2	-52.1	0	0	0	0	111.2
577	E	27.5	Very low	31.8	Very low	172 Å²	172	142 Å²	142	80%	0.804	76%	0.76	S	S	*	*			trans	-108	168.7	170.7	-80.3	-165.3	90.7	0	0	111.5
578	L	28.1	Very low	31.7	Very low	128 Å²	128	141.1 Å²	141.1	67%	0.67	76%	0.759	S	S	*	*			trans	60	118.6	148.3	-71.4	159.2	0	0	0	121.3
579	K	29.4	Very low	31.7	Very low	170 Å²	170	142.6 Å²	142.6	74%	0.739	76%	0.757	S	S	*	*			trans	84.1	115.7	130.7	-75.8	-178.7	171.3	176.8	0	123
580	L	27.8	Very low	31.4	Very low	160 Å²	160	143.4 Å²	143.4	84%	0.838	76%	0.76	S	S	*	*				54.3	106.6	117.4	-57.5	172.6	0	0	0	121.2
581	A	28.1	Very low	31.4	Very low	97 Å²	97	142.9 Å²	142.9	80%	0.802	76%	0.761	S	S	*	*				-157.5	140.1	129.2	0	0	0	0	0	108.2
582	K	30.1	Very low	31.1	Very low	171 Å²	171	146.4 Å²	146.4	74%	0.743	77%	0.772	S	S	*	*			cis	77.4	129	35.3	-172.6	171.5	-176	-175.8	0	111.5
583	E	28.8	Very low	31.2	Very low	140 Å²	140	142.5 Å²	142.5	65%	0.654	77%	0.771	S	S	*	*			cis	-138.6	158.8	6.1	-154.2	148.2	-143.5	0	0	107.8
584	Q	30.2	Very low	31.5	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	78%	0.778	S	S	*	*				-176.7	157.3	74.4	-74.7	-175.2	7	0	0	108.8
585	S	30	Very low	31.1	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	78%	0.783	S	S	*	*			cis	-141.7	-177.7	-0.7	57.9	0	0	0	0	111.6
586	R	31.4	Very low	30.6	Very low	232 Å²	232	146.2 Å²	146.2	88%	0.875	79%	0.79	S	S	*	*			trans	-121	178.4	-176	-114.6	-174.3	175.8	-160	1.4	108.8
587	P	44.4	Very low	30.3	Very low	104 Å²	104	144.3 Å²	144.3	68%	0.675	79%	0.79	S	S	*	*			cis	-138.4	-172.8	-18.9	37.7	-18.8	0	0	0	114.4
588	A	28.8	Very low	30.2	Very low	85 Å²	85	140 Å²	140	70%	0.702	79%	0.793	S	S	*	*			trans	72.9	152	140.9	0	0	0	0	0	120.5
589	S	31.7	Very low	30.1	Very low	110 Å²	110	138.9 Å²	138.9	77%	0.769	80%	0.795	S	S	*	*			cis	-167.9	150	-19.5	-100.5	0	0	0	0	112.8
590	R	29.3	Very low	29.9	Very low	257 Å²	257	138.2 Å²	138.2	97%	0.97	80%	0.795	S	S	*	*			trans	67.2	160.7	157.3	-109.1	175.7	177.4	146.4	-0.6	118.5
591	A	30.5	Very low	29.9	Very low	86 Å²	86	137 Å²	137	71%	0.711	79%	0.794	S	S	*	*			trans	-125.1	150.8	-177.3	0	0	0	0	0	111
592	L	28	Very low	29.8	Very low	173 Å²	173	140.2 Å²	140.2	91%	0.906	80%	0.797	S	S	*	*			trans	-148.2	146.1	159.6	-76.9	-177.4	0	0	0	110
593	T	34.2	Very low	29.6	Very low	128 Å²	128	137.1 Å²	137.1	79%	0.785	80%	0.803	S	S	*	*			trans	-103.9	157.3	147.8	50.4	0	0	0	0	106
594	P	39	Very low	29.6	Very low	119 Å²	119	135.8 Å²	135.8	77%	0.773	81%	0.809	S	S	*	*			cis	-149.7	-171.1	49.7	42.8	-20.7	0	0	0	117.8
595	T	25.6	Very low	29.8	Very low	125 Å²	125	132.1 Å²	132.1	77%	0.767	80%	0.801	S	S	*	*			trans	-44.7	147.6	170.5	-17.5	0	0	0	0	116.7
596	Q	27.3	Very low	29.6	Very low	191 Å²	191	137.3 Å²	137.3	89%	0.893	80%	0.804	S	S	*	*				165.3	149.6	108.4	-85.7	-151.7	23.3	0	0	115.2
597	G	25.2	Very low	29.4	Very low	84 Å²	84	134.3 Å²	134.3	87%	0.866	80%	0.8	S	S	*	*			trans	103.5	132.7	141.1	0	0	0	0	0	119
598	G	26.2	Very low	28.5	Very low	83 Å²	83	137 Å²	137	86%	0.856	81%	0.808	S	S	*	*			trans	143.3	89	160.3	0	0	0	0	0	117.7
599	S	26.6	Very low	28.3	Very low	103 Å²	103	138.1 Å²	138.1	72%	0.72	81%	0.81	S	S	*	*			trans	-30.9	163.6	155.6	-67.9	0	0	0	0	117
600	E	24.7	Very low	28	Very low	157 Å²	157	137 Å²	137	73%	0.734	82%	0.816	S	S	*	*			cis	165.9	-176	-14.4	-101.3	163.2	114	0	0	104.9
601	T	27.6	Very low	27.8	Very low	134 Å²	134	128.1 Å²	128.1	82%	0.822	81%	0.805	S	S	*	*			trans	68.2	151.7	173.3	70.6	0	0	0	0	116.4
602	L	27.1	Very low	27.7	Very low	165 Å²	165	136 Å²	136	86%	0.864	82%	0.816	S	S	*	*			cis	171.7	114.8	-36.3	-119.5	171.3	0	0	0	104.6
603	A	25.2	Very low	27.9	Very low	106 Å²	106	133.1 Å²	133.1	88%	0.876	81%	0.81	S	S	*	*			trans	-159.8	119.7	161.9	0	0	0	0	0	111.9
604	S	28.5	Very low	28.3	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	80%	0.804	S	S	*	*			trans	-149.7	139.5	158.9	179.2	0	0	0	0	106.8
605	P	34.9	Very low	27.7	Very low	109 Å²	109	137.1 Å²	137.1	71%	0.708	81%	0.809	S	S	*	*				-153	149.2	123.1	34.9	-17.4	0	0	0	116.7
606	R	25.6	Very low	27.6	Very low	221 Å²	221	135.9 Å²	135.9	83%	0.834	80%	0.804	S	S	*	*			trans	68.1	133.5	150.5	-66.4	168.4	-172.8	-163.8	0.6	116.9
607	Q	27.1	Very low	27.5	Very low	169 Å²	169	133.7 Å²	133.7	79%	0.79	80%	0.798	S	S	*	*			cis	97	153.6	39.6	-84.9	-167.4	-34.1	0	0	114.2
608	L	26	Very low	27.6	Very low	161 Å²	161	141 Å²	141	84%	0.843	80%	0.8	S	S	*	*			trans	83	147.5	175.1	-49.2	178.5	0	0	0	116.3
609	S	24.8	Very low	27.6	Very low	108 Å²	108	143.5 Å²	143.5	76%	0.755	79%	0.794	S	S	*	*			cis	-171.4	133.4	-32.7	-104.8	0	0	0	0	111.1
610	G	23.7	Very low	28.9	Very low	86 Å²	86	143.8 Å²	143.8	89%	0.887	79%	0.793	S	S	*	*			trans	71.8	161.8	169.5	0	0	0	0	0	116.1
611	G	25	Very low	29.1	Very low	72 Å²	72	142 Å²	142	74%	0.742	79%	0.793	S	S	*	*			cis	125.2	106.8	-10.7	0	0	0	0	0	114.7
612	R	28.6	Very low	29.2	Very low	252 Å²	252	139.9 Å²	139.9	95%	0.951	79%	0.789	S	S	*	*			trans	-177.9	135	154.2	-101	150	-163.7	-94.4	2.1	112
613	S	32.7	Very low	29.3	Very low	111 Å²	111	136 Å²	136	78%	0.776	78%	0.781	S	S	*	*			trans	-116.1	153.2	152.5	166.6	0	0	0	0	107.2
614	P	42.7	Very low	29.5	Very low	100 Å²	100	138.9 Å²	138.9	65%	0.649	78%	0.776	S	S	*	*			trans	-148.9	132.9	138.9	32.6	-14	0	0	0	116.8
615	R	26.3	Very low	29.5	Very low	232 Å²	232	140.9 Å²	140.9	88%	0.875	78%	0.775	S	S	*	*			trans	71.9	159.3	138.8	-61.6	176.4	-169.5	-138.5	0.6	117.2
616	C	24.3	Very low	29.2	Very low	99 Å²	99	142.9 Å²	142.9	67%	0.669	78%	0.777	S	S	*	*			cis	-133.1	154.7	15.5	-114.9	0	0	0	0	113.7
617	D	25.5	Very low	29.2	Very low	144 Å²	144	139 Å²	139	77%	0.77	77%	0.773	S	S	*	*			trans	25.5	148.4	144.6	-43.4	-38	0	0	0	121.4
618	R	25.8	Very low	29.3	Very low	238 Å²	238	141 Å²	141	90%	0.898	77%	0.773	S	S	*	*			cis	-153.9	141.4	24.9	-169.1	167.5	66.2	-159.7	2.8	112.4
619	N	27.1	Very low	29.8	Very low	136 Å²	136	139.4 Å²	139.4	73%	0.727	77%	0.772	S	S	*	*			trans	-122.8	174.4	167.8	-142.2	16	0	0	0	108.3
620	P	53.7	Low	29.8	Very low	108 Å²	108	137.4 Å²	137.4	70%	0.701	77%	0.768	S	S	*	*				-136.9	175.5	63.9	39.7	-22	0	0	0	113.1
621	T	30	Very low	30	Very low	121 Å²	121	139.2 Å²	139.2	74%	0.742	77%	0.768	S	S	*	*			cis	-155.3	174.5	30.2	-21.3	0	0	0	0	107
622	A	29.1	Very low	30.2	Very low	88 Å²	88	138.7 Å²	138.7	73%	0.727	76%	0.762	S	S	*	*			cis	-151.8	-145	8.6	0	0	0	0	0	111.6
623	A	28.7	Very low	30.4	Very low	85 Å²	85	134.9 Å²	134.9	70%	0.702	75%	0.754	S	S	*	*			trans	-58.3	145.9	177.7	0	0	0	0	0	113.2
624	E	28.7	Very low	30.5	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	74%	0.735	S	S	*	*			cis	73.3	142.6	44.7	-60.9	-170.5	162.3	0	0	113.2
625	M	30.1	Very low	30.3	Very low	152 Å²	152	136 Å²	136	75%	0.749	74%	0.736	S	S	*	*			cis	-156.8	156.4	19.6	-145.2	-169.6	-81.3	0	0	114.1
626	M	27.6	Very low	30.5	Very low	152 Å²	152	129.7 Å²	129.7	75%	0.749	73%	0.727	S	S	*	*			trans	61.7	137.6	141.5	-128.1	63.3	-176.2	0	0	127
627	D	25.6	Very low	30.9	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	73%	0.729	S	S	*	*			trans	87.5	161.9	131.2	-111.5	-46.9	0	0	0	126.8
628	R	30.5	Very low	31.5	Very low	212 Å²	212	128.5 Å²	128.5	80%	0.8	73%	0.731	S	S	*	*			trans	-144.5	120.7	-177.8	175.9	-166.2	-179.3	-99	2.5	113.1
629	P	34.9	Very low	31.6	Very low	126 Å²	126	126.7 Å²	126.7	82%	0.818	73%	0.73	S	S	*	*			trans	-119.8	177.9	138.2	2.7	19.7	0	0	0	110.9
630	G	25.5	Very low	31.9	Very low	66 Å²	66	129.9 Å²	129.9	68%	0.68	73%	0.732	S	S	*	*			cis	-178.4	177.9	0.1	0	0	0	0	0	111.7
631	S	28.5	Very low	31	Very low	125 Å²	125	131.8 Å²	131.8	87%	0.874	74%	0.735	S	S	*	*			trans	-70.2	159.5	173.2	-169.4	0	0	0	0	111.7
632	G	28	Very low	30.9	Very low	60 Å²	60	135.1 Å²	135.1	62%	0.619	74%	0.742	S	S	*	*			cis	152.1	178.9	-0.8	0	0	0	0	0	111.5
633	H	34.4	Very low	30.9	Very low	172 Å²	172	137.3 Å²	137.3	80%	0.796	74%	0.741	S	S	*	*			trans	66.4	164	170.7	-82.9	64.5	0	0	0	119.2
634	V	34.2	Very low	31.2	Very low	62 Å²	62	141.4 Å²	141.4	38%	0.376	75%	0.746	S	S	.	*			cis	-169.3	138.1	-48.1	112.1	0	0	0	0	112.2	S151	S151-V634 WeakPolarHBondContact O-CG1 3.45Å
635	R	37.6	Very low	31.4	Very low	174 Å²	174	138.1 Å²	138.1	66%	0.657	75%	0.747	S	S	*	*			trans	58.5	167.7	155	-70.7	-175.8	153.6	-166.9	-6.3	120.3	G150	G150-R635 VanDerWaalsContact O-CD 3.27Å; G150-R635 WeakPolarHBondContact O-CD 3.26Å; G150-R635 PolarHBondContact O-NH1 3.46Å; G150-R635 VanDerWaalsContact O-NH1 3.08Å
636	S	31.4	Very low	31.4	Very low	98 Å²	98	137.4 Å²	137.4	69%	0.685	75%	0.746	S	S	*	*			cis	-171.9	172.5	-24.8	-91.9	0	0	0	0	110.1
637	A	31.9	Very low	31.5	Very low	87 Å²	87	135.7 Å²	135.7	72%	0.719	74%	0.738	S	S	*	*			trans	71.1	135.6	163.1	0	0	0	0	0	117.4
638	T	37.7	Very low	31.7	Very low	132 Å²	132	139.5 Å²	139.5	81%	0.81	74%	0.742	S	S	*	*			cis	91.3	103.9	21.8	71.8	0	0	0	0	117.7
639	F	27.9	Very low	31.7	Very low	200 Å²	200	136.9 Å²	136.9	88%	0.877	74%	0.743	S	S	*	*			trans	-159.1	130.8	143.3	-117.6	-94.4	0	0	0	105.5
640	R	33.9	Very low	32	Very low	203 Å²	203	136.5 Å²	136.5	77%	0.766	74%	0.74	S	S	*	*			cis	85.4	106.2	46.9	-93.5	-161.8	-179.6	-123.9	2	115.6
641	L	35.5	Very low	32.1	Very low	147 Å²	147	138.7 Å²	138.7	77%	0.77	74%	0.741	S	S	*	*			trans	67.6	130.5	144.2	-56.2	173.2	0	0	0	120.6
642	H	27.6	Very low	32.1	Very low	191 Å²	191	143.6 Å²	143.6	88%	0.884	74%	0.74	S	S	*	*				-140.6	167.3	128.6	-149.8	-85.6	0	0	0	109.7
643	D	29	Very low	32.2	Very low	134 Å²	134	146.9 Å²	146.9	72%	0.717	75%	0.748	S	S	*	*			trans	-133.1	174.5	-167.3	-156.3	-4.3	0	0	0	112.3
644	E	34.8	Very low	31.7	Very low	172 Å²	172	146 Å²	146	80%	0.804	75%	0.749	S	S	*	*			trans	65.9	131	168.6	-61.2	-149.7	99	0	0	121
645	A	33	Very low	31.7	Very low	96 Å²	96	150.8 Å²	150.8	79%	0.793	77%	0.772	S	S	*	*				172.7	86.6	109.5	0	0	0	0	0	114.6
646	N	29.8	Very low	31.3	Very low	138 Å²	138	147.1 Å²	147.1	74%	0.738	78%	0.778	S	S	*	*			trans	27.1	151	133.4	-145.8	-0.1	0	0	0	124.5
647	M	29.8	Very low	30.9	Very low	115 Å²	115	148.6 Å²	148.6	57%	0.567	79%	0.788	S	S	*	*			trans	97.5	112.8	152.7	-55.4	-86.1	66.3	0	0	123.9
648	R	30.9	Very low	31	Very low	219 Å²	219	150.3 Å²	150.3	83%	0.826	79%	0.789	S	S	*	*			trans	69.9	137	132	-82.6	168.2	173	123.2	-1.7	124.4
649	L	29.4	Very low	31.2	Very low	157 Å²	157	150.1 Å²	150.1	82%	0.822	79%	0.79	S	S	*	*			trans	-65	164.5	161.8	-72	165.3	0	0	0	111.7
650	P	41.2	Very low	31.3	Very low	118 Å²	118	144.7 Å²	144.7	77%	0.766	78%	0.782	S	S	*	*				-157.4	153.6	53.7	43.1	-20.5	0	0	0	122.3
651	T	27.2	Very low	31.9	Very low	112 Å²	112	141 Å²	141	69%	0.687	78%	0.784	S	S	*	*				47.4	111.3	121.8	-44	0	0	0	0	125
652	R	29.9	Very low	31.6	Very low	228 Å²	228	142.2 Å²	142.2	86%	0.86	79%	0.786	S	S	*	*			trans	75.3	154.7	137.4	-82.3	-178.5	165.3	172.7	-4.4	124.7
653	V	28.9	Very low	32.6	Very low	130 Å²	130	138.9 Å²	138.9	79%	0.788	78%	0.781	S	S	*	*			trans	59.3	154.2	166.9	-85.5	0	0	0	0	118.1
654	D	23.9	Very low	32.6	Very low	154 Å²	154	140.3 Å²	140.3	82%	0.824	79%	0.788	S	S	*	*			cis	-142.3	-177.2	9	-141.8	-23.8	0	0	0	114.8
655	L	34.5	Very low	32	Very low	161 Å²	161	135.4 Å²	135.4	84%	0.843	78%	0.784	S	S	*	*			trans	-111.6	147.3	-169.9	-166	79.5	0	0	0	113.4
656	A	28.6	Very low	31.8	Very low	97 Å²	97	139.9 Å²	139.9	80%	0.802	79%	0.789	S	S	*	*			trans	-156.9	138.8	167.1	0	0	0	0	0	117.1
657	C	24.3	Very low	31.7	Very low	130 Å²	130	139.2 Å²	139.2	88%	0.878	79%	0.794	S	S	*	*			trans	86.7	139.7	148.2	-134.1	0	0	0	0	122
658	V	32.9	Very low	31.5	Very low	123 Å²	123	136.8 Å²	136.8	75%	0.745	80%	0.799	S	S	*	*			trans	-139.2	164.1	176.6	-152.9	0	0	0	0	106.6
659	P	41.9	Very low	31.5	Very low	127 Å²	127	132.3 Å²	132.3	83%	0.825	80%	0.801	S	S	*	*				-150.1	166.4	101	37.2	-19.8	0	0	0	116
660	A	29.7	Very low	31.4	Very low	86 Å²	86	129.8 Å²	129.8	71%	0.711	80%	0.797	S	S	*	*			trans	-110.4	179	164	0	0	0	0	0	110.2
661	P	46.1	Very low	30.8	Very low	127 Å²	127	129.3 Å²	129.3	83%	0.825	79%	0.792	S	S	*	*				-150.8	-179.1	87.7	39.5	-20.4	0	0	0	116.2
662	E	29.5	Very low	30.9	Very low	172 Å²	172	132.6 Å²	132.6	80%	0.804	80%	0.8	S	S	*	*			trans	-100	-170.6	175.8	-56.4	-167.2	155.2	0	0	113.3
663	P	49.2	Very low	30.8	Very low	121 Å²	121	127 Å²	127	79%	0.786	79%	0.79	S	S	*	*				-151.4	135.4	87.1	37.5	-17.8	0	0	0	119.4
664	L	28.3	Very low	30.8	Very low	163 Å²	163	129.9 Å²	129.9	85%	0.853	80%	0.795	S	S	*	*				60.3	137.5	122.5	-163.4	65	0	0	0	124
665	G	23.2	Very low	30.9	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	79%	0.791	S	S	*	*			trans	-166.7	116.1	160.3	0	0	0	0	0	115.1
666	E	27.5	Very low	30.3	Very low	190 Å²	190	125.9 Å²	125.9	89%	0.888	79%	0.791	S	S	*	*			trans	-23.8	170.1	171.4	-62.2	175.6	129	0	0	122.3
667	S	28.3	Very low	30.2	Very low	123 Å²	123	126.9 Å²	126.9	86%	0.86	79%	0.787	S	S	*	*			cis	178.8	151.4	-28.5	-173.2	0	0	0	0	111.3
668	G	27.1	Very low	30.2	Very low	65 Å²	65	125.7 Å²	125.7	67%	0.67	78%	0.781	S	S	*	*			trans	135	113.1	150.6	0	0	0	0	0	121.6
669	S	29.3	Very low	29.7	Very low	124 Å²	124	125.4 Å²	125.4	87%	0.867	78%	0.784	S	S	*	*			trans	69.1	166.5	151.5	-86.2	0	0	0	0	119.2
670	S	28.2	Very low	28.9	Very low	104 Å²	104	124.1 Å²	124.1	73%	0.727	78%	0.778	S	S	*	*			cis	-171.4	171.2	-11.8	43	0	0	0	0	111.4
671	T	28.4	Very low	28.6	Very low	109 Å²	109	128.3 Å²	128.3	67%	0.669	78%	0.783	S	S	*	*			cis	179.7	141.6	-31.2	-74.7	0	0	0	0	109.6
672	Q	29.1	Very low	27.8	Very low	181 Å²	181	129.2 Å²	129.2	85%	0.846	77%	0.774	S	S	*	*			trans	69.6	148.9	161.5	-82.8	170.4	-4.8	0	0	120.2
673	V	28.1	Very low	27.5	Very low	109 Å²	109	129 Å²	129	66%	0.661	77%	0.773	S	S	*	*			cis	-153.9	142.2	-9.7	94.7	0	0	0	0	114.5
674	E	28.3	Very low	26.3	Very low	191 Å²	191	126.7 Å²	126.7	89%	0.893	77%	0.771	S	S	*	*			trans	26.2	158.5	143	-60.2	172.7	177.5	0	0	127.3
675	G	25.4	Very low	26.1	Very low	71 Å²	71	126.4 Å²	126.4	73%	0.732	77%	0.769	S	S	*	*			trans	117.9	107.6	171	0	0	0	0	0	112.9
676	D	23.8	Very low	26.2	Very low	160 Å²	160	130.1 Å²	130.1	86%	0.856	77%	0.772	S	S	*	*			cis	61.6	129.1	46.4	-124.5	15.6	0	0	0	112.5
677	V	26.4	Very low	26	Very low	119 Å²	119	125.3 Å²	125.3	72%	0.721	76%	0.759	S	S	*	*			cis	-145.5	140.6	15.8	-102.9	0	0	0	0	109.5
678	S	22.7	Very low	25.9	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	76%	0.756	S	S	*	*				78.1	149	85.5	-158.2	0	0	0	0	117.5
679	S	22.5	Very low	25.9	Very low	116 Å²	116	132.5 Å²	132.5	81%	0.811	76%	0.762	S	S	*	*			trans	69.8	154.9	172.1	75.3	0	0	0	0	118.7
680	S	25.3	Very low	25.8	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	75%	0.751	S	S	*	*			cis	-169.3	171.4	-36.5	-158	0	0	0	0	109.7
681	E	23.3	Very low	25.9	Very low	174 Å²	174	133.8 Å²	133.8	81%	0.813	76%	0.755	S	S	*	*			trans	65.9	156.8	156.7	-71.3	-177.5	126.8	0	0	119.5
682	K	29.3	Very low	25.8	Very low	147 Å²	147	139.8 Å²	139.8	64%	0.639	77%	0.766	S	S	*	*			cis	-172.2	146.7	-38.1	-146.2	-171.2	176.2	-147.9	0	109
683	E	23	Very low	25.9	Very low	168 Å²	168	136.3 Å²	136.3	79%	0.785	76%	0.761	S	S	*	*			trans	59.6	149.2	164.7	-70.4	152.3	-164	0	0	116
684	G	24.1	Very low	26.1	Very low	72 Å²	72	140 Å²	140	74%	0.742	77%	0.769	S	S	*	*			cis	-166.4	-176	-13.4	0	0	0	0	0	105.7
685	L	25.7	Very low	26.3	Very low	157 Å²	157	136.4 Å²	136.4	82%	0.822	76%	0.76	S	S	*	*			cis	-173.6	156.3	-6	-128	172.3	0	0	0	105.7
686	L	23.7	Very low	27	Very low	148 Å²	148	142.2 Å²	142.2	78%	0.775	77%	0.767	S	S	*	*			trans	71.3	120.1	173.2	-52.8	175.6	0	0	0	115.3
687	S	24.1	Very low	27.5	Very low	88 Å²	88	141.1 Å²	141.1	62%	0.615	76%	0.761	S	S	*	*				83.2	148	79.1	-67.6	0	0	0	0	113.6
688	E	25.2	Very low	28.5	Very low	172 Å²	172	142 Å²	142	80%	0.804	76%	0.76	S	S	*	*			cis	-161.4	176.9	-10.8	-110.8	159.9	74.6	0	0	107.3
689	E	27.3	Very low	29	Very low	168 Å²	168	145 Å²	145	79%	0.785	76%	0.763	S	S	*	*			cis	-122.9	-119.8	7.3	-169.3	-125.2	89	0	0	110.1
690	A	27.9	Very low	30.2	Very low	77 Å²	77	144.7 Å²	144.7	64%	0.636	76%	0.755	S	S	*	*			trans	-144.9	177.3	-175.8	0	0	0	0	0	114
691	Q	30	Very low	30.7	Very low	177 Å²	177	146.5 Å²	146.5	83%	0.827	76%	0.757	S	S	*	*			trans	-120.3	124.6	153.9	-70.8	-174.4	-34.1	0	0	108.4
692	R	27.5	Very low	31.5	Very low	236 Å²	236	145.6 Å²	145.6	89%	0.891	76%	0.757	S	S	*	*			trans	170.9	106.6	138.8	-91.1	147.1	-155.7	177	7.4	114.6
693	S	29.4	Very low	31.9	Very low	107 Å²	107	143.6 Å²	143.6	75%	0.748	76%	0.762	S	S	*	*				50.1	124.8	126.8	74.4	0	0	0	0	122.7
694	K	33.6	Very low	32.6	Very low	188 Å²	188	144.2 Å²	144.2	82%	0.817	77%	0.765	S	S	*	*				102.2	143.2	123.9	-148.2	-174.4	-176.4	178.8	0	119.6
695	T	32.8	Very low	32.9	Very low	114 Å²	114	148.7 Å²	148.7	70%	0.699	77%	0.771	S	S	*	*			trans	84.2	140.1	165.7	75.8	0	0	0	0	118.4
696	H	39.3	Very low	33.1	Very low	193 Å²	193	150.1 Å²	150.1	89%	0.894	77%	0.77	S	S	*	*			trans	-109.1	84.9	166.2	-78.7	-50.4	0	0	0	109.3
697	L	33.4	Very low	33.8	Very low	137 Å²	137	146.1 Å²	146.1	72%	0.717	76%	0.758	S	S	*	*			trans	-135.5	142.6	145.5	-168.3	62.7	0	0	0	106.9	E699	L697-E699 VanDerWaalsContact C-N 3.26Å; L697-E699 PolarHBondContact O-N 2.85Å
698	I	48.3	Very low	34.5	Very low	137 Å²	137	147.8 Å²	147.8	70%	0.703	77%	0.767	S	S	*	*			trans	-82.7	83.4	177.2	-57.8	174.8	0	0	0	107	V700	I698-V700 HydrophobicContact CG2-CG2 4.19Å; I698-V700 PolarHBondContact O-N 3.16Å
699	E	33.7	Very low	35	Very low	169 Å²	169	148.2 Å²	148.2	79%	0.79	77%	0.769	S	S	*	*			trans	-68	123.6	161	-67.8	-178.6	158.1	0	0	107.3	L697	L697-E699 VanDerWaalsContact C-N 3.26Å; L697-E699 PolarHBondContact O-N 2.85Å
700	V	47.9	Very low	35.6	Very low	109 Å²	109	149.1 Å²	149.1	66%	0.661	77%	0.774	S	S	*	*			trans	-98.8	100.6	171.8	176.9	0	0	0	0	105.2	I698	I698-V700 HydrophobicContact CG2-CG2 4.19Å; I698-V700 PolarHBondContact O-N 3.16Å
701	D	35.3	Very low	36.2	Very low	139 Å²	139	154.4 Å²	154.4	74%	0.743	79%	0.785	S	S	*	*			trans	-69.9	136.7	179.6	-150.5	-24.8	0	0	0	110.1	S703	D701-S703 PolarHBondContact OD1-OG 2.99Å
702	L	39.6	Very low	36.6	Very low	154 Å²	154	154.8 Å²	154.8	81%	0.806	79%	0.787	S	S	*	*			trans	-130.1	84.5	-175.3	-76.9	175.9	0	0	0	108.4
703	S	38.5	Very low	36.8	Very low	105 Å²	105	146.2 Å²	146.2	73%	0.734	77%	0.772	S	S	*	*			trans	-132.8	49.2	-177.7	-67.9	0	0	0	0	112.8	D701	D701-S703 PolarHBondContact OD1-OG 2.99Å
704	E	38.3	Very low	36.9	Very low	181 Å²	181	147.4 Å²	147.4	85%	0.846	78%	0.775	S	S	*	*			trans	-121.9	151.1	153.5	-73.4	-167.2	167	0	0	109.6
705	L	29.8	Very low	36.9	Very low	166 Å²	166	146.6 Å²	146.6	87%	0.869	77%	0.774	S	S	*	*			trans	66.9	81.2	-176.1	-63.5	127.5	0	0	0	116.8
706	K	28.8	Very low	36.8	Very low	188 Å²	188	149 Å²	149	82%	0.817	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-79	126.1	133	174.9	63.8	-178.4	170.5	0	107.2
707	A	39.2	Very low	36.7	Very low	63 Å²	63	143.5 Å²	143.5	52%	0.521	77%	0.771	S	S	.	*	P	Polyproline II helix	trans	-82.9	163	-177.1	0	0	0	0	0	113.3
708	P	37.9	Very low	36.8	Very low	124 Å²	124	142.1 Å²	142.1	81%	0.805	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-80.4	148.6	151.5	34.6	-31.1	0	0	0	111.1
709	E	36.9	Very low	36.4	Very low	180 Å²	180	140 Å²	140	84%	0.841	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-96.2	171.6	167.8	-70.9	168.6	114.7	0	0	109.9
710	E	39.9	Very low	36.6	Very low	188 Å²	188	139 Å²	139	88%	0.879	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90.2	141.3	-167.5	-60.6	175.3	138.1	0	0	114.2
711	E	40.3	Very low	36.2	Very low	188 Å²	188	142 Å²	142	88%	0.879	78%	0.782	S	S	*	*			trans	52	155.9	160	-73.9	-174.3	134.1	0	0	119.6
712	E	37.4	Very low	36.2	Very low	184 Å²	184	138.9 Å²	138.9	86%	0.86	78%	0.782	S	S	*	*			cis	-151.4	160.8	22.5	-160.3	-176.5	-164.1	0	0	111.7
713	G	31.9	Very low	36.3	Very low	57 Å²	57	139.7 Å²	139.7	59%	0.588	79%	0.787	S	S	*	*			trans	109	102.6	145.5	0	0	0	0	0	120.3
714	T	32.4	Very low	36.2	Very low	132 Å²	132	138 Å²	138	81%	0.81	79%	0.787	S	S	*	*			trans	60	151	139.2	30.3	0	0	0	0	120.7
715	E	34.1	Very low	36.6	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.794	78%	0.778	S	S	*	*			cis	-157.3	147.1	6.1	43.4	-156	85.6	0	0	114.3
716	D	30.8	Very low	37.3	Very low	164 Å²	164	137.5 Å²	137.5	88%	0.877	78%	0.78	S	S	*	*			trans	66.3	148.7	149.5	-127.9	-15.7	0	0	0	126.3
717	A	37.3	Very low	38.8	Very low	79 Å²	79	136.9 Å²	136.9	65%	0.653	78%	0.777	S	S	*	*			trans	70.2	99.4	149.8	0	0	0	0	0	124.5
718	A	35.7	Very low	38.9	Very low	107 Å²	107	139.8 Å²	139.8	88%	0.884	79%	0.794	S	S	*	*			trans	71.2	148.5	138.1	0	0	0	0	0	119.8
719	A	38.5	Very low	39.5	Very low	92 Å²	92	140 Å²	140	76%	0.76	79%	0.792	S	S	*	*			cis	-153.2	178.2	6.9	0	0	0	0	0	113.3
720	E	39	Very low	39.6	Very low	148 Å²	148	139.9 Å²	139.9	69%	0.692	79%	0.794	S	S	*	*			trans	71.6	115.9	162.1	-81.1	-76.2	95.3	0	0	121.2
721	K	38.5	Very low	40	Very low	174 Å²	174	133.9 Å²	133.9	76%	0.757	78%	0.783	S	S	*	*			trans	35.2	138.6	148.7	-61.8	-177.9	-175.4	70.9	0	122.1
722	G	36	Very low	39.9	Very low	72 Å²	72	133.8 Å²	133.8	74%	0.742	78%	0.78	S	S	*	*			cis	156.7	149.1	-8	0	0	0	0	0	116
723	D	41.7	Very low	40.5	Very low	171 Å²	171	134.1 Å²	134.1	91%	0.914	78%	0.779	S	S	*	*			trans	60.7	150.2	163.9	-154.2	12.1	0	0	0	119.3
724	G	36.7	Very low	41.5	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	78%	0.782	S	S	*	*			trans	147.5	23	-179.7	0	0	0	0	0	117.2	Q726	G724-Q726 PolarHBondContact O-N 3.08Å
725	E	46.9	Very low	42.8	Very low	140 Å²	140	140.4 Å²	140.4	65%	0.654	78%	0.779	S	S	*	*			trans	-67.5	122.4	176.4	-76.6	-151.8	119.2	0	0	112.9	K727	E725-K727 VanDerWaalsContact OE1-CE 3.3Å; E725-K727 WeakPolarHBondContact OE1-CE 3.33Å; E725-K727 IonicContact OE1-NZ 2.62Å; E725-K727 PolarHBondContact OE1-NZ 3.09Å
726	Q	42.9	Very low	44	Very low	196 Å²	196	137.6 Å²	137.6	92%	0.916	77%	0.769	S	S	*	*			trans	-140	103.1	144.1	-71.1	-159.3	5.7	0	0	111.3	G724	G724-Q726 PolarHBondContact O-N 3.08Å
727	K	60.8	Low	45.5	Very low	175 Å²	175	136.6 Å²	136.6	76%	0.761	76%	0.759	S	S	*	*			trans	-89.9	123.3	171.3	-70.7	160.9	178	152.1	0	109.5	E725	E725-K727 VanDerWaalsContact OE1-CE 3.3Å; E725-K727 WeakPolarHBondContact OE1-CE 3.33Å; E725-K727 IonicContact OE1-NZ 2.62Å; E725-K727 PolarHBondContact OE1-NZ 3.09Å
728	S	42.2	Very low	46.8	Very low	124 Å²	124	138 Å²	138	87%	0.867	75%	0.752	S	S	*	*			trans	-125.8	122.9	162.9	58.1	0	0	0	0	110.3
729	V	50.4	Low	48.1	Very low	129 Å²	129	139 Å²	139	78%	0.782	74%	0.737	S	S	*	*			trans	-112.4	112.3	-176.9	174.8	0	0	0	0	108.9
730	M	37.3	Very low	49.8	Very low	176 Å²	176	137.5 Å²	137.5	87%	0.867	73%	0.725	S	S	*	*			trans	-175.7	135.5	132.4	-154	57.6	62.9	0	0	108.8
731	G	48.9	Very low	51.4	Low	63 Å²	63	135.9 Å²	135.9	65%	0.649	72%	0.717	S	S	*	*			trans	-102.5	165.6	-172	0	0	0	0	0	115.3
732	F	38.4	Very low	53.4	Low	185 Å²	185	132 Å²	132	81%	0.811	71%	0.705	S	S	*	*			trans	-149.4	163.3	156.8	-111.5	-82.3	0	0	0	110.7	F734	F732-F734 HydrophobicContact CB-CD2 4.44Å; F732-F734 HydrophobicContact CB-CE2 4.44Å; F732-F734 PolarHBondContact O-N 2.78Å
733	F	50.8	Low	55.8	Low	192 Å²	192	132.2 Å²	132.2	84%	0.842	69%	0.686	S	S	*	*	S	Bend	trans	-74.1	71.7	-165.7	-74.8	-103.5	0	0	0	114.9
734	F	52.8	Low	57.5	Low	148 Å²	148	127.9 Å²	127.9	65%	0.649	66%	0.663	S	S	*	*			trans	-111.9	-6.4	175.6	-75.2	-79.2	0	0	0	115.2	F732 D736	F732-F734 HydrophobicContact CB-CD2 4.44Å; F732-F734 HydrophobicContact CB-CE2 4.44Å; F732-F734 PolarHBondContact O-N 2.78Å; F734-D736 PolarHBondContact O-N 3.44Å
735	K	58.7	Low	59.8	Low	172 Å²	172	126.8 Å²	126.8	75%	0.748	65%	0.646	S	S	*	*	H	α-helix	trans	-73	-27.7	-171.8	-150.5	72.8	174.3	-178.1	0	114.2	K739	K735-K739 WeakPolarHBondContact O-CG 3.5Å
736	D	59.1	Low	61.8	Low	112 Å²	112	126.5 Å²	126.5	60%	0.599	64%	0.643	S	S	*	*	H	α-helix	trans	-95.3	-27.7	-177	-70.7	-31	0	0	0	113.8	F734 K739 A740	F734-D736 PolarHBondContact O-N 3.44Å; D736-K739 PolarHBondContact O-N 3.17Å; D736-A740 WeakPolarHBondContact O-CB 3.32Å; D736-A740 PolarHBondContact O-N 3.47Å
737	E	62	Low	64	Low	142 Å²	142	122.9 Å²	122.9	66%	0.664	62%	0.624	S	S	*	*	H	α-helix	trans	-69.8	-38.6	174.1	-168.6	154.9	-139.1	0	0	111	K739 A740 E741	E737-K739 VanDerWaalsContact C-N 3.34Å; E737-K739 PolarHBondContact O-N 3.25Å; E737-A740 WeakPolarHBondContact O-CB 3.23Å; E737-A740 PolarHBondContact O-N 2.91Å; E737-A740 VanDerWaalsContact O-N 3.15Å; E737-E741 PolarHBondContact O-N 3.13Å
738	Q	64.6	Low	65.3	Low	109 Å²	109	122.1 Å²	122.1	51%	0.509	62%	0.617	S	S	.	*	H	α-helix	trans	-59.5	-42.8	169.7	-163.7	68.9	67.7	0	0	111.9	A740 E741 D742	Q738-A740 VanDerWaalsContact C-N 3.34Å; Q738-A740 PolarHBondContact O-N 3.38Å; Q738-E741 PolarHBondContact O-N 3.41Å; Q738-D742 WeakPolarHBondContact O-CB 3.49Å; Q738-D742 VanDerWaalsContact O-CG 3.3Å; Q738-D742 PolarHBondContact O-N 2.85Å
739	K	64.5	Low	67.5	Low	127 Å²	127	118.7 Å²	118.7	55%	0.552	60%	0.596	S	S	*	*	H	α-helix	trans	-65.1	-35.3	174.3	-80.1	178.3	175	176.5	0	112.9	K735 D736 E737 E743	K735-K739 WeakPolarHBondContact O-CG 3.5Å; D736-K739 PolarHBondContact O-N 3.17Å; E737-K739 VanDerWaalsContact C-N 3.34Å; E737-K739 PolarHBondContact O-N 3.25Å; K739-E743 WeakPolarHBondContact O-CB 3.45Å; K739-E743 PolarHBondContact O-N 3.48Å
740	A	72.9	Confident	69.3	Low	62 Å²	62	115.3 Å²	115.3	51%	0.512	58%	0.581	S	S	.	*	H	α-helix	trans	-68.7	-38.3	176.5	0	0	0	0	0	111.3	D736 E737 Q738 L744	D736-A740 WeakPolarHBondContact O-CB 3.32Å; D736-A740 PolarHBondContact O-N 3.47Å; E737-A740 WeakPolarHBondContact O-CB 3.23Å; E737-A740 PolarHBondContact O-N 2.91Å; E737-A740 VanDerWaalsContact O-N 3.15Å; Q738-A740 VanDerWaalsContact C-N 3.34Å; Q738-A740 PolarHBondContact O-N 3.38Å; A740-L744 WeakPolarHBondContact O-CB 3.38Å; A740-L744 PolarHBondContact O-N 2.89Å
741	E	73.4	Confident	72	Confident	114 Å²	114	113.6 Å²	113.6	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-69.1	-42.3	172.1	-174.4	163.2	-139.4	0	0	112.1	E737 Q738 E743 L744 A745	E737-E741 PolarHBondContact O-N 3.13Å; Q738-E741 PolarHBondContact O-N 3.41Å; E741-E743 PolarHBondContact O-N 2.96Å; E741-L744 CarbonylContact O-C 3.5Å; E741-L744 WeakPolarHBondContact O-CA 3.45Å; E741-L744 WeakPolarHBondContact O-CB 3.5Å; E741-L744 PolarHBondContact O-N 2.9Å; E741-A745 WeakPolarHBondContact O-CB 3.42Å; E741-A745 PolarHBondContact O-N 3.49Å
742	D	80.4	Confident	74.1	Confident	92 Å²	92	116.1 Å²	116.1	49%	0.492	57%	0.568	S	S	.	*	H	α-helix	trans	-61.6	-42	174.5	-73.8	-24.2	0	0	0	111.6	Q738 L744 A745 K746	Q738-D742 WeakPolarHBondContact O-CB 3.49Å; Q738-D742 VanDerWaalsContact O-CG 3.3Å; Q738-D742 PolarHBondContact O-N 2.85Å; D742-L744 VanDerWaalsContact C-N 3.31Å; D742-L744 PolarHBondContact O-N 2.95Å; D742-A745 PolarHBondContact O-N 3.47Å; D742-K746 WeakPolarHBondContact O-CB 3.42Å; D742-K746 PolarHBondContact O-N 3.26Å
743	E	85.6	Confident	76.6	Confident	76 Å²	76	112.6 Å²	112.6	36%	0.355	56%	0.556	S	S	.	*	H	α-helix	trans	-67.2	-29.9	172.9	-89.7	-68.5	133.2	0	0	112.6	K739 E741 K746 K747	K739-E743 WeakPolarHBondContact O-CB 3.45Å; K739-E743 PolarHBondContact O-N 3.48Å; E741-E743 PolarHBondContact O-N 2.96Å; E743-K746 WeakPolarHBondContact OE1-CD 3.43Å; E743-K746 IonicContact OE1-NZ 2.87Å; E743-K746 PolarHBondContact OE1-NZ 3.26Å; E743-K747 VanDerWaalsContact O-CB 3.28Å; E743-K747 WeakPolarHBondContact O-CB 3.39Å; E743-K747 WeakPolarHBondContact O-CD 3.33Å; E743-K747 WeakPolarHBondContact O-CG 3.48Å; E743-K747 PolarHBondContact O-N 2.91Å; E743-K747 IonicContact OE2-NZ 2.62Å; E743-K747 PolarHBondContact OE2-NZ 3.17Å
744	L	78.7	Confident	78.5	Confident	81 Å²	81	111.3 Å²	111.3	42%	0.424	55%	0.551	S	S	.	*	H	α-helix	trans	-71.8	-41.3	172	-172.1	69.5	0	0	0	111.4	A740 E741 D742 K747 R748	A740-L744 WeakPolarHBondContact O-CB 3.38Å; A740-L744 PolarHBondContact O-N 2.89Å; E741-L744 CarbonylContact O-C 3.5Å; E741-L744 WeakPolarHBondContact O-CA 3.45Å; E741-L744 WeakPolarHBondContact O-CB 3.5Å; E741-L744 PolarHBondContact O-N 2.9Å; D742-L744 VanDerWaalsContact C-N 3.31Å; D742-L744 PolarHBondContact O-N 2.95Å; L744-K747 PolarHBondContact O-N 2.91Å; L744-R748 WeakPolarHBondContact O-CB 3.29Å; L744-R748 VanDerWaalsContact O-CG 3.26Å; L744-R748 WeakPolarHBondContact O-CG 3.39Å; L744-R748 PolarHBondContact O-N 2.81Å
745	A	84.2	Confident	80.4	Confident	47 Å²	47	110 Å²	110	39%	0.388	55%	0.547	S	S	.	.	H	α-helix	trans	-64.6	-45.4	175.8	0	0	0	0	0	111.2	E741 D742 R748 A749	E741-A745 WeakPolarHBondContact O-CB 3.42Å; E741-A745 PolarHBondContact O-N 3.49Å; D742-A745 PolarHBondContact O-N 3.47Å; A745-R748 WeakPolarHBondContact O-CB 3.5Å; A745-R748 PolarHBondContact O-N 3.13Å; A745-A749 WeakPolarHBondContact O-CB 3.48Å; A745-A749 PolarHBondContact O-N 2.8Å
746	K	89.1	Confident	81.9	Confident	134 Å²	134	108 Å²	108	58%	0.583	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-41	174.3	-173.4	175.3	169.4	-162.4	0	112.1	D742 E743 A749 A750	D742-K746 WeakPolarHBondContact O-CB 3.42Å; D742-K746 PolarHBondContact O-N 3.26Å; E743-K746 WeakPolarHBondContact OE1-CD 3.43Å; E743-K746 IonicContact OE1-NZ 2.87Å; E743-K746 PolarHBondContact OE1-NZ 3.26Å; K746-A749 PolarHBondContact O-N 2.88Å; K746-A750 VanDerWaalsContact O-CB 3.24Å; K746-A750 WeakPolarHBondContact O-CB 3.39Å; K746-A750 PolarHBondContact O-N 2.9Å
747	K	89	Confident	83.4	Confident	120 Å²	120	108.7 Å²	108.7	52%	0.522	54%	0.537	S	S	.	.	H	α-helix	trans	-64.7	-39.8	171.6	-75.6	171.8	-177.4	80.6	0	112.4	E743 L744 F751	E743-K747 VanDerWaalsContact O-CB 3.28Å; E743-K747 WeakPolarHBondContact O-CB 3.39Å; E743-K747 WeakPolarHBondContact O-CD 3.33Å; E743-K747 WeakPolarHBondContact O-CG 3.48Å; E743-K747 PolarHBondContact O-N 2.91Å; E743-K747 IonicContact OE2-NZ 2.62Å; E743-K747 PolarHBondContact OE2-NZ 3.17Å; L744-K747 PolarHBondContact O-N 2.91Å; K747-F751 WeakPolarHBondContact O-CB 3.25Å; K747-F751 PolarHBondContact O-N 3.26Å
748	R	89.1	Confident	84.8	Confident	159 Å²	159	109.3 Å²	109.3	60%	0.6	54%	0.538	S	S	*	.	H	α-helix	trans	-63.2	-46.5	173.7	-75	167	175.1	168	-0.4	111.7	L744 A745 F751 L752	L744-R748 WeakPolarHBondContact O-CB 3.29Å; L744-R748 VanDerWaalsContact O-CG 3.26Å; L744-R748 WeakPolarHBondContact O-CG 3.39Å; L744-R748 PolarHBondContact O-N 2.81Å; A745-R748 WeakPolarHBondContact O-CB 3.5Å; A745-R748 PolarHBondContact O-N 3.13Å; R748-F751 PolarHBondContact O-N 2.69Å; R748-L752 PolarHBondContact O-N 2.87Å
749	A	87.2	Confident	85.9	Confident	52 Å²	52	107 Å²	107	43%	0.43	54%	0.538	S	S	.	.	H	α-helix	trans	-63.7	-45.6	177.3	0	0	0	0	0	112.1	A745 K746 F751 L752 L753	A745-A749 WeakPolarHBondContact O-CB 3.48Å; A745-A749 PolarHBondContact O-N 2.8Å; K746-A749 PolarHBondContact O-N 2.88Å; A749-F751 VanDerWaalsContact C-N 3.32Å; A749-F751 PolarHBondContact O-N 3.23Å; A749-L752 WeakPolarHBondContact O-CB 3.28Å; A749-L752 PolarHBondContact O-N 3.46Å; A749-L752 VanDerWaalsContact O-N 3.16Å; A749-L753 PolarHBondContact O-N 3.4Å
750	A	88.9	Confident	86.9	Confident	58 Å²	58	105.8 Å²	105.8	48%	0.479	53%	0.534	S	S	.	.	H	α-helix	trans	-62.7	-36	175.5	0	0	0	0	0	112.5	K746 K754	K746-A750 VanDerWaalsContact O-CB 3.24Å; K746-A750 WeakPolarHBondContact O-CB 3.39Å; K746-A750 PolarHBondContact O-N 2.9Å; A750-K754 WeakPolarHBondContact O-CB 3.4Å; A750-K754 PolarHBondContact O-N 3.26Å
751	F	92.8	Very high	87.6	Confident	141 Å²	141	108.5 Å²	108.5	62%	0.618	54%	0.536	S	S	*	.	H	α-helix	trans	-65.6	-42	172.3	-178.9	-95.1	0	0	0	112	K747 R748 A749 K754 Q755	K747-F751 WeakPolarHBondContact O-CB 3.25Å; K747-F751 PolarHBondContact O-N 3.26Å; R748-F751 PolarHBondContact O-N 2.69Å; A749-F751 VanDerWaalsContact C-N 3.32Å; A749-F751 PolarHBondContact O-N 3.23Å; F751-K754 PolarHBondContact O-N 3.49Å; F751-Q755 PolarHBondContact O-N 3.42Å
752	L	93.1	Very high	88.4	Confident	116 Å²	116	105.9 Å²	105.9	61%	0.607	53%	0.534	S	S	*	.	H	α-helix	trans	-62.9	-49.6	177.1	-141.4	79.9	0	0	0	111.4	R748 A749 K754 Q755 Q756	R748-L752 PolarHBondContact O-N 2.87Å; A749-L752 WeakPolarHBondContact O-CB 3.28Å; A749-L752 PolarHBondContact O-N 3.46Å; A749-L752 VanDerWaalsContact O-N 3.16Å; L752-K754 VanDerWaalsContact C-N 3.35Å; L752-K754 PolarHBondContact O-N 3.31Å; L752-Q755 WeakPolarHBondContact O-CB 3.07Å; L752-Q755 PolarHBondContact O-N 3.15Å; L752-Q755 VanDerWaalsContact O-N 3.13Å; L752-Q756 PolarHBondContact O-N 3.11Å
753	L	91.4	Very high	88.8	Confident	110 Å²	110	109.2 Å²	109.2	58%	0.576	54%	0.54	S	S	*	.	H	α-helix	trans	-61.1	-39.9	175.6	-78.2	165.2	0	0	0	112.3	A749 Q755 Q756 K757	A749-L753 PolarHBondContact O-N 3.4Å; L753-Q755 VanDerWaalsContact C-N 3.32Å; L753-Q755 PolarHBondContact O-N 3.03Å; L753-Q756 PolarHBondContact O-N 2.89Å; L753-K757 WeakPolarHBondContact O-CB 3.41Å; L753-K757 PolarHBondContact O-N 3.16Å
754	K	92.1	Very high	89	Confident	166 Å²	166	109 Å²	109	72%	0.722	54%	0.54	S	S	*	.	H	α-helix	trans	-67	-32.2	175.2	-171.3	169.2	-175.3	171.8	0	112.3	A750 F751 L752 K758	A750-K754 WeakPolarHBondContact O-CB 3.4Å; A750-K754 PolarHBondContact O-N 3.26Å; F751-K754 PolarHBondContact O-N 3.49Å; L752-K754 VanDerWaalsContact C-N 3.35Å; L752-K754 PolarHBondContact O-N 3.31Å; K754-K758 VanDerWaalsContact O-CB 3.26Å; K754-K758 WeakPolarHBondContact O-CB 3.49Å; K754-K758 PolarHBondContact O-N 3.41Å
755	Q	92.7	Very high	89.4	Confident	121 Å²	121	113 Å²	113	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-69.7	-45.8	171.6	-159.3	-158.8	127.4	0	0	111.1	F751 L752 L753 K758 A759	F751-Q755 PolarHBondContact O-N 3.42Å; L752-Q755 WeakPolarHBondContact O-CB 3.07Å; L752-Q755 PolarHBondContact O-N 3.15Å; L752-Q755 VanDerWaalsContact O-N 3.13Å; L753-Q755 VanDerWaalsContact C-N 3.32Å; L753-Q755 PolarHBondContact O-N 3.03Å; Q755-K758 PolarHBondContact O-N 2.71Å; Q755-A759 WeakPolarHBondContact O-CB 3.49Å; Q755-A759 PolarHBondContact O-N 3.41Å
756	Q	88.9	Confident	89.7	Confident	128 Å²	128	116.3 Å²	116.3	60%	0.598	56%	0.555	S	S	*	*	H	α-helix	trans	-60.2	-50.8	178.2	-175.3	176.3	-1.5	0	0	111.5	L752 L753 K758 A759 E760	L752-Q756 PolarHBondContact O-N 3.11Å; L753-Q756 PolarHBondContact O-N 2.89Å; Q756-K758 VanDerWaalsContact C-N 3.3Å; Q756-K758 PolarHBondContact O-N 2.6Å; Q756-A759 WeakPolarHBondContact O-CB 3.43Å; Q756-A759 PolarHBondContact O-N 2.87Å; Q756-A759 VanDerWaalsContact O-N 3.1Å; Q756-E760 WeakPolarHBondContact O-CB 3.44Å; Q756-E760 PolarHBondContact O-N 2.85Å
757	K	90.7	Very high	89.5	Confident	127 Å²	127	115.1 Å²	115.1	55%	0.552	55%	0.552	S	S	*	*	H	α-helix	trans	-60.4	-36.9	176.6	-173.3	165.1	-176.1	166	0	112.3	L753 E760 E761	L753-K757 WeakPolarHBondContact O-CB 3.41Å; L753-K757 PolarHBondContact O-N 3.16Å; K757-E760 PolarHBondContact O-N 2.93Å; K757-E761 VanDerWaalsContact O-CB 3.31Å; K757-E761 WeakPolarHBondContact O-CB 3.45Å; K757-E761 PolarHBondContact O-N 3.37Å
758	K	91	Very high	89.3	Confident	155 Å²	155	115 Å²	115	67%	0.674	55%	0.553	S	S	*	*	H	α-helix	trans	-69.9	-34.5	174.7	-173.7	174.6	-178.8	178.9	0	112.9	K754 Q755 Q756 A762	K754-K758 VanDerWaalsContact O-CB 3.26Å; K754-K758 WeakPolarHBondContact O-CB 3.49Å; K754-K758 PolarHBondContact O-N 3.41Å; Q755-K758 PolarHBondContact O-N 2.71Å; Q756-K758 VanDerWaalsContact C-N 3.3Å; Q756-K758 PolarHBondContact O-N 2.6Å; K758-A762 WeakPolarHBondContact O-CB 3.43Å; K758-A762 PolarHBondContact O-N 3.19Å; K758-A762 VanDerWaalsContact O-N 3.09Å
759	A	87.5	Confident	89.2	Confident	61 Å²	61	112.3 Å²	112.3	50%	0.504	55%	0.55	S	S	.	*	H	α-helix	trans	-71.3	-38.2	174.4	0	0	0	0	0	111.7	Q755 Q756 A762 R763	Q755-A759 WeakPolarHBondContact O-CB 3.49Å; Q755-A759 PolarHBondContact O-N 3.41Å; Q756-A759 WeakPolarHBondContact O-CB 3.43Å; Q756-A759 PolarHBondContact O-N 2.87Å; Q756-A759 VanDerWaalsContact O-N 3.1Å; A759-A762 PolarHBondContact O-N 3.26Å; A759-R763 PolarHBondContact O-N 3.22Å
760	E	86.9	Confident	89.1	Confident	101 Å²	101	114.6 Å²	114.6	47%	0.472	55%	0.552	S	S	.	*	H	α-helix	trans	-64.2	-49.8	172.6	177.8	178.7	-141.6	0	0	112	Q756 K757 A762 R763 I764	Q756-E760 WeakPolarHBondContact O-CB 3.44Å; Q756-E760 PolarHBondContact O-N 2.85Å; K757-E760 PolarHBondContact O-N 2.93Å; E760-A762 VanDerWaalsContact C-N 3.27Å; E760-A762 PolarHBondContact O-N 3.26Å; E760-R763 CarbonylContact O-C 3.48Å; E760-R763 WeakPolarHBondContact O-CA 3.31Å; E760-R763 WeakPolarHBondContact O-CB 3.43Å; E760-R763 PolarHBondContact O-N 3.41Å; E760-I764 HydrophobicContact CG-CD1 3.94Å; E760-I764 WeakPolarHBondContact O-CG1 3.38Å; E760-I764 PolarHBondContact O-N 3.35Å
761	E	87.8	Confident	89	Confident	119 Å²	119	114.4 Å²	114.4	56%	0.556	55%	0.55	S	S	*	*	H	α-helix	trans	-56	-43.2	175	-171.7	-162.2	139.7	0	0	111	K757 R763 I764 R765	K757-E761 VanDerWaalsContact O-CB 3.31Å; K757-E761 WeakPolarHBondContact O-CB 3.45Å; K757-E761 PolarHBondContact O-N 3.37Å; E761-R763 VanDerWaalsContact C-N 3.34Å; E761-R763 PolarHBondContact O-N 2.85Å; E761-I764 PolarHBondContact O-N 3.37Å; E761-R765 VanDerWaalsContact O-CB 3.27Å; E761-R765 WeakPolarHBondContact O-CB 3.23Å; E761-R765 PolarHBondContact O-N 2.85Å
762	A	89	Confident	88.6	Confident	60 Å²	60	113.1 Å²	113.1	50%	0.496	55%	0.546	S	S	.	.	H	α-helix	trans	-64.7	-35	174.4	0	0	0	0	0	112.9	K758 A759 E760 K766	K758-A762 WeakPolarHBondContact O-CB 3.43Å; K758-A762 PolarHBondContact O-N 3.19Å; K758-A762 VanDerWaalsContact O-N 3.09Å; A759-A762 PolarHBondContact O-N 3.26Å; E760-A762 VanDerWaalsContact C-N 3.27Å; E760-A762 PolarHBondContact O-N 3.26Å; A762-K766 WeakPolarHBondContact O-CB 3.14Å; A762-K766 PolarHBondContact O-N 2.76Å
763	R	89.1	Confident	88	Confident	162 Å²	162	110.1 Å²	110.1	61%	0.611	54%	0.535	S	S	*	.	H	α-helix	trans	-67.3	-47.1	174.4	-166.8	-174.7	77.6	114.3	0.2	111.4	A759 E760 E761 K766 Q767	A759-R763 PolarHBondContact O-N 3.22Å; E760-R763 CarbonylContact O-C 3.48Å; E760-R763 WeakPolarHBondContact O-CA 3.31Å; E760-R763 WeakPolarHBondContact O-CB 3.43Å; E760-R763 PolarHBondContact O-N 3.41Å; E761-R763 VanDerWaalsContact C-N 3.34Å; E761-R763 PolarHBondContact O-N 2.85Å; R763-K766 PolarHBondContact O-N 3.19Å; R763-Q767 WeakPolarHBondContact O-CB 3.34Å; R763-Q767 PolarHBondContact O-N 2.9Å
764	I	89.2	Confident	87.8	Confident	72 Å²	72	109.6 Å²	109.6	37%	0.369	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-46.4	177.3	-66.7	167.9	0	0	0	110	E760 E761 K766 Q767 Q768	E760-I764 HydrophobicContact CG-CD1 3.94Å; E760-I764 WeakPolarHBondContact O-CG1 3.38Å; E760-I764 PolarHBondContact O-N 3.35Å; E761-I764 PolarHBondContact O-N 3.37Å; I764-K766 VanDerWaalsContact C-N 3.33Å; I764-K766 PolarHBondContact O-N 3.05Å; I764-Q767 WeakPolarHBondContact O-CB 3.41Å; I764-Q767 PolarHBondContact O-N 2.77Å; I764-Q767 VanDerWaalsContact O-N 3.13Å; I764-Q768 WeakPolarHBondContact O-CG 3.34Å; I764-Q768 PolarHBondContact O-N 3.25Å
765	R	88.2	Confident	87.3	Confident	163 Å²	163	107.4 Å²	107.4	62%	0.615	53%	0.525	S	S	*	.	H	α-helix	trans	-64.1	-34.9	177.2	-171.9	174	-177.1	154.3	3.5	112.9	E761 L769	E761-R765 VanDerWaalsContact O-CB 3.27Å; E761-R765 WeakPolarHBondContact O-CB 3.23Å; E761-R765 PolarHBondContact O-N 2.85Å; R765-L769 WeakPolarHBondContact O-CG 3.45Å; R765-L769 PolarHBondContact O-N 2.85Å
766	K	90.5	Very high	87.1	Confident	118 Å²	118	108.2 Å²	108.2	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-49.3	169.6	178	179.3	179.1	-74	0	110.5	A762 R763 I764 Q768 L769 E770	A762-K766 WeakPolarHBondContact O-CB 3.14Å; A762-K766 PolarHBondContact O-N 2.76Å; R763-K766 PolarHBondContact O-N 3.19Å; I764-K766 VanDerWaalsContact C-N 3.33Å; I764-K766 PolarHBondContact O-N 3.05Å; K766-Q768 VanDerWaalsContact C-N 3.31Å; K766-Q768 PolarHBondContact O-N 2.85Å; K766-L769 PolarHBondContact O-N 3.29Å; K766-E770 IonicContact NZ-OE1 3.6Å; K766-E770 PolarHBondContact NZ-OE1 3.16Å; K766-E770 IonicContact NZ-OE2 3.89Å; K766-E770 PolarHBondContact NZ-OE2 2.96Å; K766-E770 VanDerWaalsContact O-CB 3.31Å; K766-E770 WeakPolarHBondContact O-CB 3.16Å; K766-E770 PolarHBondContact O-N 2.94Å
767	Q	84.3	Confident	86.7	Confident	109 Å²	109	108 Å²	108	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-60.8	-38.5	-178	-171.5	174.1	-3.7	0	0	112.1	R763 I764 E770 A771	R763-Q767 WeakPolarHBondContact O-CB 3.34Å; R763-Q767 PolarHBondContact O-N 2.9Å; I764-Q767 WeakPolarHBondContact O-CB 3.41Å; I764-Q767 PolarHBondContact O-N 2.77Å; I764-Q767 VanDerWaalsContact O-N 3.13Å; Q767-E770 PolarHBondContact O-N 3.43Å; Q767-A771 WeakPolarHBondContact O-CB 3.35Å; Q767-A771 PolarHBondContact O-N 3.48Å
768	Q	85.6	Confident	86.1	Confident	117 Å²	117	104.7 Å²	104.7	55%	0.547	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-47.3	172.8	-73.1	172.9	-16.4	0	0	112.5	I764 K766 E770 A771 E772	I764-Q768 WeakPolarHBondContact O-CG 3.34Å; I764-Q768 PolarHBondContact O-N 3.25Å; K766-Q768 VanDerWaalsContact C-N 3.31Å; K766-Q768 PolarHBondContact O-N 2.85Å; Q768-E770 VanDerWaalsContact C-N 3.32Å; Q768-E770 PolarHBondContact O-N 3.23Å; Q768-A771 PolarHBondContact O-N 3.46Å; Q768-E772 WeakPolarHBondContact O-CB 3.39Å; Q768-E772 PolarHBondContact O-N 2.87Å
769	L	85.6	Confident	85.7	Confident	103 Å²	103	102 Å²	102	54%	0.539	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-32.6	177.1	-72.9	168.3	0	0	0	112.7	R765 K766 S773	R765-L769 WeakPolarHBondContact O-CG 3.45Å; R765-L769 PolarHBondContact O-N 2.85Å; K766-L769 PolarHBondContact O-N 3.29Å; L769-S773 WeakPolarHBondContact O-CB 3.43Å; L769-S773 PolarHBondContact O-N 3.33Å
770	E	85.2	Confident	85.3	Confident	99 Å²	99	102.1 Å²	102.1	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-68.3	-48.5	176.9	-162.4	153.5	-139.2	0	0	110.1	K766 Q767 Q768 S773 E774	K766-E770 IonicContact NZ-OE1 3.6Å; K766-E770 PolarHBondContact NZ-OE1 3.16Å; K766-E770 IonicContact NZ-OE2 3.89Å; K766-E770 PolarHBondContact NZ-OE2 2.96Å; K766-E770 VanDerWaalsContact O-CB 3.31Å; K766-E770 WeakPolarHBondContact O-CB 3.16Å; K766-E770 PolarHBondContact O-N 2.94Å; Q767-E770 PolarHBondContact O-N 3.43Å; Q768-E770 VanDerWaalsContact C-N 3.32Å; Q768-E770 PolarHBondContact O-N 3.23Å; E770-S773 CarbonylContact O-C 3.55Å; E770-S773 WeakPolarHBondContact O-CB 3.41Å; E770-S773 PolarHBondContact O-N 3.37Å; E770-S773 VanDerWaalsContact O-N 3.15Å; E770-S773 PolarHBondContact O-OG 3.32Å; E770-E774 WeakPolarHBondContact O-CB 2.97Å; E770-E774 PolarHBondContact O-N 2.99Å
771	A	87	Confident	85.2	Confident	54 Å²	54	103.6 Å²	103.6	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-62.6	-41.4	174	0	0	0	0	0	113.2	Q767 Q768 S773 E774 L775	Q767-A771 WeakPolarHBondContact O-CB 3.35Å; Q767-A771 PolarHBondContact O-N 3.48Å; Q768-A771 PolarHBondContact O-N 3.46Å; A771-S773 VanDerWaalsContact C-N 3.29Å; A771-S773 PolarHBondContact O-N 2.87Å; A771-E774 PolarHBondContact O-N 2.84Å; A771-E774 VanDerWaalsContact O-N 3.16Å; A771-L775 WeakPolarHBondContact O-CB 3.45Å; A771-L775 PolarHBondContact O-N 3.5Å
772	E	84.4	Confident	84.8	Confident	115 Å²	115	104.1 Å²	104.1	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-61.3	-39.9	172.8	-165.3	-159.3	143.5	0	0	110.9	Q768 E774 K776	Q768-E772 WeakPolarHBondContact O-CB 3.39Å; Q768-E772 PolarHBondContact O-N 2.87Å; E772-E774 VanDerWaalsContact C-N 3.27Å; E772-E774 PolarHBondContact O-N 2.94Å; E772-K776 WeakPolarHBondContact O-CB 3.45Å; E772-K776 PolarHBondContact O-N 2.98Å; E772-K776 VanDerWaalsContact O-N 3.11Å
773	S	80.1	Confident	84.7	Confident	52 Å²	52	108.2 Å²	108.2	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-69.5	-24.4	176.9	88.2	0	0	0	0	113.7	L769 E770 A771 R777	L769-S773 WeakPolarHBondContact O-CB 3.43Å; L769-S773 PolarHBondContact O-N 3.33Å; E770-S773 CarbonylContact O-C 3.55Å; E770-S773 WeakPolarHBondContact O-CB 3.41Å; E770-S773 PolarHBondContact O-N 3.37Å; E770-S773 VanDerWaalsContact O-N 3.15Å; E770-S773 PolarHBondContact O-OG 3.32Å; A771-S773 VanDerWaalsContact C-N 3.29Å; A771-S773 PolarHBondContact O-N 2.87Å; S773-R777 WeakPolarHBondContact O-CB 3.28Å; S773-R777 PolarHBondContact O-N 3.25Å
774	E	87	Confident	84.2	Confident	99 Å²	99	102.2 Å²	102.2	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-83.2	-51	178.8	-174.6	144.6	-111.3	0	0	111.4	E770 A771 E772 K776 R777 D778	E770-E774 WeakPolarHBondContact O-CB 2.97Å; E770-E774 PolarHBondContact O-N 2.99Å; A771-E774 PolarHBondContact O-N 2.84Å; A771-E774 VanDerWaalsContact O-N 3.16Å; E772-E774 VanDerWaalsContact C-N 3.27Å; E772-E774 PolarHBondContact O-N 2.94Å; E774-K776 PolarHBondContact O-N 3.24Å; E774-K776 VanDerWaalsContact O-N 3.16Å; E774-R777 CarbonylContact O-C 3.55Å; E774-R777 WeakPolarHBondContact O-CA 3.42Å; E774-R777 VanDerWaalsContact O-CB 3.28Å; E774-R777 WeakPolarHBondContact O-CB 3.47Å; E774-R777 PolarHBondContact O-N 3Å; E774-D778 PolarHBondContact O-N 2.62Å
775	L	83.2	Confident	83.7	Confident	120 Å²	120	102.1 Å²	102.1	63%	0.628	49%	0.487	S	S	*	.	H	α-helix	trans	-52.2	-41.4	171.3	-171.7	160.3	0	0	0	111.1	A771 R777 D778 E779	A771-L775 WeakPolarHBondContact O-CB 3.45Å; A771-L775 PolarHBondContact O-N 3.5Å; L775-R777 VanDerWaalsContact C-N 3.33Å; L775-R777 PolarHBondContact O-N 2.89Å; L775-D778 PolarHBondContact O-N 3.09Å; L775-E779 WeakPolarHBondContact O-CB 3.49Å; L775-E779 PolarHBondContact O-N 3.25Å
776	K	86.9	Confident	83.1	Confident	139 Å²	139	99.9 Å²	99.9	60%	0.604	48%	0.484	S	S	*	.	H	α-helix	trans	-70.8	-23.9	176.6	-166.5	169.4	-160.6	152.3	0	114.4	E772 E774	E772-K776 WeakPolarHBondContact O-CB 3.45Å; E772-K776 PolarHBondContact O-N 2.98Å; E772-K776 VanDerWaalsContact O-N 3.11Å; E774-K776 PolarHBondContact O-N 3.24Å; E774-K776 VanDerWaalsContact O-N 3.16Å
777	R	82.4	Confident	82.5	Confident	124 Å²	124	98.5 Å²	98.5	47%	0.468	48%	0.482	S	S	.	.	H	α-helix	trans	-77.9	-35.2	170.7	-174.2	-178.9	-59.3	103.5	11.6	110.7	S773 E774 L775 A780 R781	S773-R777 WeakPolarHBondContact O-CB 3.28Å; S773-R777 PolarHBondContact O-N 3.25Å; E774-R777 CarbonylContact O-C 3.55Å; E774-R777 WeakPolarHBondContact O-CA 3.42Å; E774-R777 VanDerWaalsContact O-CB 3.28Å; E774-R777 WeakPolarHBondContact O-CB 3.47Å; E774-R777 PolarHBondContact O-N 3Å; L775-R777 VanDerWaalsContact C-N 3.33Å; L775-R777 PolarHBondContact O-N 2.89Å; R777-A780 CarbonylContact O-C 3.53Å; R777-A780 WeakPolarHBondContact O-CB 3.31Å; R777-A780 PolarHBondContact O-N 3.46Å; R777-R781 PolarHBondContact O-N 3.22Å
778	D	78.2	Confident	82.4	Confident	57 Å²	57	97.2 Å²	97.2	31%	0.305	47%	0.473	S	S	.	.	H	α-helix	trans	-82.8	-32.9	-175.8	-66.4	-12.3	0	0	0	112.6	E774 L775 A780 R781 R782	E774-D778 PolarHBondContact O-N 2.62Å; L775-D778 PolarHBondContact O-N 3.09Å; D778-A780 VanDerWaalsContact C-N 3.26Å; D778-A780 PolarHBondContact O-N 2.87Å; D778-R781 WeakPolarHBondContact O-CB 3.36Å; D778-R781 PolarHBondContact O-N 2.9Å; D778-R781 VanDerWaalsContact O-N 3.14Å; D778-R781 IonicContact OD1-CZ 3.58Å; D778-R781 IonicContact OD1-NE 2.6Å; D778-R781 PolarHBondContact OD1-NE 2.86Å; D778-R781 IonicContact OD1-NH2 2.8Å; D778-R781 PolarHBondContact OD1-NH2 3.13Å; D778-R781 IonicContact OD2-NH2 3.03Å; D778-R782 WeakPolarHBondContact O-CB 3.34Å; D778-R782 PolarHBondContact O-N 2.87Å
779	E	80.6	Confident	82.1	Confident	97 Å²	97	96 Å²	96	45%	0.453	47%	0.47	S	S	.	.	H	α-helix	trans	-57.9	-40.1	161.2	173.4	152.3	-95.3	0	0	111.9	L775 R781 R782 K783	L775-E779 WeakPolarHBondContact O-CB 3.49Å; L775-E779 PolarHBondContact O-N 3.25Å; E779-R781 VanDerWaalsContact C-N 3.32Å; E779-R781 PolarHBondContact O-N 3.22Å; E779-R782 IonicContact OE1-CZ 2.75Å; E779-R782 IonicContact OE1-NH2 3.79Å; E779-R782 PolarHBondContact OE1-NH2 3.48Å; E779-K783 WeakPolarHBondContact O-CB 3.46Å; E779-K783 PolarHBondContact O-N 2.82Å
780	A	80.6	Confident	82.1	Confident	64 Å²	64	98.7 Å²	98.7	53%	0.529	47%	0.472	S	S	.	.	H	α-helix	trans	-71.1	-25.2	175.4	0	0	0	0	0	113.2	R777 D778	R777-A780 CarbonylContact O-C 3.53Å; R777-A780 WeakPolarHBondContact O-CB 3.31Å; R777-A780 PolarHBondContact O-N 3.46Å; D778-A780 VanDerWaalsContact C-N 3.26Å; D778-A780 PolarHBondContact O-N 2.87Å
781	R	83.4	Confident	82	Confident	132 Å²	132	99.5 Å²	99.5	50%	0.498	47%	0.474	S	S	.	.	H	α-helix	trans	-71.1	-63	168.4	-71.3	-164.3	-95.7	-169	0.8	110.4	M66 R777 D778 E779 K783 A784 E785	M66-R781 HydrophobicContact CE-CB 3.91Å; M66-R781 VanDerWaalsContact CE-O 3.32Å; M66-R781 WeakPolarHBondContact CE-O 3.36Å; R777-R781 PolarHBondContact O-N 3.22Å; D778-R781 WeakPolarHBondContact O-CB 3.36Å; D778-R781 PolarHBondContact O-N 2.9Å; D778-R781 VanDerWaalsContact O-N 3.14Å; D778-R781 IonicContact OD1-CZ 3.58Å; D778-R781 IonicContact OD1-NE 2.6Å; D778-R781 PolarHBondContact OD1-NE 2.86Å; D778-R781 IonicContact OD1-NH2 2.8Å; D778-R781 PolarHBondContact OD1-NH2 3.13Å; D778-R781 IonicContact OD2-NH2 3.03Å; E779-R781 VanDerWaalsContact C-N 3.32Å; E779-R781 PolarHBondContact O-N 3.22Å; R781-K783 PolarHBondContact O-N 3.14Å; R781-K783 VanDerWaalsContact O-N 3.14Å; R781-A784 WeakPolarHBondContact O-CA 3.39Å; R781-A784 WeakPolarHBondContact O-CB 3.44Å; R781-A784 PolarHBondContact O-N 2.92Å; R781-E785 PolarHBondContact O-N 3.07Å
782	R	79.9	Confident	81.9	Confident	131 Å²	131	100 Å²	100	49%	0.494	47%	0.468	S	S	.	.	H	α-helix	trans	-50.7	-38.6	179.4	174.7	174.5	51.3	73.1	-1.2	113.2	D778 E779 A784 E785 E786	D778-R782 WeakPolarHBondContact O-CB 3.34Å; D778-R782 PolarHBondContact O-N 2.87Å; E779-R782 IonicContact OE1-CZ 2.75Å; E779-R782 IonicContact OE1-NH2 3.79Å; E779-R782 PolarHBondContact OE1-NH2 3.48Å; R782-A784 VanDerWaalsContact C-N 3.33Å; R782-A784 PolarHBondContact O-N 3.21Å; R782-E785 WeakPolarHBondContact O-CB 3.41Å; R782-E785 PolarHBondContact O-N 2.92Å; R782-E786 PolarHBondContact O-N 2.82Å
783	K	86.9	Confident	81.8	Confident	145 Å²	145	100.4 Å²	100.4	63%	0.63	47%	0.469	S	S	*	.	H	α-helix	trans	-71.9	-22.8	176.7	-174.6	162.7	-173.7	160.2	0	114.1	E779 R781 D787	E779-K783 WeakPolarHBondContact O-CB 3.46Å; E779-K783 PolarHBondContact O-N 2.82Å; R781-K783 PolarHBondContact O-N 3.14Å; R781-K783 VanDerWaalsContact O-N 3.14Å; K783-D787 WeakPolarHBondContact O-CB 3.39Å
784	A	79.8	Confident	82	Confident	37 Å²	37	100.6 Å²	100.6	31%	0.306	47%	0.465	S	S	.	.	H	α-helix	trans	-80.3	-21.8	170.6	0	0	0	0	0	112.4	R781 R782 R788	R781-A784 WeakPolarHBondContact O-CA 3.39Å; R781-A784 WeakPolarHBondContact O-CB 3.44Å; R781-A784 PolarHBondContact O-N 2.92Å; R782-A784 VanDerWaalsContact C-N 3.33Å; R782-A784 PolarHBondContact O-N 3.21Å; A784-R788 PolarHBondContact O-N 2.83Å
785	E	78.3	Confident	82.1	Confident	69 Å²	69	101.8 Å²	101.8	32%	0.322	47%	0.468	S	S	.	.	H	α-helix	trans	-72.6	-60.3	177.6	-151.1	139.1	-133.5	0	0	110.8	M66 E67 R781 R782 D787 R788 L789	M66-E785 HydrophobicContact CE-CB 3.87Å; M66-E785 HydrophobicContact CE-CG 4.03Å; M66-E785 VanDerWaalsContact CE-OE1 3.3Å; M66-E785 WeakPolarHBondContact CE-OE1 3.47Å; M66-E785 WeakPolarHBondContact CE-OE2 3.17Å; M66-E785 HydrophobicContact CG-CG 4.29Å; M66-E785 VanDerWaalsContact CG-OE1 3.29Å; M66-E785 WeakPolarHBondContact CG-OE1 3.37Å; M66-E785 VanDerWaalsContact SD-CA 3.53Å; M66-E785 HydrophobicContact SD-CB 3.45Å; M66-E785 WeakPolarHBondContact SD-CB 3.32Å; M66-E785 VanDerWaalsContact SD-CD 3.51Å; M66-E785 HydrophobicContact SD-CG 3.63Å; E67-E785 HydrophobicContact CG-CG 4.14Å; R781-E785 PolarHBondContact O-N 3.07Å; R782-E785 WeakPolarHBondContact O-CB 3.41Å; R782-E785 PolarHBondContact O-N 2.92Å; E785-D787 PolarHBondContact O-N 2.64Å; E785-D787 VanDerWaalsContact O-N 3.11Å; E785-R788 PolarHBondContact O-N 3.22Å; E785-L789 PolarHBondContact O-N 3.49Å
786	E	76.2	Confident	82.3	Confident	116 Å²	116	99.9 Å²	99.9	54%	0.542	46%	0.462	S	S	.	.	H	α-helix	trans	-49.3	-41.1	173.3	-173.1	-160.2	148.9	0	0	111.5	R782 R788 R790	R782-E786 PolarHBondContact O-N 2.82Å; E786-R788 PolarHBondContact O-N 3.14Å; E786-R790 WeakPolarHBondContact O-CB 3.32Å; E786-R790 PolarHBondContact O-N 2.95Å
787	D	76.8	Confident	82.5	Confident	89 Å²	89	100.2 Å²	100.2	48%	0.476	46%	0.459	S	S	.	.	H	α-helix	trans	-72.8	-24.2	-178.8	-156.7	58.1	0	0	0	112.3	K783 E785 K791	K783-D787 WeakPolarHBondContact O-CB 3.39Å; E785-D787 PolarHBondContact O-N 2.64Å; E785-D787 VanDerWaalsContact O-N 3.11Å; D787-K791 WeakPolarHBondContact O-CG 3.12Å; D787-K791 PolarHBondContact O-NZ 2.77Å; D787-K791 IonicContact OD1-NZ 2.99Å; D787-K791 IonicContact OD2-NZ 3.94Å; D787-K791 PolarHBondContact OD2-NZ 3.09Å
788	R	82.7	Confident	82.7	Confident	82 Å²	82	101.9 Å²	101.9	31%	0.309	47%	0.465	S	S	.	.	H	α-helix	trans	-90.3	-40.6	174.1	-147.7	-161.1	80.6	170.3	3.6	111.9	N65 M66 E67 A784 E785 E786 R790 K791 E792	N65-R788 WeakPolarHBondContact O-CD 3.11Å; N65-R788 PolarHBondContact O-NH1 3.49Å; M66-R788 PolarHBondContact O-NH1 3.38Å; E67-R788 VanDerWaalsContact CD-CZ 3.47Å; E67-R788 VanDerWaalsContact OE1-CB 3.3Å; E67-R788 WeakPolarHBondContact OE1-CB 3.34Å; E67-R788 WeakPolarHBondContact OE1-CD 3.22Å; E67-R788 IonicContact OE1-CZ 2.64Å; E67-R788 IonicContact OE1-NE 3.2Å; E67-R788 PolarHBondContact OE1-NE 3.45Å; E67-R788 IonicContact OE1-NH2 2.76Å; E67-R788 IonicContact OE2-CZ 3.67Å; E67-R788 IonicContact OE2-NE 2.77Å; E67-R788 PolarHBondContact OE2-NE 3.49Å; E67-R788 IonicContact OE2-NH2 3.02Å; E67-R788 PolarHBondContact OE2-NH2 3.08Å; A784-R788 PolarHBondContact O-N 2.83Å; E785-R788 PolarHBondContact O-N 3.22Å; E786-R788 PolarHBondContact O-N 3.14Å; R788-R790 PolarHBondContact O-N 3.36Å; R788-K791 CarbonylContact O-C 3.53Å; R788-K791 WeakPolarHBondContact O-CA 3.35Å; R788-K791 WeakPolarHBondContact O-CB 3.48Å; R788-K791 PolarHBondContact O-N 3.06Å; R788-E792 IonicContact NH2-OE2 2.69Å; R788-E792 PolarHBondContact O-N 2.98Å
789	L	78.8	Confident	83.1	Confident	92 Å²	92	102.6 Å²	102.6	48%	0.482	47%	0.467	S	S	.	.	H	α-helix	trans	-52.6	-44.1	170.7	-166.6	86.3	0	0	0	111	E67 E785 K791 E792 E793	E67-L789 PolarHBondContact OE2-N 3.22Å; E785-L789 PolarHBondContact O-N 3.49Å; L789-K791 VanDerWaalsContact C-N 3.25Å; L789-K791 PolarHBondContact O-N 3.27Å; L789-E792 CarbonylContact O-C 3.56Å; L789-E792 WeakPolarHBondContact O-CA 3.35Å; L789-E792 VanDerWaalsContact O-CB 3.29Å; L789-E792 WeakPolarHBondContact O-CB 3.41Å; L789-E792 PolarHBondContact O-N 2.91Å; L789-E793 WeakPolarHBondContact O-CB 3.3Å; L789-E793 PolarHBondContact O-N 2.84Å
790	R	85.8	Confident	83.7	Confident	159 Å²	159	103.5 Å²	103.5	60%	0.6	48%	0.475	S	S	*	.	H	α-helix	trans	-65.5	-21.9	175.2	-167.6	176.4	-164.5	150.5	10.6	114.5	E786 R788 E794	E786-R790 WeakPolarHBondContact O-CB 3.32Å; E786-R790 PolarHBondContact O-N 2.95Å; R788-R790 PolarHBondContact O-N 3.36Å; R790-E794 WeakPolarHBondContact O-CB 3.32Å; R790-E794 PolarHBondContact O-N 2.86Å
791	K	83.9	Confident	84.1	Confident	116 Å²	116	104.8 Å²	104.8	50%	0.504	47%	0.471	S	S	.	.	H	α-helix	trans	-84.6	-28.2	171	-66.8	174.8	-168.7	81.3	0	111.7	D787 R788 L789 K795	D787-K791 WeakPolarHBondContact O-CG 3.12Å; D787-K791 PolarHBondContact O-NZ 2.77Å; D787-K791 IonicContact OD1-NZ 2.99Å; D787-K791 IonicContact OD2-NZ 3.94Å; D787-K791 PolarHBondContact OD2-NZ 3.09Å; R788-K791 CarbonylContact O-C 3.53Å; R788-K791 WeakPolarHBondContact O-CA 3.35Å; R788-K791 WeakPolarHBondContact O-CB 3.48Å; R788-K791 PolarHBondContact O-N 3.06Å; L789-K791 VanDerWaalsContact C-N 3.25Å; L789-K791 PolarHBondContact O-N 3.27Å; K791-K795 WeakPolarHBondContact O-CB 3.31Å; K791-K795 PolarHBondContact O-N 3.41Å
792	E	84.1	Confident	84.5	Confident	66 Å²	66	104 Å²	104	31%	0.308	47%	0.472	S	S	.	.	H	α-helix	trans	-70.1	-50.2	172.2	-156.1	70.9	-115.5	0	0	110.3	R788 L789 K795 T796	R788-E792 IonicContact NH2-OE2 2.69Å; R788-E792 PolarHBondContact O-N 2.98Å; L789-E792 CarbonylContact O-C 3.56Å; L789-E792 WeakPolarHBondContact O-CA 3.35Å; L789-E792 VanDerWaalsContact O-CB 3.29Å; L789-E792 WeakPolarHBondContact O-CB 3.41Å; L789-E792 PolarHBondContact O-N 2.91Å; E792-K795 CarbonylContact O-C 3.58Å; E792-K795 WeakPolarHBondContact O-CA 3.47Å; E792-K795 WeakPolarHBondContact O-CB 3.34Å; E792-K795 PolarHBondContact O-N 3.02Å; E792-K795 IonicContact OE1-NZ 3.76Å; E792-K795 PolarHBondContact OE1-NZ 3.38Å; E792-T796 PolarHBondContact O-N 2.9Å; E792-T796 PolarHBondContact O-OG1 2.82Å
793	E	82.9	Confident	84.9	Confident	122 Å²	122	103.5 Å²	103.5	57%	0.57	48%	0.475	S	S	*	.	H	α-helix	trans	-56.8	-51.7	176.4	-175.9	-161.8	-163	0	0	112.5	L789 K795 T796 R797	L789-E793 WeakPolarHBondContact O-CB 3.3Å; L789-E793 PolarHBondContact O-N 2.84Å; E793-K795 PolarHBondContact O-N 3.1Å; E793-T796 PolarHBondContact O-N 2.78Å; E793-T796 PolarHBondContact O-OG1 2.87Å; E793-R797 WeakPolarHBondContact O-CB 3.44Å; E793-R797 PolarHBondContact O-N 2.82Å
794	E	83.8	Confident	84.9	Confident	57 Å²	57	100.9 Å²	100.9	27%	0.266	47%	0.465	S	S	.	.	H	α-helix	trans	-69.1	-15.1	177.8	175.5	61.3	-172.2	0	0	112.2	R790 R797 R798	R790-E794 WeakPolarHBondContact O-CB 3.32Å; R790-E794 PolarHBondContact O-N 2.86Å; E794-R797 IonicContact OE1-NH1 3.86Å; E794-R797 IonicContact OE2-CZ 2.9Å; E794-R797 IonicContact OE2-NH1 3.1Å; E794-R797 PolarHBondContact OE2-NH1 3.2Å; E794-R798 WeakPolarHBondContact O-CB 3.26Å; E794-R798 WeakPolarHBondContact O-CD 3.39Å; E794-R798 WeakPolarHBondContact O-CG 3.49Å; E794-R798 PolarHBondContact O-N 3.07Å; E794-R798 PolarHBondContact O-NE 3.29Å; E794-R798 IonicContact OE1-CZ 2.65Å; E794-R798 IonicContact OE1-NE 3.34Å; E794-R798 PolarHBondContact OE1-NE 3.21Å; E794-R798 IonicContact OE1-NH2 3.94Å; E794-R798 PolarHBondContact OE1-NH2 3.24Å
795	K	89.3	Confident	85.3	Confident	123 Å²	123	106 Å²	106	54%	0.535	48%	0.477	S	S	.	.	H	α-helix	trans	-84.7	-45.4	171.9	166.6	-167.9	160.2	-146.1	0	111.5	K791 E792 E793 R798 E799	K791-K795 WeakPolarHBondContact O-CB 3.31Å; K791-K795 PolarHBondContact O-N 3.41Å; E792-K795 CarbonylContact O-C 3.58Å; E792-K795 WeakPolarHBondContact O-CA 3.47Å; E792-K795 WeakPolarHBondContact O-CB 3.34Å; E792-K795 PolarHBondContact O-N 3.02Å; E792-K795 IonicContact OE1-NZ 3.76Å; E792-K795 PolarHBondContact OE1-NZ 3.38Å; E793-K795 PolarHBondContact O-N 3.1Å; K795-R798 PolarHBondContact O-N 3.2Å; K795-E799 PolarHBondContact O-N 2.63Å
796	T	86.6	Confident	85.9	Confident	81 Å²	81	107.7 Å²	107.7	50%	0.497	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-43.1	175.2	55.8	0	0	0	0	110.7	E792 E793 R798 E799 L800	E792-T796 PolarHBondContact O-N 2.9Å; E792-T796 PolarHBondContact O-OG1 2.82Å; E793-T796 PolarHBondContact O-N 2.78Å; E793-T796 PolarHBondContact O-OG1 2.87Å; T796-R798 VanDerWaalsContact C-N 3.33Å; T796-R798 PolarHBondContact O-N 3.13Å; T796-E799 PolarHBondContact O-N 3.11Å; T796-E799 VanDerWaalsContact O-N 3.14Å; T796-L800 WeakPolarHBondContact O-CB 3.49Å; T796-L800 PolarHBondContact O-N 3.2Å
797	R	90.8	Very high	86.4	Confident	146 Å²	146	108.7 Å²	108.7	55%	0.551	49%	0.487	S	S	*	.	H	α-helix	trans	-55.3	-42.8	172.5	-178	175	175.9	-112.1	-1.6	113	E793 E794 I801	E793-R797 WeakPolarHBondContact O-CB 3.44Å; E793-R797 PolarHBondContact O-N 2.82Å; E794-R797 IonicContact OE1-NH1 3.86Å; E794-R797 IonicContact OE2-CZ 2.9Å; E794-R797 IonicContact OE2-NH1 3.1Å; E794-R797 PolarHBondContact OE2-NH1 3.2Å; R797-I801 HydrophobicContact CG-CD1 4.31Å; R797-I801 WeakPolarHBondContact O-CD1 3.39Å; R797-I801 VanDerWaalsContact O-CG1 3.3Å; R797-I801 WeakPolarHBondContact O-CG1 3.3Å; R797-I801 PolarHBondContact O-N 3.25Å; R797-I801 VanDerWaalsContact O-N 3.16Å
798	R	86.7	Confident	86.8	Confident	158 Å²	158	112 Å²	112	60%	0.596	49%	0.493	S	S	*	.	H	α-helix	trans	-69.8	-37	176.1	-76.1	170.1	-169.4	-177.5	7.1	112.8	E794 K795 T796 K802	E794-R798 WeakPolarHBondContact O-CB 3.26Å; E794-R798 WeakPolarHBondContact O-CD 3.39Å; E794-R798 WeakPolarHBondContact O-CG 3.49Å; E794-R798 PolarHBondContact O-N 3.07Å; E794-R798 PolarHBondContact O-NE 3.29Å; E794-R798 IonicContact OE1-CZ 2.65Å; E794-R798 IonicContact OE1-NE 3.34Å; E794-R798 PolarHBondContact OE1-NE 3.21Å; E794-R798 IonicContact OE1-NH2 3.94Å; E794-R798 PolarHBondContact OE1-NH2 3.24Å; K795-R798 PolarHBondContact O-N 3.2Å; T796-R798 VanDerWaalsContact C-N 3.33Å; T796-R798 PolarHBondContact O-N 3.13Å; R798-K802 VanDerWaalsContact O-CB 3.31Å; R798-K802 WeakPolarHBondContact O-CB 3.31Å; R798-K802 PolarHBondContact O-N 3.48Å
799	E	88.3	Confident	87.1	Confident	73 Å²	73	112.9 Å²	112.9	34%	0.341	50%	0.499	S	S	.	.	H	α-helix	trans	-69.1	-39.1	176.6	-172.8	54.6	-141.6	0	0	111.4	K795 T796 K802 Q803	K795-E799 PolarHBondContact O-N 2.63Å; T796-E799 PolarHBondContact O-N 3.11Å; T796-E799 VanDerWaalsContact O-N 3.14Å; E799-K802 CarbonylContact O-C 3.55Å; E799-K802 WeakPolarHBondContact O-CB 3.18Å; E799-K802 PolarHBondContact O-N 2.9Å; E799-K802 IonicContact OE1-NZ 2.79Å; E799-K802 PolarHBondContact OE1-NZ 3.37Å; E799-K802 IonicContact OE2-NZ 2.63Å; E799-K802 PolarHBondContact OE2-NZ 3.48Å; E799-Q803 WeakPolarHBondContact O-CG 3.47Å; E799-Q803 PolarHBondContact O-N 3.05Å
800	L	91.9	Very high	87.3	Confident	116 Å²	116	115.4 Å²	115.4	61%	0.607	51%	0.508	S	S	*	.	H	α-helix	trans	-60.5	-48.7	174.4	-166.8	161.1	0	0	0	111.2	T796 K802 Q803 E804	T796-L800 WeakPolarHBondContact O-CB 3.49Å; T796-L800 PolarHBondContact O-N 3.2Å; L800-K802 VanDerWaalsContact C-N 3.27Å; L800-K802 PolarHBondContact O-N 2.88Å; L800-Q803 PolarHBondContact O-N 2.87Å; L800-E804 PolarHBondContact O-N 2.62Å
801	I	90.4	Very high	87	Confident	90 Å²	90	112.6 Å²	112.6	46%	0.462	50%	0.502	S	S	.	.	H	α-helix	trans	-59.3	-39	174.5	-67.7	164.5	0	0	0	111.3	R797 E804 Y805	R797-I801 HydrophobicContact CG-CD1 4.31Å; R797-I801 WeakPolarHBondContact O-CD1 3.39Å; R797-I801 VanDerWaalsContact O-CG1 3.3Å; R797-I801 WeakPolarHBondContact O-CG1 3.3Å; R797-I801 PolarHBondContact O-N 3.25Å; R797-I801 VanDerWaalsContact O-N 3.16Å; I801-E804 PolarHBondContact O-N 2.86Å; I801-Y805 WeakPolarHBondContact O-CB 3.41Å; I801-Y805 PolarHBondContact O-N 2.75Å
802	K	91.7	Very high	86.7	Confident	116 Å²	116	112.8 Å²	112.8	50%	0.504	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-37.9	176.8	164.8	169.8	157.8	-82.1	0	112.4	R798 E799 L800 L806	R798-K802 VanDerWaalsContact O-CB 3.31Å; R798-K802 WeakPolarHBondContact O-CB 3.31Å; R798-K802 PolarHBondContact O-N 3.48Å; E799-K802 CarbonylContact O-C 3.55Å; E799-K802 WeakPolarHBondContact O-CB 3.18Å; E799-K802 PolarHBondContact O-N 2.9Å; E799-K802 IonicContact OE1-NZ 2.79Å; E799-K802 PolarHBondContact OE1-NZ 3.37Å; E799-K802 IonicContact OE2-NZ 2.63Å; E799-K802 PolarHBondContact OE2-NZ 3.48Å; L800-K802 VanDerWaalsContact C-N 3.27Å; L800-K802 PolarHBondContact O-N 2.88Å; K802-L806 PolarHBondContact O-N 2.95Å; K802-L806 VanDerWaalsContact O-N 3.11Å
803	Q	87.3	Confident	85.8	Confident	121 Å²	121	114.5 Å²	114.5	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-70.5	-41.2	173.8	-71.1	-176.8	19.5	0	0	111.9	E799 L800 Y805 L806 R807	E799-Q803 WeakPolarHBondContact O-CG 3.47Å; E799-Q803 PolarHBondContact O-N 3.05Å; L800-Q803 PolarHBondContact O-N 2.87Å; Q803-Y805 VanDerWaalsContact C-N 3.35Å; Q803-Y805 PolarHBondContact O-N 2.95Å; Q803-L806 PolarHBondContact O-N 3.48Å; Q803-L806 VanDerWaalsContact O-N 3.16Å; Q803-R807 PolarHBondContact O-N 2.92Å
804	E	86.4	Confident	85.1	Confident	89 Å²	89	116.9 Å²	116.9	42%	0.416	52%	0.522	S	S	.	.	H	α-helix	trans	-58.7	-47	174.3	-164	-150.6	152.3	0	0	110.9	L800 I801 L806 R807 R808	L800-E804 PolarHBondContact O-N 2.62Å; I801-E804 PolarHBondContact O-N 2.86Å; E804-L806 VanDerWaalsContact C-N 3.32Å; E804-L806 PolarHBondContact O-N 3.49Å; E804-R807 PolarHBondContact O-N 2.83Å; E804-R808 VanDerWaalsContact O-CB 3.25Å; E804-R808 WeakPolarHBondContact O-CB 3.45Å; E804-R808 PolarHBondContact O-N 2.73Å; E804-R808 IonicContact OE1-NH1 2.69Å
805	Y	89.6	Confident	84.4	Confident	144 Å²	144	121.1 Å²	121.1	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-58.4	-41.9	175	177.9	-101.9	0	0	0	112.2	I801 Q803 K809	I801-Y805 WeakPolarHBondContact O-CB 3.41Å; I801-Y805 PolarHBondContact O-N 2.75Å; Q803-Y805 VanDerWaalsContact C-N 3.35Å; Q803-Y805 PolarHBondContact O-N 2.95Å; Y805-K809 HydrophobicContact CE1-CD 4.34Å; Y805-K809 VanDerWaalsContact O-CB 3.27Å; Y805-K809 WeakPolarHBondContact O-CB 3.32Å; Y805-K809 PolarHBondContact O-N 3.36Å
806	L	89.8	Confident	82.9	Confident	105 Å²	105	123 Å²	123	55%	0.55	55%	0.553	S	S	.	*	H	α-helix	trans	-66.3	-44	177.9	-133.4	72.1	0	0	0	112.3	K802 Q803 E804 K809 Q810	K802-L806 PolarHBondContact O-N 2.95Å; K802-L806 VanDerWaalsContact O-N 3.11Å; Q803-L806 PolarHBondContact O-N 3.48Å; Q803-L806 VanDerWaalsContact O-N 3.16Å; E804-L806 VanDerWaalsContact C-N 3.32Å; E804-L806 PolarHBondContact O-N 3.49Å; L806-K809 PolarHBondContact O-N 2.85Å; L806-Q810 PolarHBondContact O-N 3.46Å
807	R	86.4	Confident	81.4	Confident	137 Å²	137	126.7 Å²	126.7	52%	0.517	57%	0.565	S	S	.	*	H	α-helix	trans	-62.2	-45.9	176.1	-167.7	-164.1	68.8	68.5	0.9	111.1	Q803 E804 K809 Q810 Q811	Q803-R807 PolarHBondContact O-N 2.92Å; E804-R807 PolarHBondContact O-N 2.83Å; R807-K809 VanDerWaalsContact C-N 3.34Å; R807-K809 PolarHBondContact O-N 3.32Å; R807-Q810 PolarHBondContact O-N 2.84Å; R807-Q811 PolarHBondContact O-N 3.29Å
808	R	86.4	Confident	79.8	Confident	158 Å²	158	122.4 Å²	122.4	60%	0.596	57%	0.566	S	S	*	*	H	α-helix	trans	-62.9	-40.6	178.6	-166.1	172.5	-168.1	133.2	3.4	111.5	E804 Q811 E812	E804-R808 VanDerWaalsContact O-CB 3.25Å; E804-R808 WeakPolarHBondContact O-CB 3.45Å; E804-R808 PolarHBondContact O-N 2.73Å; E804-R808 IonicContact OE1-NH1 2.69Å; R808-Q811 WeakPolarHBondContact O-CB 3.29Å; R808-Q811 PolarHBondContact O-N 3.01Å; R808-E812 WeakPolarHBondContact O-CB 3.5Å; R808-E812 PolarHBondContact O-N 3.21Å
809	K	88.3	Confident	77.5	Confident	101 Å²	101	121.6 Å²	121.6	44%	0.439	57%	0.572	S	S	.	*	H	α-helix	trans	-68.1	-33.8	175.8	-172.6	167.5	-174.2	169.1	0	113.5	Y805 L806 R807 M813	Y805-K809 HydrophobicContact CE1-CD 4.34Å; Y805-K809 VanDerWaalsContact O-CB 3.27Å; Y805-K809 WeakPolarHBondContact O-CB 3.32Å; Y805-K809 PolarHBondContact O-N 3.36Å; L806-K809 PolarHBondContact O-N 2.85Å; R807-K809 VanDerWaalsContact C-N 3.34Å; R807-K809 PolarHBondContact O-N 3.32Å; K809-M813 WeakPolarHBondContact O-CB 3.21Å; K809-M813 WeakPolarHBondContact O-CG 3.3Å; K809-M813 PolarHBondContact O-N 2.86Å; K809-M813 VanDerWaalsContact O-N 3.09Å
810	Q	82.1	Confident	75.1	Confident	145 Å²	145	124.8 Å²	124.8	68%	0.678	60%	0.597	S	S	*	*	H	α-helix	trans	-67.8	-37.9	170.6	-76.9	-173.7	-8.7	0	0	112.1	L806 R807 F814	L806-Q810 PolarHBondContact O-N 3.46Å; R807-Q810 PolarHBondContact O-N 2.84Å; Q810-F814 PolarHBondContact O-N 3.01Å
811	Q	79.8	Confident	72.7	Confident	101 Å²	101	127.9 Å²	127.9	47%	0.472	61%	0.605	S	S	.	*	H	α-helix	trans	-65.1	-44.6	176.1	-173	173.6	-14.6	0	0	111.5	R807 R808 F814 E815	R807-Q811 PolarHBondContact O-N 3.29Å; R808-Q811 WeakPolarHBondContact O-CB 3.29Å; R808-Q811 PolarHBondContact O-N 3.01Å; Q811-F814 WeakPolarHBondContact O-CB 3.37Å; Q811-F814 PolarHBondContact O-N 3.39Å; Q811-F814 VanDerWaalsContact O-N 3.1Å; Q811-E815 PolarHBondContact O-N 3.01Å
812	E	78.4	Confident	70.3	Confident	120 Å²	120	129.7 Å²	129.7	56%	0.561	62%	0.623	S	S	*	*	H	α-helix	trans	-57.3	-47.9	174.1	-173.8	173.6	-141.7	0	0	112.1	R808 F814 E815 E816	R808-E812 WeakPolarHBondContact O-CB 3.5Å; R808-E812 PolarHBondContact O-N 3.21Å; E812-F814 PolarHBondContact O-N 3.48Å; E812-F814 VanDerWaalsContact O-N 3.16Å; E812-E815 PolarHBondContact O-N 3.41Å; E812-E816 PolarHBondContact O-N 2.85Å
813	M	65.6	Low	67.7	Low	101 Å²	101	133 Å²	133	50%	0.498	64%	0.637	S	S	.	*	H	α-helix	trans	-60.9	-20.7	174.5	-74.8	-74.2	-46	0	0	114.6	K809 Q817	K809-M813 WeakPolarHBondContact O-CB 3.21Å; K809-M813 WeakPolarHBondContact O-CG 3.3Å; K809-M813 PolarHBondContact O-N 2.86Å; K809-M813 VanDerWaalsContact O-N 3.09Å; M813-Q817 PolarHBondContact O-NE2 3.16Å
814	F	67.6	Low	65.6	Low	172 Å²	172	133.4 Å²	133.4	75%	0.754	65%	0.648	S	S	*	*	H	α-helix	trans	-92	-35.3	177.2	-165.4	-91.1	0	0	0	111.5	Q810 Q811 E812	Q810-F814 PolarHBondContact O-N 3.01Å; Q811-F814 WeakPolarHBondContact O-CB 3.37Å; Q811-F814 PolarHBondContact O-N 3.39Å; Q811-F814 VanDerWaalsContact O-N 3.1Å; E812-F814 PolarHBondContact O-N 3.48Å; E812-F814 VanDerWaalsContact O-N 3.16Å
815	E	69.1	Low	63.2	Low	146 Å²	146	134.6 Å²	134.6	68%	0.682	66%	0.664	S	S	*	*	H	α-helix	trans	-68.4	-39.9	175.7	-169.4	164.8	-171.4	0	0	112	Q811 E812 Q817 G818	Q811-E815 PolarHBondContact O-N 3.01Å; E812-E815 PolarHBondContact O-N 3.41Å; E815-Q817 PolarHBondContact O-N 3.36Å; E815-G818 PolarHBondContact O-N 3.46Å
816	E	59	Low	60.9	Low	162 Å²	162	137.6 Å²	137.6	76%	0.757	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-29.7	177	-168.5	-180	-177.3	0	0	113.1	E812 G818	E812-E816 PolarHBondContact O-N 2.85Å; E816-G818 VanDerWaalsContact C-N 3.28Å; E816-G818 PolarHBondContact O-N 3.12Å
817	Q	53.6	Low	58.3	Low	160 Å²	160	137.5 Å²	137.5	75%	0.748	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-0	176.5	-70.7	177.3	81.6	0	0	113.5	M813 E815	M813-Q817 PolarHBondContact O-NE2 3.16Å; E815-Q817 PolarHBondContact O-N 3.36Å
818	G	57.3	Low	55.5	Low	56 Å²	56	140.1 Å²	140.1	58%	0.577	70%	0.7	S	S	*	*	S	Bend	trans	-108.9	-2.9	-153.3	0	0	0	0	0	119.4	E815 E816	E815-G818 PolarHBondContact O-N 3.46Å; E816-G818 VanDerWaalsContact C-N 3.28Å; E816-G818 PolarHBondContact O-N 3.12Å
819	L	39.1	Very low	52.9	Low	140 Å²	140	140.2 Å²	140.2	73%	0.733	71%	0.708	S	S	*	*			trans	-144.6	97.9	-168.9	-160.4	62.9	0	0	0	118.1	K821	L819-K821 HydrophobicContact CD1-CD 4.41Å; L819-K821 HydrophobicContact CD1-CG 4.47Å
820	V	36.9	Very low	50	Low	141 Å²	141	142.8 Å²	142.8	86%	0.855	72%	0.719	S	S	*	*			trans	-123.8	120.6	156.1	176.1	0	0	0	0	109.6
821	K	43.1	Very low	47.3	Very low	181 Å²	181	142.3 Å²	142.3	79%	0.787	72%	0.716	S	S	*	*			trans	-143.3	109.3	171.8	-75.6	-175.3	179.4	169.7	0	112.2	L819	L819-K821 HydrophobicContact CD1-CD 4.41Å; L819-K821 HydrophobicContact CD1-CG 4.47Å
822	P	39.8	Very low	44.8	Very low	127 Å²	127	145.2 Å²	145.2	83%	0.825	73%	0.728	S	S	*	*			trans	-75.2	168.1	163.1	32.6	-33.3	0	0	0	111.3
823	K	36.4	Very low	42.8	Very low	186 Å²	186	147.4 Å²	147.4	81%	0.809	74%	0.737	S	S	*	*			trans	-128	125.3	-156	-169.7	176.3	-176	174.7	0	113
824	T	43	Very low	41.3	Very low	129 Å²	129	152.1 Å²	152.1	79%	0.791	76%	0.755	S	S	*	*			trans	65.1	155.4	164.7	44.9	0	0	0	0	116.5
825	P	36.6	Very low	39.6	Very low	115 Å²	115	148 Å²	148	75%	0.747	75%	0.752	S	S	*	*			cis	-129.9	167.2	27.4	41.6	-25.7	0	0	0	117.7
826	K	41.7	Very low	37.8	Very low	206 Å²	206	146.7 Å²	146.7	90%	0.896	75%	0.754	S	S	*	*			trans	-83.2	138.9	163.9	-66.6	-175.9	178.3	-177.9	0	110.3
827	P	35.1	Very low	36.5	Very low	103 Å²	103	146.6 Å²	146.6	67%	0.669	76%	0.757	S	S	*	*			trans	-142.9	148.4	130.5	35.3	-21.2	0	0	0	115
828	K	26.3	Very low	35.3	Very low	192 Å²	192	148.3 Å²	148.3	84%	0.835	76%	0.757	S	S	*	*			trans	51	104	147.1	-59.2	166.9	-173.6	175.5	0	117.3
829	Q	31.7	Very low	34	Very low	161 Å²	161	151.8 Å²	151.8	75%	0.752	76%	0.758	S	S	*	*				69	131.3	65.9	-162.3	-150.7	34	0	0	113.7
830	K	27	Very low	33.6	Very low	155 Å²	155	152.9 Å²	152.9	67%	0.674	76%	0.759	S	S	*	*			trans	81.4	143.1	176.3	-55.5	-177.3	-178.9	-172.3	0	114.4
831	H	27.3	Very low	33.2	Very low	134 Å²	134	151.1 Å²	151.1	62%	0.62	75%	0.754	S	S	*	*			cis	-158.8	140	-2.2	-111.5	-32.6	0	0	0	111
832	K	27.1	Very low	32.4	Very low	163 Å²	163	146.5 Å²	146.5	71%	0.709	75%	0.749	S	S	*	*			trans	57.2	154	147.8	-56.6	174.7	179.2	177.4	0	117
833	H	35.9	Very low	32	Very low	166 Å²	166	146 Å²	146	77%	0.769	74%	0.744	S	S	*	*			cis	-146.5	163.2	31.6	-77.9	-107.4	0	0	0	113.8
834	K	33.3	Very low	31.6	Very low	200 Å²	200	144.1 Å²	144.1	87%	0.87	74%	0.743	S	S	*	*			trans	-10.8	153.3	149.9	-75.2	-175.3	173.6	-169.6	0	118.5
835	A	32.9	Very low	30.9	Very low	84 Å²	84	145.3 Å²	145.3	69%	0.694	74%	0.739	S	S	*	*			cis	-159.4	-174.5	-3.1	0	0	0	0	0	108.4
836	V	30.9	Very low	30.5	Very low	120 Å²	120	148.3 Å²	148.3	73%	0.727	74%	0.741	S	S	*	*				-174.3	137.2	59.2	165.4	0	0	0	0	109.9
837	I	30.6	Very low	29.8	Very low	159 Å²	159	142.6 Å²	142.6	82%	0.815	73%	0.727	S	S	*	*			trans	64.1	152	163.1	-73.6	168.6	0	0	0	116.8
838	R	28.7	Very low	29.3	Very low	197 Å²	197	147.1 Å²	147.1	74%	0.743	74%	0.736	S	S	*	*			cis	177.3	143.5	-28.3	-175.1	177.5	-178.1	161.8	9.1	104.9
839	E	30.7	Very low	29.1	Very low	128 Å²	128	143.5 Å²	143.5	60%	0.598	73%	0.733	S	S	*	*			cis	-121.2	139.8	-6.2	-126.4	134.6	-168.4	0	0	106.4
840	E	29.5	Very low	28.7	Very low	163 Å²	163	141.2 Å²	141.2	76%	0.762	74%	0.735	S	S	*	*				58	110.6	101.3	-59.5	-103.5	104.8	0	0	113.2
841	S	30.1	Very low	29	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	74%	0.736	S	S	*	*				79.3	144.1	70.6	-67.8	0	0	0	0	112.8
842	A	25.3	Very low	29.3	Very low	84 Å²	84	138.2 Å²	138.2	69%	0.694	74%	0.744	S	S	*	*			cis	-164.9	167.7	-14.9	0	0	0	0	0	110.9
843	T	30.8	Very low	30	Very low	117 Å²	117	135.8 Å²	135.8	72%	0.718	74%	0.744	S	S	*	*			trans	-11.4	138.1	138.5	-43.6	0	0	0	0	116.5	H845	T843-H845 HydrophobicContact CG2-CB 4.4Å
844	D	28.1	Very low	29.7	Very low	145 Å²	145	134 Å²	134	78%	0.775	74%	0.741	S	S	*	*			trans	-123.7	151	156.9	-150.3	-16	0	0	0	112	F846	D844-F846 VanDerWaalsContact OD1-CE2 3.29Å; D844-F846 WeakPolarHBondContact OD1-CE2 3.42Å
845	H	28.7	Very low	29.7	Very low	154 Å²	154	130.7 Å²	130.7	71%	0.713	73%	0.732	S	S	*	*			trans	-153.4	75.7	-140.7	-145.5	-23.1	0	0	0	113.9	T843	T843-H845 HydrophobicContact CG2-CB 4.4Å
846	F	28.7	Very low	30.3	Very low	179 Å²	179	133.5 Å²	133.5	79%	0.785	74%	0.735	S	S	*	*			trans	-126.7	127.5	173.5	-64.8	-87.1	0	0	0	111.1	D844	D844-F846 VanDerWaalsContact OD1-CE2 3.29Å; D844-F846 WeakPolarHBondContact OD1-CE2 3.42Å
847	S	26.6	Very low	30.5	Very low	86 Å²	86	133 Å²	133	60%	0.601	74%	0.736	S	S	*	*			cis	84.1	87.6	22.3	97.7	0	0	0	0	116.3
848	K	25.7	Very low	30.6	Very low	197 Å²	197	132.3 Å²	132.3	86%	0.857	74%	0.735	S	S	*	*				177.3	145.8	124.8	-98.9	164	-179.9	168.1	0	115.8
849	C	21.8	Very low	30.9	Very low	117 Å²	117	126 Å²	126	79%	0.791	73%	0.725	S	S	*	*			trans	41.3	130.4	139.8	-59.4	0	0	0	0	124
850	S	23.2	Very low	31.3	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	74%	0.738	S	S	*	*			trans	100.9	154	131.5	-148	0	0	0	0	119.6
851	S	32.6	Very low	31.4	Very low	98 Å²	98	126.5 Å²	126.5	69%	0.685	74%	0.739	S	S	*	*			trans	59.7	123.1	-174.1	26.6	0	0	0	0	115.2
852	T	33.9	Very low	31.4	Very low	128 Å²	128	124.6 Å²	124.6	79%	0.785	74%	0.736	S	S	*	*			cis	62.7	143.7	43.4	75.5	0	0	0	0	114.4
853	P	40.9	Very low	31.7	Very low	112 Å²	112	125.7 Å²	125.7	73%	0.727	74%	0.739	S	S	*	*			cis	-111.8	-176.4	-15.2	36.9	-21.3	0	0	0	111
854	D	29.9	Very low	31.9	Very low	129 Å²	129	126.1 Å²	126.1	69%	0.69	74%	0.737	S	S	*	*			cis	-156.5	160.1	-19.5	-104.4	-2.1	0	0	0	106.9
855	N	33.4	Very low	32.2	Very low	130 Å²	130	127.3 Å²	127.3	70%	0.695	74%	0.742	S	S	*	*			cis	73.9	137.1	47	-58.6	-51.2	0	0	0	113.6
856	L	46	Very low	32.5	Very low	143 Å²	143	125.1 Å²	125.1	75%	0.749	74%	0.744	S	S	*	*			cis	-141.1	141.6	8.7	-78.6	179.2	0	0	0	114.1
857	S	34.8	Very low	32.7	Very low	108 Å²	108	124.4 Å²	124.4	76%	0.755	75%	0.748	S	S	*	*			trans	69.6	158.3	136.4	80.2	0	0	0	0	120.4
858	N	33	Very low	32.9	Very low	146 Å²	146	124.5 Å²	124.5	78%	0.781	75%	0.754	S	S	*	*			cis	-141.5	158.7	8.4	-156.4	13.6	0	0	0	114.6
859	A	35.1	Very low	33.1	Very low	65 Å²	65	120.8 Å²	120.8	54%	0.537	75%	0.753	S	S	.	*			trans	-5.2	150.3	157.6	0	0	0	0	0	119.8
860	Q	39.9	Very low	33.6	Very low	188 Å²	188	120 Å²	120	88%	0.879	75%	0.754	S	S	*	*			cis	-175.7	165.1	3.3	-107.1	169.4	-22.3	0	0	106.2
861	S	30.1	Very low	34	Very low	112 Å²	112	118.7 Å²	118.7	78%	0.783	75%	0.751	S	S	*	*			cis	-167.7	143.8	-13.2	-171.5	0	0	0	0	108.3
862	G	31.1	Very low	34	Very low	65 Å²	65	120.3 Å²	120.3	67%	0.67	76%	0.756	S	S	*	*			trans	76.1	113	173.8	0	0	0	0	0	114.6
863	S	32.1	Very low	34.1	Very low	108 Å²	108	120.5 Å²	120.5	76%	0.755	75%	0.753	S	S	*	*			cis	65.2	125.9	30	-143.6	0	0	0	0	111.8
864	N	35.1	Very low	33.8	Very low	125 Å²	125	122.9 Å²	122.9	67%	0.668	75%	0.754	S	S	*	*			cis	-169.7	153	5.4	31.5	-112.6	0	0	0	111.2
865	L	34.5	Very low	34.2	Very low	170 Å²	170	120.8 Å²	120.8	89%	0.89	76%	0.755	S	S	*	*				171.4	158.6	129.9	-93.5	164.2	0	0	0	111.5
866	S	33.4	Very low	34.1	Very low	108 Å²	108	121.2 Å²	121.2	76%	0.755	76%	0.757	S	S	*	*			trans	-119.5	143.3	-172.3	-77.6	0	0	0	0	113.7
867	L	33.4	Very low	33.5	Very low	164 Å²	164	118.9 Å²	118.9	86%	0.859	75%	0.753	S	S	*	*			trans	63.1	106.1	153.9	-61.3	173.1	0	0	0	120.7
868	A	31.2	Very low	33.3	Very low	88 Å²	88	119.8 Å²	119.8	73%	0.727	75%	0.753	S	S	*	*				72.9	139.9	123.3	0	0	0	0	0	123.3
869	S	29.7	Very low	33.2	Very low	120 Å²	120	119.3 Å²	119.3	84%	0.839	75%	0.751	S	S	*	*			trans	79.2	155.7	155.7	-59.8	0	0	0	0	119.4
870	A	31.8	Very low	32.9	Very low	99 Å²	99	121.4 Å²	121.4	82%	0.818	76%	0.762	S	S	*	*			trans	60.9	108.7	-167.9	0	0	0	0	0	113.9
871	A	31.8	Very low	32.3	Very low	87 Å²	87	116.3 Å²	116.3	72%	0.719	76%	0.759	S	S	*	*			cis	88	144.1	37.2	0	0	0	0	0	114.5
872	T	32.5	Very low	32.2	Very low	131 Å²	131	114.6 Å²	114.6	80%	0.804	76%	0.759	S	S	*	*			trans	59.9	113.5	171.1	40.4	0	0	0	0	117
873	N	37.2	Very low	32	Very low	133 Å²	133	116.8 Å²	116.8	71%	0.711	77%	0.771	S	S	*	*				73.2	140.9	103.8	-103.1	27.8	0	0	0	113.4
874	E	34.7	Very low	31.9	Very low	162 Å²	162	115.2 Å²	115.2	76%	0.757	77%	0.772	S	S	*	*			cis	-135.8	-168.3	31.7	-70.7	-63.7	160.6	0	0	114
875	A	38	Very low	31.6	Very low	84 Å²	84	114.4 Å²	114.4	69%	0.694	78%	0.776	S	S	*	*			trans	-74.1	-176.1	179.9	0	0	0	0	0	114.3
876	D	31.6	Very low	31.5	Very low	140 Å²	140	112.6 Å²	112.6	75%	0.749	76%	0.763	S	S	*	*			cis	-158.8	169.1	15.5	-152.3	-51.2	0	0	0	111.9
877	S	32.5	Very low	31.5	Very low	94 Å²	94	117.2 Å²	117.2	66%	0.657	76%	0.764	S	S	*	*			trans	46.4	123.5	150.8	-76.2	0	0	0	0	121.9
878	V	31.1	Very low	31.3	Very low	127 Å²	127	114.4 Å²	114.4	77%	0.77	76%	0.756	S	S	*	*				-164	118.9	105.5	-97.5	0	0	0	0	115.1
879	N	30.7	Very low	31	Very low	136 Å²	136	117 Å²	117	73%	0.727	76%	0.758	S	S	*	*			trans	54.9	157.7	136.3	81.1	52.8	0	0	0	125.3
880	S	29	Very low	30.8	Very low	109 Å²	109	116.9 Å²	116.9	76%	0.762	76%	0.757	S	S	*	*			trans	83	112.4	149	-56.3	0	0	0	0	123.4
881	G	26.6	Very low	30.8	Very low	80 Å²	80	117.7 Å²	117.7	83%	0.825	75%	0.752	S	S	*	*				118.7	141.2	123.2	0	0	0	0	0	119.2
882	G	27.6	Very low	30.6	Very low	76 Å²	76	121 Å²	121	78%	0.784	75%	0.752	S	S	*	*			trans	76.4	109.9	168.8	0	0	0	0	0	114.9
883	A	28.4	Very low	30.3	Very low	112 Å²	112	119.5 Å²	119.5	93%	0.926	75%	0.747	S	S	*	*			cis	67.8	108.8	23.1	0	0	0	0	0	114.9
884	G	29	Very low	30	Very low	74 Å²	74	122.8 Å²	122.8	76%	0.763	76%	0.755	S	S	*	*			trans	148.1	87.8	-174.2	0	0	0	0	0	109.8
885	S	28.5	Very low	30.1	Very low	108 Å²	108	121 Å²	121	76%	0.755	76%	0.758	S	S	*	*				66.1	129.4	64.5	-152.1	0	0	0	0	112.2
886	Q	32.7	Very low	29.6	Very low	132 Å²	132	120.7 Å²	120.7	62%	0.617	76%	0.763	S	S	*	*			cis	-172.8	152.1	-11.4	-118.3	-176.1	16.2	0	0	107.5
887	R	33.2	Very low	29.6	Very low	206 Å²	206	119.4 Å²	119.4	78%	0.777	77%	0.765	S	S	*	*			trans	66.8	159.3	147.1	-65.9	175.9	-175.8	-179.7	5.2	118
888	C	28.8	Very low	29.5	Very low	104 Å²	104	125.5 Å²	125.5	70%	0.703	77%	0.773	S	S	*	*			cis	-149.7	175.9	-13	-120.7	0	0	0	0	112.5
889	D	25.4	Very low	29.7	Very low	144 Å²	144	126.1 Å²	126.1	77%	0.77	77%	0.773	S	S	*	*			trans	-51.3	156	176.2	-46.3	-107.9	0	0	0	116.4
890	S	25.9	Very low	29.8	Very low	116 Å²	116	126.4 Å²	126.4	81%	0.811	77%	0.774	S	S	*	*				-151.5	150.9	115.7	-167.9	0	0	0	0	111.2
891	V	31.7	Very low	30	Very low	117 Å²	117	126 Å²	126	71%	0.709	77%	0.771	S	S	*	*			trans	-90	164.6	168.1	-64.1	0	0	0	0	110.5
892	E	27.8	Very low	30.6	Very low	155 Å²	155	133.7 Å²	133.7	72%	0.724	78%	0.775	S	S	*	*				-175.9	132.6	117.4	-164	45.1	-103.3	0	0	113.4
893	S	27.1	Very low	30.8	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	78%	0.776	S	S	*	*			trans	56.6	160.1	157	-77.1	0	0	0	0	125.3
894	F	29.2	Very low	31.5	Very low	202 Å²	202	134.3 Å²	134.3	89%	0.886	77%	0.773	S	S	*	*			trans	-115.2	-178.4	-173.1	-87	-85.3	0	0	0	110.5
895	P	38.4	Very low	32.4	Very low	126 Å²	126	137.5 Å²	137.5	82%	0.818	77%	0.768	S	S	*	*			cis	-132.9	-175.8	9.8	43.2	-26.4	0	0	0	116
896	G	26.7	Very low	33.6	Very low	77 Å²	77	142.4 Å²	142.4	79%	0.794	77%	0.77	S	S	*	*			trans	138.3	30.8	149.4	0	0	0	0	0	121.3
897	S	32.1	Very low	33.9	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	78%	0.775	S	S	*	*			trans	-157	127	164.9	-173	0	0	0	0	115.3
898	R	30.7	Very low	34.4	Very low	222 Å²	222	144.9 Å²	144.9	84%	0.838	78%	0.784	S	S	*	*			trans	153	145.5	153.4	-87.4	154.4	-166.4	-96.9	-2.1	109
899	N	34	Very low	34.9	Very low	141 Å²	141	147.4 Å²	147.4	75%	0.754	79%	0.79	S	S	*	*			cis	-178.2	179.3	-18.4	53.1	-6.3	0	0	0	106.3
900	N	32.7	Very low	35.6	Very low	141 Å²	141	147.1 Å²	147.1	75%	0.754	79%	0.789	S	S	*	*			cis	-169.4	147.8	-48.1	174.3	24.4	0	0	0	105.4
901	S	33.5	Very low	36.2	Very low	100 Å²	100	145 Å²	145	70%	0.699	79%	0.786	S	S	*	*			trans	-177.5	113.8	145.1	43.4	0	0	0	0	114
902	R	38.8	Very low	36.8	Very low	243 Å²	243	144.7 Å²	144.7	92%	0.917	79%	0.788	S	S	*	*				167.6	78.2	116	-87.8	170.5	-167.7	-134.6	2	111.4
903	A	32.3	Very low	37.3	Very low	97 Å²	97	143.6 Å²	143.6	80%	0.802	79%	0.792	S	S	*	*			trans	-146.4	126	159.8	0	0	0	0	0	107.3
904	A	43.2	Very low	37.7	Very low	103 Å²	103	143.1 Å²	143.1	85%	0.851	80%	0.795	S	S	*	*			trans	-164.6	45.7	-177.5	0	0	0	0	0	111
905	E	48.1	Very low	38	Very low	142 Å²	142	139.1 Å²	139.1	66%	0.664	79%	0.792	S	S	*	*	S	Bend	trans	-157	119.8	177.2	-171.1	-161.5	90.5	0	0	108.7
906	R	53.9	Low	37.9	Very low	211 Å²	211	138.5 Å²	138.5	80%	0.796	79%	0.791	S	S	*	*			trans	80.2	73	-173.9	-59.9	162.6	-99.6	-177.6	-8.7	116.3
907	D	39.2	Very low	38.9	Very low	135 Å²	135	142.7 Å²	142.7	72%	0.722	79%	0.793	S	S	*	*			trans	-115.5	95.2	157.5	-70.2	-59.5	0	0	0	109.9
908	W	43.4	Very low	39.2	Very low	255 Å²	255	143.9 Å²	143.9	97%	0.966	80%	0.796	S	S	*	*			trans	-139.6	10.8	166.4	-87.5	117.6	0	0	0	112.4
909	D	39.5	Very low	39.5	Very low	156 Å²	156	138.5 Å²	138.5	83%	0.834	79%	0.792	S	S	*	*			trans	-92.1	7.9	-173.2	-136.4	-12.5	0	0	0	113.5	G911	D909-G911 PolarHBondContact O-N 3.12Å
910	N	39.8	Very low	40	Very low	138 Å²	138	141.3 Å²	141.3	74%	0.738	80%	0.803	S	S	*	*			trans	-100.8	40.2	-177.1	-89	97.8	0	0	0	113.7
911	G	38.4	Very low	40.4	Very low	73 Å²	73	138.3 Å²	138.3	75%	0.753	80%	0.798	S	S	*	*	S	Bend	trans	-92.4	-2.2	174.7	0	0	0	0	0	115.7	D909	D909-G911 PolarHBondContact O-N 3.12Å
912	S	44.4	Very low	41.2	Very low	109 Å²	109	142.4 Å²	142.4	76%	0.762	81%	0.806	S	S	*	*			trans	-137.1	55.7	-162.3	-61.4	0	0	0	0	114.6
913	T	37.2	Very low	41.3	Very low	132 Å²	132	140.6 Å²	140.6	81%	0.81	80%	0.801	S	S	*	*			trans	-128.5	44	168.7	49	0	0	0	0	113.4
914	A	37.2	Very low	41.9	Very low	91 Å²	91	142.5 Å²	142.5	75%	0.752	80%	0.803	S	S	*	*			trans	-147.5	133.1	150.1	0	0	0	0	0	106.9
915	S	35.4	Very low	42.6	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	77%	0.774	S	S	*	*			cis	-127	161.7	12.8	-63.2	0	0	0	0	113.1
916	S	34.5	Very low	43.2	Very low	113 Å²	113	137.1 Å²	137.1	79%	0.79	78%	0.776	S	S	*	*			trans	-63.5	153.1	180	-49.8	0	0	0	0	113.9
917	I	48.3	Very low	43.7	Very low	164 Å²	164	133 Å²	133	84%	0.841	76%	0.764	S	S	*	*			trans	-75.3	125.9	160	73.7	-178.5	0	0	0	108.5
918	T	39.9	Very low	44.8	Very low	138 Å²	138	134.6 Å²	134.6	85%	0.847	77%	0.772	S	S	*	*			trans	177.2	46	153.5	38.4	0	0	0	0	113.2
919	S	36.6	Very low	45.3	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	77%	0.769	S	S	*	*			trans	-162.7	125.7	155.4	46.5	0	0	0	0	111.6	A921	S919-A921 PolarHBondContact O-N 3.28Å
920	M	44.9	Very low	46.9	Very low	199 Å²	199	133.8 Å²	133.8	98%	0.98	77%	0.768	S	S	*	*			trans	-86.2	85.2	165.2	-89	-72.3	-171.1	0	0	108.5
921	A	40.6	Very low	47.7	Very low	79 Å²	79	135.6 Å²	135.6	65%	0.653	77%	0.772	S	S	*	*			trans	-128.7	123.6	158.2	0	0	0	0	0	106.6	S919 Y923	S919-A921 PolarHBondContact O-N 3.28Å; A921-Y923 VanDerWaalsContact C-N 3.33Å; A921-Y923 PolarHBondContact O-N 2.76Å
922	E	49.5	Very low	48.7	Very low	185 Å²	185	136.6 Å²	136.6	86%	0.864	77%	0.765	S	S	*	*			trans	-71.9	92.6	178.1	-70.6	178.8	126.6	0	0	108.5	T924	E922-T924 PolarHBondContact O-N 2.69Å; E922-T924 PolarHBondContact O-OG1 2.79Å
923	Y	41.6	Very low	49.2	Very low	206 Å²	206	135 Å²	135	81%	0.808	75%	0.753	S	S	*	*			trans	-70.8	77.5	175.1	-176.5	-105.1	0	0	0	109.9	A921 G925	A921-Y923 VanDerWaalsContact C-N 3.33Å; A921-Y923 PolarHBondContact O-N 2.76Å; Y923-G925 PolarHBondContact O-N 3.44Å
924	T	45	Very low	50.4	Low	136 Å²	136	133.1 Å²	133.1	83%	0.834	75%	0.751	S	S	*	*			trans	-74.2	47.6	167.2	-47.6	0	0	0	0	109.7	E922	E922-T924 PolarHBondContact O-N 2.69Å; E922-T924 PolarHBondContact O-OG1 2.79Å
925	G	57.7	Low	52.5	Low	25 Å²	25	136.2 Å²	136.2	26%	0.258	75%	0.748	S	S	.	*	P	Polyproline II helix	trans	-72.3	161.9	169.9	0	0	0	0	0	110.7	Y923 K927	Y923-G925 PolarHBondContact O-N 3.44Å; G925-K927 PolarHBondContact O-N 3.3Å
926	P	61.3	Low	55.1	Low	108 Å²	108	132.3 Å²	132.3	70%	0.701	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-52.5	129.3	174	-25.5	34.8	0	0	0	110.9	L928	P926-L928 PolarHBondContact O-N 3.04Å
927	K	64.2	Low	58	Low	123 Å²	123	127.2 Å²	127.2	54%	0.535	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-54.1	126.7	172.4	-73.8	179.4	174	179.5	0	107.5	G925 F929 E996	G925-K927 PolarHBondContact O-N 3.3Å; K927-F929 PolarHBondContact O-N 2.83Å; K927-E996 WeakPolarHBondContact CE-OE1 3.42Å; K927-E996 IonicContact NZ-OE1 2.91Å; K927-E996 PolarHBondContact NZ-OE1 2.86Å
928	L	62.4	Low	60.2	Low	170 Å²	170	122.1 Å²	122.1	89%	0.89	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-53.8	117.6	177.5	-74.3	169.4	0	0	0	108.9	P926 K930	P926-L928 PolarHBondContact O-N 3.04Å; L928-K930 VanDerWaalsContact C-N 3.26Å; L928-K930 PolarHBondContact O-N 2.92Å
929	F	53.7	Low	62.7	Low	206 Å²	206	120 Å²	120	90%	0.904	65%	0.645	S	S	*	*			trans	-69.2	82.6	-176	-70	-81.1	0	0	0	111	K927	K927-F929 PolarHBondContact O-N 2.83Å
930	K	72.9	Confident	65.5	Low	187 Å²	187	117.2 Å²	117.2	81%	0.813	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-102.6	129.2	160.4	-177.8	166.2	-174.9	166.2	0	107.3	L928	L928-K930 VanDerWaalsContact C-N 3.26Å; L928-K930 PolarHBondContact O-N 2.92Å
931	E	55	Low	68	Low	177 Å²	177	107.8 Å²	107.8	83%	0.827	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-48.2	129.4	-177.3	-64	177.6	162.1	0	0	111.5	S933	E931-S933 PolarHBondContact O-N 2.84Å
932	P	59.5	Low	70.6	Confident	94 Å²	94	108.4 Å²	108.4	61%	0.61	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-54.7	124.1	173.1	-26	35	0	0	0	109.8	A934	P932-A934 PolarHBondContact O-N 3.27Å
933	S	55.4	Low	72.7	Confident	74 Å²	74	102 Å²	102	52%	0.517	54%	0.535	S	S	.	.			trans	-69.5	104.1	-177.7	-168.8	0	0	0	0	109.4	E931 K935	E931-S933 PolarHBondContact O-N 2.84Å; S933-K935 PolarHBondContact O-N 3.27Å
934	A	62.1	Low	75.3	Confident	93 Å²	93	92.1 Å²	92.1	77%	0.769	50%	0.497	S	S	*	.			trans	-66.2	22.9	179.8	0	0	0	0	0	114.5	P932 S936	P932-A934 PolarHBondContact O-N 3.27Å; A934-S936 PolarHBondContact O-N 3.49Å
935	K	82.3	Confident	77.7	Confident	157 Å²	157	85.7 Å²	85.7	68%	0.683	46%	0.457	S	S	*	.			trans	-89.7	89	-179.2	-174.6	-180	178.1	177.2	0	109.9	S933 H973	S933-K935 PolarHBondContact O-N 3.27Å; K935-H973 PolarHBondContact O-CE1 3.34Å; K935-H973 VanDerWaalsContact O-CE1 3.26Å
936	S	90.6	Very high	79.5	Confident	36 Å²	36	85.5 Å²	85.5	25%	0.252	45%	0.452	S	S	.	.			trans	-54.5	141.9	172.9	177	0	0	0	0	112.6	A934 K938 N972	A934-S936 PolarHBondContact O-N 3.49Å; S936-K938 VanDerWaalsContact OG-CB 3.25Å; S936-K938 WeakPolarHBondContact OG-CB 3.43Å; S936-K938 PolarHBondContact OG-N 2.73Å; S936-K938 VanDerWaalsContact OG-N 3.08Å; S936-N972 WeakPolarHBondContact CA-O 3.47Å; S936-N972 VanDerWaalsContact CB-O 3.23Å; S936-N972 WeakPolarHBondContact CB-O 3.46Å; S936-N972 PolarHBondContact OG-O 3.02Å
937	N	94.4	Very high	80.9	Confident	6 Å²	6	85.2 Å²	85.2	3%	0.032	44%	0.441	C	S	.	.			trans	-97.1	4.5	170.5	77.9	-26.7	0	0	0	113.5	P939 I940 I941 N972 H973 L974 D1040	N937-P939 VanDerWaalsContact C-CD 3.49Å; N937-I940 HydrophobicContact CB-CB 4.4Å; N937-I940 HydrophobicContact CB-CD1 4.17Å; N937-I940 HydrophobicContact CB-CG1 4.46Å; N937-I940 WeakPolarHBondContact O-CA 3.33Å; N937-I940 VanDerWaalsContact O-CB 3.28Å; N937-I940 WeakPolarHBondContact O-CB 3.5Å; N937-I940 PolarHBondContact O-N 2.84Å; N937-I941 PolarHBondContact O-N 2.74Å; N937-N972 PolarHBondContact N-O 2.76Å; N937-H973 WeakPolarHBondContact OD1-CA 3.14Å; N937-L974 PolarHBondContact ND2-O 3.39Å; N937-L974 PolarHBondContact OD1-N 2.88Å; N937-L974 PolarHBondContact OD1-O 3.45Å; N937-D1040 PolarHBondContact ND2-OD1 3.25Å
938	K	94.1	Very high	82.2	Confident	57 Å²	57	81.7 Å²	81.7	25%	0.248	43%	0.431	C	S	.	.	H	α-helix	trans	-43.9	-46.9	176.8	-174.5	165.4	175.9	168.7	0	114.5	S936 I940 I941 H942 L966 E967 C969 L974	S936-K938 VanDerWaalsContact OG-CB 3.25Å; S936-K938 WeakPolarHBondContact OG-CB 3.43Å; S936-K938 PolarHBondContact OG-N 2.73Å; S936-K938 VanDerWaalsContact OG-N 3.08Å; K938-I940 VanDerWaalsContact C-N 3.35Å; K938-I940 PolarHBondContact O-N 2.91Å; K938-I941 PolarHBondContact O-N 3.24Å; K938-H942 WeakPolarHBondContact O-CB 3.47Å; K938-H942 PolarHBondContact O-N 3.45Å; K938-L966 WeakPolarHBondContact CE-O 3.24Å; K938-L966 HydrophobicContact CG-CD1 4.14Å; K938-L966 HydrophobicContact CG-CG 4.45Å; K938-L966 PolarHBondContact NZ-O 3.2Å; K938-L966 VanDerWaalsContact NZ-O 3.09Å; K938-E967 PolarHBondContact NZ-O 3.07Å; K938-C969 PolarHBondContact NZ-O 3.03Å; K938-L974 HydrophobicContact CB-CD1 3.93Å; K938-L974 HydrophobicContact CD-CD1 4.44Å; K938-L974 HydrophobicContact CG-CD1 4.14Å
939	P	93.8	Very high	83.6	Confident	92 Å²	92	74.4 Å²	74.4	60%	0.597	39%	0.394	S	S	*	.	H	α-helix	trans	-70.5	-25.5	176.5	27.3	-35.7	0	0	0	114.4	N937 N943	N937-P939 VanDerWaalsContact C-CD 3.49Å; P939-N943 WeakPolarHBondContact O-CB 3.05Å; P939-N943 PolarHBondContact O-N 2.87Å
940	I	95	Very high	85.5	Confident	52 Å²	52	64.9 Å²	64.9	27%	0.267	35%	0.353	S	S	.	.	H	α-helix	trans	-71.1	-45.8	174.8	-51.7	-177.5	0	0	0	109.1	N937 K938 N943 A944 Y1020	N937-I940 HydrophobicContact CB-CB 4.4Å; N937-I940 HydrophobicContact CB-CD1 4.17Å; N937-I940 HydrophobicContact CB-CG1 4.46Å; N937-I940 WeakPolarHBondContact O-CA 3.33Å; N937-I940 VanDerWaalsContact O-CB 3.28Å; N937-I940 WeakPolarHBondContact O-CB 3.5Å; N937-I940 PolarHBondContact O-N 2.84Å; K938-I940 VanDerWaalsContact C-N 3.35Å; K938-I940 PolarHBondContact O-N 2.91Å; I940-N943 PolarHBondContact O-N 2.99Å; I940-A944 WeakPolarHBondContact O-CB 3.39Å; I940-A944 PolarHBondContact O-N 3.4Å; I940-Y1020 HydrophobicContact CG2-CD1 3.71Å; I940-Y1020 HydrophobicContact CG2-CG 4.35Å
941	I	95.9	Very high	86.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-44.3	176.1	-62.1	-58.3	0	0	0	111.5	N937 K938 N943 A944 I945 L966 L974 I976 L988 D1040	N937-I941 PolarHBondContact O-N 2.74Å; K938-I941 PolarHBondContact O-N 3.24Å; I941-N943 VanDerWaalsContact C-N 3.34Å; I941-N943 PolarHBondContact O-N 3.44Å; I941-A944 PolarHBondContact O-N 3.5Å; I941-I945 HydrophobicContact CG2-CD1 3.66Å; I941-I945 HydrophobicContact CG2-CG1 4.34Å; I941-I945 WeakPolarHBondContact O-CB 3.49Å; I941-I945 WeakPolarHBondContact O-CG1 3.47Å; I941-I945 PolarHBondContact O-N 3.28Å; I941-L966 HydrophobicContact CG2-CD1 4.16Å; I941-L966 HydrophobicContact CG2-CD2 4.39Å; I941-L974 HydrophobicContact CG1-CB 4.04Å; I941-L974 HydrophobicContact CG2-CB 4.42Å; I941-I976 HydrophobicContact CD1-CD1 4.22Å; I941-I976 HydrophobicContact CD1-CG1 4.35Å; I941-I976 HydrophobicContact CG2-CD1 4.33Å; I941-I976 HydrophobicContact CG2-CG1 4.34Å; I941-L988 HydrophobicContact CG2-CD1 3.9Å; I941-D1040 HydrophobicContact CD1-CB 3.8Å; I941-D1040 VanDerWaalsContact CD1-O 3.29Å; I941-D1040 WeakPolarHBondContact CD1-O 3.4Å
942	H	95.3	Very high	88.1	Confident	93 Å²	93	52.5 Å²	52.5	43%	0.431	32%	0.321	S	S	.	.	H	α-helix	trans	-55.6	-47	174.1	-176.7	-62.8	0	0	0	112	K938 S946 L963 L966	K938-H942 WeakPolarHBondContact O-CB 3.47Å; K938-H942 PolarHBondContact O-N 3.45Å; H942-S946 VanDerWaalsContact O-CB 3.3Å; H942-S946 WeakPolarHBondContact O-CB 3.28Å; H942-S946 PolarHBondContact O-N 3.34Å; H942-S946 PolarHBondContact O-OG 3.36Å; H942-L963 HydrophobicContact CB-CD2 4.48Å; H942-L966 HydrophobicContact CB-CD2 3.91Å
943	N	95.3	Very high	89.7	Confident	49 Å²	49	56.8 Å²	56.8	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-62.1	-47.2	176.9	-175	-52.3	0	0	0	111.3	P939 I940 I941 I945 S946 H947 Y1020	P939-N943 WeakPolarHBondContact O-CB 3.05Å; P939-N943 PolarHBondContact O-N 2.87Å; I940-N943 PolarHBondContact O-N 2.99Å; I941-N943 VanDerWaalsContact C-N 3.34Å; I941-N943 PolarHBondContact O-N 3.44Å; N943-I945 PolarHBondContact O-N 2.9Å; N943-S946 PolarHBondContact O-N 2.89Å; N943-H947 WeakPolarHBondContact O-CB 3.28Å; N943-H947 PolarHBondContact O-N 2.99Å; N943-Y1020 HydrophobicContact CB-CE1 4.29Å; N943-Y1020 WeakPolarHBondContact OD1-CE1 3.27Å; N943-Y1020 PolarHBondContact OD1-OH 2.88Å
944	A	96.3	Very high	91.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-37.3	-178.8	0	0	0	0	0	113.3	I940 I941 C948 C949 I976 Y1020 F1027	I940-A944 WeakPolarHBondContact O-CB 3.39Å; I940-A944 PolarHBondContact O-N 3.4Å; I941-A944 PolarHBondContact O-N 3.5Å; A944-C948 WeakPolarHBondContact O-CA 3.43Å; A944-C948 VanDerWaalsContact O-CB 3.25Å; A944-C948 WeakPolarHBondContact O-CB 3.36Å; A944-C948 PolarHBondContact O-N 2.88Å; A944-C949 PolarHBondContact O-N 2.61Å; A944-C949 PolarHBondContact O-SG 2.86Å; A944-I976 HydrophobicContact CB-CD1 4.38Å; A944-Y1020 HydrophobicContact CB-CD1 3.89Å; A944-Y1020 HydrophobicContact CB-CD2 3.57Å; A944-Y1020 HydrophobicContact CB-CE1 3.89Å; A944-Y1020 HydrophobicContact CB-CE2 3.6Å; A944-Y1020 HydrophobicContact CB-CG 3.71Å; A944-F1027 HydrophobicContact CB-CE2 4.23Å; A944-F1027 HydrophobicContact CB-CZ 3.66Å
945	I	95.2	Very high	93.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.322	C	S	.	.	I	π-helix	trans	-65	-49.8	173.5	-70.4	169	0	0	0	110	I941 N943 H947 L950 K959 I962 L963 L966 I976 L988	I941-I945 HydrophobicContact CG2-CD1 3.66Å; I941-I945 HydrophobicContact CG2-CG1 4.34Å; I941-I945 WeakPolarHBondContact O-CB 3.49Å; I941-I945 WeakPolarHBondContact O-CG1 3.47Å; I941-I945 PolarHBondContact O-N 3.28Å; N943-I945 PolarHBondContact O-N 2.9Å; I945-H947 PolarHBondContact O-N 2.94Å; I945-L950 HydrophobicContact CG2-CB 4.47Å; I945-L950 HydrophobicContact CG2-CD1 4.14Å; I945-L950 PolarHBondContact O-N 3.39Å; I945-K959 HydrophobicContact CG2-CG 4.48Å; I945-I962 HydrophobicContact CD1-CG2 3.99Å; I945-L963 HydrophobicContact CB-CD2 4.39Å; I945-L963 HydrophobicContact CG2-CD2 4.1Å; I945-L963 HydrophobicContact CG2-CG 4.37Å; I945-L966 HydrophobicContact CD1-CD2 4.34Å; I945-I976 HydrophobicContact CG1-CD1 3.92Å; I945-L988 HydrophobicContact CD1-CD2 4.27Å
946	S	94.1	Very high	93.6	Very high	22 Å²	22	54.3 Å²	54.3	15%	0.154	31%	0.308	C	S	.	.	I	π-helix	trans	-67	-30.8	-175.7	-59.1	0	0	0	0	114.8	H942 N943	H942-S946 VanDerWaalsContact O-CB 3.3Å; H942-S946 WeakPolarHBondContact O-CB 3.28Å; H942-S946 PolarHBondContact O-N 3.34Å; H942-S946 PolarHBondContact O-OG 3.36Å; N943-S946 PolarHBondContact O-N 2.89Å
947	H	91.1	Very high	93.8	Very high	101 Å²	101	57 Å²	57	47%	0.468	32%	0.324	S	S	.	.	I	π-helix	trans	-122.3	-11.1	-169.3	-61.5	-41	0	0	0	115.8	N943 I945 K1025	N943-H947 WeakPolarHBondContact O-CB 3.28Å; N943-H947 PolarHBondContact O-N 2.99Å; I945-H947 PolarHBondContact O-N 2.94Å; H947-K1025 HydrophobicContact CB-CD 4.25Å
948	C	92.2	Very high	93.8	Very high	49 Å²	49	60.7 Å²	60.7	33%	0.331	34%	0.341	S	S	.	.	I	π-helix	trans	-126.5	-49.8	-178.4	-166.8	0	0	0	0	112	A944 Y1020 K1025 F1027	A944-C948 WeakPolarHBondContact O-CA 3.43Å; A944-C948 VanDerWaalsContact O-CB 3.25Å; A944-C948 WeakPolarHBondContact O-CB 3.36Å; A944-C948 PolarHBondContact O-N 2.88Å; C948-Y1020 HydrophobicContact CB-CE2 3.9Å; C948-K1025 PolarHBondContact SG-O 3.33Å; C948-F1027 HydrophobicContact CB-CE2 4.12Å
949	C	92.3	Very high	93.9	Very high	17 Å²	17	59.6 Å²	59.6	12%	0.115	34%	0.336	C	S	.	.	I	π-helix	trans	-86.3	-45.3	-168.3	-52.2	0	0	0	0	114	A944 F985 F1027	A944-C949 PolarHBondContact O-N 2.61Å; A944-C949 PolarHBondContact O-SG 2.86Å; C949-F985 HydrophobicContact CB-CB 4.19Å; C949-F985 HydrophobicContact CB-CD2 4.19Å; C949-F1027 VanDerWaalsContact SG-CE2 3.54Å
950	L	93.5	Very high	93.9	Very high	6 Å²	6	59.1 Å²	59.1	3%	0.031	33%	0.329	C	S	.	.	S	Bend	trans	-126	35	-175.5	-61.5	178.1	0	0	0	111.2	I945 N955 Q958 K959 I962 F985	I945-L950 HydrophobicContact CG2-CB 4.47Å; I945-L950 HydrophobicContact CG2-CD1 4.14Å; I945-L950 PolarHBondContact O-N 3.39Å; L950-N955 HydrophobicContact CB-CB 4.1Å; L950-N955 HydrophobicContact CD2-CB 4.27Å; L950-Q958 HydrophobicContact CD1-CG 4.4Å; L950-K959 HydrophobicContact CB-CB 3.91Å; L950-K959 HydrophobicContact CB-CG 4.31Å; L950-K959 HydrophobicContact CD1-CB 4.46Å; L950-I962 HydrophobicContact CD1-CD1 3.6Å; L950-F985 HydrophobicContact CD1-CD1 4.3Å; L950-F985 HydrophobicContact CD1-CG 4.4Å; L950-F985 HydrophobicContact CD2-CB 4.02Å; L950-F985 HydrophobicContact CD2-CD1 4.22Å; L950-F985 HydrophobicContact CD2-CG 4.17Å; L950-F985 HydrophobicContact CG-CB 4.43Å; L950-F985 HydrophobicContact CG-CG 4.28Å
951	A	89.1	Confident	93.9	Very high	47 Å²	47	61.5 Å²	61.5	39%	0.388	34%	0.339	S	S	.	.			trans	-70.7	151	176.2	0	0	0	0	0	112
952	G	92.3	Very high	93.9	Very high	57 Å²	57	61.6 Å²	61.6	59%	0.588	34%	0.34	S	S	*	.	S	Bend	trans	89.8	155.2	177.1	0	0	0	0	0	114.5	V954 N955	G952-V954 VanDerWaalsContact C-N 3.27Å; G952-V954 PolarHBondContact O-N 2.95Å; G952-V954 VanDerWaalsContact O-N 3.15Å; G952-N955 PolarHBondContact O-N 3.4Å
953	K	92.8	Very high	93.9	Very high	185 Å²	185	58.3 Å²	58.3	80%	0.804	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-57.7	-31.5	-169.7	-65.6	-171.5	175.4	-171.8	0	114.8	N955 E956	K953-N955 VanDerWaalsContact C-N 3.28Å; K953-N955 PolarHBondContact O-N 3.33Å; K953-E956 VanDerWaalsContact O-CB 3.26Å; K953-E956 WeakPolarHBondContact O-CB 3.48Å; K953-E956 PolarHBondContact O-N 3.01Å
954	V	94.8	Very high	93.9	Very high	134 Å²	134	60.9 Å²	60.9	81%	0.812	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-62.6	-36.6	-178.4	-178.9	0	0	0	0	111.8	G952	G952-V954 VanDerWaalsContact C-N 3.27Å; G952-V954 PolarHBondContact O-N 2.95Å; G952-V954 VanDerWaalsContact O-N 3.15Å
955	N	94.1	Very high	93.8	Very high	56 Å²	56	63.3 Å²	63.3	30%	0.299	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-96.8	1.9	-176.9	-60.2	-32.8	0	0	0	112.6	L950 G952 K953 Q958 K959	L950-N955 HydrophobicContact CB-CB 4.1Å; L950-N955 HydrophobicContact CD2-CB 4.27Å; G952-N955 PolarHBondContact O-N 3.4Å; K953-N955 VanDerWaalsContact C-N 3.28Å; K953-N955 PolarHBondContact O-N 3.33Å; N955-Q958 PolarHBondContact O-N 3.46Å; N955-K959 VanDerWaalsContact O-CB 3.27Å; N955-K959 WeakPolarHBondContact O-CB 3.31Å; N955-K959 PolarHBondContact O-N 3.43Å
956	E	94.6	Very high	93.7	Very high	82 Å²	82	63.4 Å²	63.4	38%	0.383	35%	0.347	S	S	.	.	H	α-helix	trans	-52.6	-49	-175.4	-173.9	120.8	-109.4	0	0	115	K953 K959 N960	K953-E956 VanDerWaalsContact O-CB 3.26Å; K953-E956 WeakPolarHBondContact O-CB 3.48Å; K953-E956 PolarHBondContact O-N 3.01Å; E956-K959 WeakPolarHBondContact O-CB 3.5Å; E956-K959 PolarHBondContact O-N 3Å; E956-K959 IonicContact OE1-NZ 3.13Å; E956-K959 PolarHBondContact OE1-NZ 3.35Å; E956-N960 VanDerWaalsContact O-CG 3.27Å; E956-N960 PolarHBondContact O-N 3.33Å; E956-N960 PolarHBondContact O-OD1 2.95Å
957	P	94.1	Very high	93.7	Very high	93 Å²	93	69.7 Å²	69.7	60%	0.604	37%	0.374	S	S	*	.	H	α-helix	trans	-66	-39.5	177.9	25.1	-33.9	0	0	0	112.3	N960 Q961	P957-N960 PolarHBondContact O-N 2.89Å; P957-Q961 PolarHBondContact O-N 2.92Å
958	Q	94.4	Very high	93.8	Very high	82 Å²	82	71.8 Å²	71.8	38%	0.383	38%	0.382	S	S	.	.	H	α-helix	trans	-66.7	-40.8	177.7	-166.2	-168.9	0.7	0	0	111.5	L950 N955 I962	L950-Q958 HydrophobicContact CD1-CG 4.4Å; N955-Q958 PolarHBondContact O-N 3.46Å; Q958-I962 HydrophobicContact CG-CD1 3.81Å; Q958-I962 WeakPolarHBondContact O-CB 3.29Å; Q958-I962 WeakPolarHBondContact O-CD1 3.43Å; Q958-I962 VanDerWaalsContact O-CG1 3.32Å; Q958-I962 WeakPolarHBondContact O-CG1 3.45Å; Q958-I962 PolarHBondContact O-N 2.9Å
959	K	95.3	Very high	93.7	Very high	34 Å²	34	70 Å²	70	15%	0.148	37%	0.37	C	S	.	.	H	α-helix	trans	-57.9	-49.5	172.7	178.3	-147.8	70.4	179.9	0	110	I945 L950 N955 E956 I962 L963	I945-K959 HydrophobicContact CG2-CG 4.48Å; L950-K959 HydrophobicContact CB-CB 3.91Å; L950-K959 HydrophobicContact CB-CG 4.31Å; L950-K959 HydrophobicContact CD1-CB 4.46Å; N955-K959 VanDerWaalsContact O-CB 3.27Å; N955-K959 WeakPolarHBondContact O-CB 3.31Å; N955-K959 PolarHBondContact O-N 3.43Å; E956-K959 WeakPolarHBondContact O-CB 3.5Å; E956-K959 PolarHBondContact O-N 3Å; E956-K959 IonicContact OE1-NZ 3.13Å; E956-K959 PolarHBondContact OE1-NZ 3.35Å; K959-I962 PolarHBondContact O-N 3.29Å; K959-L963 HydrophobicContact CD-CD1 4.45Å; K959-L963 HydrophobicContact CG-CD1 4.01Å; K959-L963 WeakPolarHBondContact O-CB 3.18Å; K959-L963 WeakPolarHBondContact O-CG 3.34Å; K959-L963 PolarHBondContact O-N 3.35Å
960	N	94.8	Very high	93.5	Very high	82 Å²	82	78 Å²	78	44%	0.439	41%	0.406	S	S	.	.	H	α-helix	trans	-62.2	-47.7	179.7	-69.5	-3.5	0	0	0	111.9	E956 P957 I962 L963 E964	E956-N960 VanDerWaalsContact O-CG 3.27Å; E956-N960 PolarHBondContact O-N 3.33Å; E956-N960 PolarHBondContact O-OD1 2.95Å; P957-N960 PolarHBondContact O-N 2.89Å; N960-I962 PolarHBondContact O-N 2.99Å; N960-L963 PolarHBondContact O-N 3.48Å; N960-E964 PolarHBondContact O-N 3.25Å
961	Q	95.6	Very high	93.4	Very high	102 Å²	102	78.8 Å²	78.8	48%	0.477	41%	0.412	S	S	.	.	H	α-helix	trans	-55.5	-48.5	176.4	-179.7	-174.8	-6.4	0	0	111.9	P957 L963 E964 E965	P957-Q961 PolarHBondContact O-N 2.92Å; Q961-L963 VanDerWaalsContact C-N 3.32Å; Q961-L963 PolarHBondContact O-N 3.06Å; Q961-E964 WeakPolarHBondContact O-CB 3.35Å; Q961-E964 PolarHBondContact O-N 3.07Å; Q961-E965 WeakPolarHBondContact CG-OE1 3.44Å; Q961-E965 PolarHBondContact NE2-OE1 3.33Å; Q961-E965 WeakPolarHBondContact O-CG 3.28Å; Q961-E965 PolarHBondContact O-N 2.89Å
962	I	95.1	Very high	93.5	Very high	3 Å²	3	80.9 Å²	80.9	2%	0.015	42%	0.416	C	S	.	.	H	α-helix	trans	-71.3	-29.5	-177	-67.2	164.1	0	0	0	111.5	I945 L950 Q958 K959 N960 L966 F985 L988 T1002	I945-I962 HydrophobicContact CD1-CG2 3.99Å; L950-I962 HydrophobicContact CD1-CD1 3.6Å; Q958-I962 HydrophobicContact CG-CD1 3.81Å; Q958-I962 WeakPolarHBondContact O-CB 3.29Å; Q958-I962 WeakPolarHBondContact O-CD1 3.43Å; Q958-I962 VanDerWaalsContact O-CG1 3.32Å; Q958-I962 WeakPolarHBondContact O-CG1 3.45Å; Q958-I962 PolarHBondContact O-N 2.9Å; K959-I962 PolarHBondContact O-N 3.29Å; N960-I962 PolarHBondContact O-N 2.99Å; I962-L966 WeakPolarHBondContact O-CB 3.27Å; I962-L966 PolarHBondContact O-N 2.82Å; I962-F985 HydrophobicContact CD1-CD1 4.34Å; I962-F985 HydrophobicContact CD1-CE1 3.48Å; I962-F985 VanDerWaalsContact CD1-CE1 3.48Å; I962-F985 HydrophobicContact CD1-CZ 3.7Å; I962-F985 HydrophobicContact CG2-CZ 4.21Å; I962-L988 HydrophobicContact CG2-CD2 3.97Å; I962-T1002 HydrophobicContact CG1-CG2 4.15Å; I962-T1002 HydrophobicContact CG2-CG2 4.19Å
963	L	94.9	Very high	93.5	Very high	24 Å²	24	78.7 Å²	78.7	13%	0.126	39%	0.391	C	S	.	.	H	α-helix	trans	-70	-37.6	172.3	-71.1	175.8	0	0	0	111.8	H942 I945 K959 N960 Q961 L966 E967	H942-L963 HydrophobicContact CB-CD2 4.48Å; I945-L963 HydrophobicContact CB-CD2 4.39Å; I945-L963 HydrophobicContact CG2-CD2 4.1Å; I945-L963 HydrophobicContact CG2-CG 4.37Å; K959-L963 HydrophobicContact CD-CD1 4.45Å; K959-L963 HydrophobicContact CG-CD1 4.01Å; K959-L963 WeakPolarHBondContact O-CB 3.18Å; K959-L963 WeakPolarHBondContact O-CG 3.34Å; K959-L963 PolarHBondContact O-N 3.35Å; N960-L963 PolarHBondContact O-N 3.48Å; Q961-L963 VanDerWaalsContact C-N 3.32Å; Q961-L963 PolarHBondContact O-N 3.06Å; L963-L966 HydrophobicContact CD2-CD2 3.97Å; L963-L966 WeakPolarHBondContact O-CB 3.31Å; L963-L966 PolarHBondContact O-N 3.47Å; L963-E967 WeakPolarHBondContact O-CB 3.44Å; L963-E967 PolarHBondContact O-N 3.44Å
964	E	94.8	Very high	93.6	Very high	103 Å²	103	69.9 Å²	69.9	48%	0.481	35%	0.352	S	S	.	.	H	α-helix	trans	-65.7	-44.4	173.8	-170.2	-168.6	152	0	0	111.7	N960 Q961 E967 K968	N960-E964 PolarHBondContact O-N 3.25Å; Q961-E964 WeakPolarHBondContact O-CB 3.35Å; Q961-E964 PolarHBondContact O-N 3.07Å; E964-E967 PolarHBondContact O-N 3.36Å; E964-K968 HydrophobicContact CG-CD 4.42Å; E964-K968 WeakPolarHBondContact O-CB 3.37Å; E964-K968 WeakPolarHBondContact O-CG 3.41Å; E964-K968 PolarHBondContact O-N 3.28Å; E964-K968 WeakPolarHBondContact OE1-CE 3.46Å; E964-K968 IonicContact OE1-NZ 2.68Å; E964-K968 PolarHBondContact OE1-NZ 2.97Å
965	E	94.5	Very high	93.7	Very high	51 Å²	51	63.6 Å²	63.6	24%	0.238	31%	0.314	C	S	.	.	H	α-helix	trans	-66.2	-35.4	174.8	-69.5	165.7	168.5	0	0	112	Q961 C969 T1002	Q961-E965 WeakPolarHBondContact CG-OE1 3.44Å; Q961-E965 PolarHBondContact NE2-OE1 3.33Å; Q961-E965 WeakPolarHBondContact O-CG 3.28Å; Q961-E965 PolarHBondContact O-N 2.89Å; E965-C969 WeakPolarHBondContact O-CB 3.3Å; E965-C969 PolarHBondContact O-N 2.9Å; E965-T1002 HydrophobicContact CB-CG2 4.47Å; E965-T1002 WeakPolarHBondContact OE2-CB 3.43Å; E965-T1002 VanDerWaalsContact OE2-CG2 3.27Å; E965-T1002 WeakPolarHBondContact OE2-CG2 3.34Å; E965-T1002 PolarHBondContact OE2-OG1 2.91Å
966	L	93.9	Very high	93.8	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-41.3	171.6	171.7	69.6	0	0	0	111.8	K938 I941 H942 I945 I962 L963 C969 L974 L988	K938-L966 WeakPolarHBondContact CE-O 3.24Å; K938-L966 HydrophobicContact CG-CD1 4.14Å; K938-L966 HydrophobicContact CG-CG 4.45Å; K938-L966 PolarHBondContact NZ-O 3.2Å; K938-L966 VanDerWaalsContact NZ-O 3.09Å; I941-L966 HydrophobicContact CG2-CD1 4.16Å; I941-L966 HydrophobicContact CG2-CD2 4.39Å; H942-L966 HydrophobicContact CB-CD2 3.91Å; I945-L966 HydrophobicContact CD1-CD2 4.34Å; I962-L966 WeakPolarHBondContact O-CB 3.27Å; I962-L966 PolarHBondContact O-N 2.82Å; L963-L966 HydrophobicContact CD2-CD2 3.97Å; L963-L966 WeakPolarHBondContact O-CB 3.31Å; L963-L966 PolarHBondContact O-N 3.47Å; L966-C969 WeakPolarHBondContact O-CB 3.25Å; L966-C969 PolarHBondContact O-N 3.4Å; L966-L974 HydrophobicContact CD1-CD1 3.69Å; L966-L974 HydrophobicContact CD1-CD2 3.83Å; L966-L974 HydrophobicContact CD1-CG 4.27Å; L966-L988 HydrophobicContact CB-CD2 4.16Å; L966-L988 HydrophobicContact CD1-CD2 4.14Å
967	E	92.7	Very high	93.9	Very high	154 Å²	154	57 Å²	57	72%	0.72	28%	0.281	S	S	*	.	H	α-helix	trans	-65.8	-46.3	179.3	-174.7	153.9	-135.4	0	0	111.1	K938 L963 E964 C969	K938-E967 PolarHBondContact NZ-O 3.07Å; L963-E967 WeakPolarHBondContact O-CB 3.44Å; L963-E967 PolarHBondContact O-N 3.44Å; E964-E967 PolarHBondContact O-N 3.36Å; E967-C969 PolarHBondContact O-N 3.46Å; E967-C969 VanDerWaalsContact O-N 3.16Å
968	K	93.6	Very high	94	Very high	145 Å²	145	52.6 Å²	52.6	63%	0.63	25%	0.253	S	S	*	.	S	Bend	trans	-62.2	-15.1	172.3	-69.7	168.6	179.3	174.6	0	114.5	E964	E964-K968 HydrophobicContact CG-CD 4.42Å; E964-K968 WeakPolarHBondContact O-CB 3.37Å; E964-K968 WeakPolarHBondContact O-CG 3.41Å; E964-K968 PolarHBondContact O-N 3.28Å; E964-K968 WeakPolarHBondContact OE1-CE 3.46Å; E964-K968 IonicContact OE1-NZ 2.68Å; E964-K968 PolarHBondContact OE1-NZ 2.97Å
969	C	90.8	Very high	93.9	Very high	11 Å²	11	51.2 Å²	51.2	7%	0.074	24%	0.244	C	C	.	.			trans	-88.5	116.1	-179	-170.8	0	0	0	0	112.4	K938 E965 L966 E967 S971 T990 L1001	K938-C969 PolarHBondContact NZ-O 3.03Å; E965-C969 WeakPolarHBondContact O-CB 3.3Å; E965-C969 PolarHBondContact O-N 2.9Å; L966-C969 WeakPolarHBondContact O-CB 3.25Å; L966-C969 PolarHBondContact O-N 3.4Å; E967-C969 PolarHBondContact O-N 3.46Å; E967-C969 VanDerWaalsContact O-N 3.16Å; C969-S971 VanDerWaalsContact C-N 3.27Å; C969-S971 PolarHBondContact O-N 2.65Å; C969-T990 WeakPolarHBondContact SG-CG2 3.49Å; C969-L1001 HydrophobicContact CB-CD1 4.08Å; C969-L1001 HydrophobicContact CB-CD2 3.65Å
970	E	89	Confident	93.8	Very high	186 Å²	186	52.6 Å²	52.6	87%	0.869	25%	0.253	S	S	*	.			trans	-79.6	-3	180	-58	-177.8	147.8	0	0	114	N972	E970-N972 PolarHBondContact O-N 2.88Å
971	S	90.8	Very high	93.4	Very high	22 Å²	22	50.9 Å²	50.9	15%	0.154	26%	0.255	C	S	.	.			trans	-67.3	127.9	-176.6	-67	0	0	0	0	112.8	C969 H973 L974 T990	C969-S971 VanDerWaalsContact C-N 3.27Å; C969-S971 PolarHBondContact O-N 2.65Å; S971-H973 PolarHBondContact O-N 3.1Å; S971-L974 WeakPolarHBondContact O-CD1 3.27Å; S971-T990 VanDerWaalsContact OG-CG2 3.29Å; S971-T990 WeakPolarHBondContact OG-CG2 3.17Å
972	N	90.3	Very high	93	Very high	91 Å²	91	49 Å²	49	49%	0.487	26%	0.263	S	S	.	.	S	Bend	trans	-59.8	-43.6	179.9	-79.7	-60.7	0	0	0	113.2	S936 N937 E970	S936-N972 WeakPolarHBondContact CA-O 3.47Å; S936-N972 VanDerWaalsContact CB-O 3.23Å; S936-N972 WeakPolarHBondContact CB-O 3.46Å; S936-N972 PolarHBondContact OG-O 3.02Å; N937-N972 PolarHBondContact N-O 2.76Å; E970-N972 PolarHBondContact O-N 2.88Å
973	H	93.3	Very high	92.8	Very high	10 Å²	10	50.5 Å²	50.5	5%	0.046	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.7	-179.1	-60.9	-68.8	0	0	0	111.6	K935 N937 S971 Y991 V1037	K935-H973 PolarHBondContact O-CE1 3.34Å; K935-H973 VanDerWaalsContact O-CE1 3.26Å; N937-H973 WeakPolarHBondContact OD1-CA 3.14Å; S971-H973 PolarHBondContact O-N 3.1Å; H973-Y991 HydrophobicContact CB-CD1 4.04Å; H973-Y991 PolarHBondContact O-N 2.88Å; H973-V1037 WeakPolarHBondContact NE2-CG1 3.45Å
974	L	95.1	Very high	92.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.2	-178.2	-71.5	127.7	0	0	0	109.8	N937 K938 I941 L966 S971 L988 Y989 T990 L1001	N937-L974 PolarHBondContact ND2-O 3.39Å; N937-L974 PolarHBondContact OD1-N 2.88Å; N937-L974 PolarHBondContact OD1-O 3.45Å; K938-L974 HydrophobicContact CB-CD1 3.93Å; K938-L974 HydrophobicContact CD-CD1 4.44Å; K938-L974 HydrophobicContact CG-CD1 4.14Å; I941-L974 HydrophobicContact CG1-CB 4.04Å; I941-L974 HydrophobicContact CG2-CB 4.42Å; L966-L974 HydrophobicContact CD1-CD1 3.69Å; L966-L974 HydrophobicContact CD1-CD2 3.83Å; L966-L974 HydrophobicContact CD1-CG 4.27Å; S971-L974 WeakPolarHBondContact O-CD1 3.27Å; L974-L988 HydrophobicContact CB-CD1 4.31Å; L974-L988 HydrophobicContact CD2-CD1 4.25Å; L974-L988 HydrophobicContact CD2-CD2 4.38Å; L974-L988 HydrophobicContact CD2-CG 4.28Å; L974-Y989 CarbonylContact C-O 3.54Å; L974-Y989 VanDerWaalsContact CA-O 3.3Å; L974-Y989 WeakPolarHBondContact CA-O 3.3Å; L974-T990 HydrophobicContact CD2-CG2 4.06Å; L974-L1001 HydrophobicContact CD2-CD2 4.01Å
975	M	95.6	Very high	92.7	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	130.8	-175.2	-57	-167.4	79.9	0	0	111.3	Y989 Y991 I998 V1035 V1039 D1040 L1042	M975-Y989 PolarHBondContact N-O 2.85Å; M975-Y989 PolarHBondContact O-N 3.26Å; M975-Y991 HydrophobicContact SD-CG 4.23Å; M975-I998 HydrophobicContact SD-CD1 4.2Å; M975-I998 HydrophobicContact SD-CG1 4.29Å; M975-V1035 HydrophobicContact CE-CG1 4.03Å; M975-V1035 HydrophobicContact SD-CG1 3.88Å; M975-V1039 HydrophobicContact CE-CB 3.72Å; M975-V1039 HydrophobicContact CE-CG1 3.4Å; M975-D1040 WeakPolarHBondContact CA-O 3.43Å; M975-L1042 HydrophobicContact CE-CB 4.47Å; M975-L1042 HydrophobicContact CE-CD2 3.85Å; M975-L1042 HydrophobicContact SD-CD2 4.03Å
976	I	96.6	Very high	92.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.6	174.9	-62.8	163.4	0	0	0	109.9	I941 A944 I945 F978 F985 L988 F1027 D1040 A1041 L1042	I941-I976 HydrophobicContact CD1-CD1 4.22Å; I941-I976 HydrophobicContact CD1-CG1 4.35Å; I941-I976 HydrophobicContact CG2-CD1 4.33Å; I941-I976 HydrophobicContact CG2-CG1 4.34Å; A944-I976 HydrophobicContact CB-CD1 4.38Å; I945-I976 HydrophobicContact CG1-CD1 3.92Å; I976-F978 HydrophobicContact CG2-CD1 3.86Å; I976-F978 HydrophobicContact CG2-CE1 3.52Å; I976-F978 HydrophobicContact CG2-CZ 4.1Å; I976-F985 HydrophobicContact CG1-CE2 4.42Å; I976-F985 HydrophobicContact CG2-CD2 3.55Å; I976-F985 HydrophobicContact CG2-CE2 3.86Å; I976-L988 HydrophobicContact CG1-CD1 4.16Å; I976-F1027 HydrophobicContact CD1-CZ 3.98Å; I976-D1040 PolarHBondContact N-O 3.49Å; I976-A1041 HydrophobicContact CB-CB 3.9Å; I976-A1041 CarbonylContact O-C 3.54Å; I976-A1041 WeakPolarHBondContact O-CA 3.18Å; I976-A1041 WeakPolarHBondContact O-CB 3.33Å; I976-L1042 PolarHBondContact O-N 3.02Å
977	L	96.8	Very high	92.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.8	168.6	174.4	61.6	0	0	0	110.1	R986 A987 Y989 I1009 L1042 I1044 W1049	L977-R986 HydrophobicContact CG-CB 4.47Å; L977-R986 PolarHBondContact O-N 2.87Å; L977-A987 HydrophobicContact CB-CB 4.19Å; L977-A987 HydrophobicContact CD2-CB 4.24Å; L977-A987 PolarHBondContact N-O 3.26Å; L977-Y989 HydrophobicContact CB-CD2 3.87Å; L977-Y989 HydrophobicContact CB-CE2 3.54Å; L977-Y989 HydrophobicContact CD2-CE2 3.64Å; L977-Y989 HydrophobicContact CG-CE2 4.2Å; L977-I1009 HydrophobicContact CD1-CD1 4.29Å; L977-I1009 HydrophobicContact CD2-CD1 4.27Å; L977-L1042 HydrophobicContact CD1-CD1 3.59Å; L977-I1044 HydrophobicContact CD1-CB 4.45Å; L977-I1044 HydrophobicContact CD1-CD1 4.39Å; L977-I1044 HydrophobicContact CD1-CG1 4.12Å; L977-I1044 HydrophobicContact CD1-CG2 3.87Å; L977-I1044 HydrophobicContact CD2-CD1 4.38Å; L977-W1049 HydrophobicContact CD1-CZ2 4.07Å; L977-W1049 HydrophobicContact CD2-CH2 3.56Å; L977-W1049 HydrophobicContact CD2-CZ2 3.91Å; L977-W1049 HydrophobicContact CG-CH2 4.02Å; L977-W1049 HydrophobicContact CG-CZ2 4.02Å
978	F	96.7	Very high	93	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	149.3	168.8	-61.9	-45.1	0	0	0	112.6	I976 C983 Q984 Y1018 F1027 A1041 L1042 T1043	I976-F978 HydrophobicContact CG2-CD1 3.86Å; I976-F978 HydrophobicContact CG2-CE1 3.52Å; I976-F978 HydrophobicContact CG2-CZ 4.1Å; F978-C983 HydrophobicContact CD1-CB 4.33Å; F978-C983 VanDerWaalsContact CD1-O 3.3Å; F978-C983 WeakPolarHBondContact CD1-O 3.48Å; F978-C983 HydrophobicContact CD2-CB 4.27Å; F978-C983 HydrophobicContact CE1-CB 4.08Å; F978-C983 WeakPolarHBondContact CE1-O 3.41Å; F978-C983 HydrophobicContact CE2-CB 4Å; F978-C983 HydrophobicContact CG-CB 4.43Å; F978-C983 HydrophobicContact CZ-CB 3.91Å; F978-Q984 VanDerWaalsContact CA-O 3.27Å; F978-Q984 WeakPolarHBondContact CA-O 3.45Å; F978-Y1018 HydrophobicContact CD2-CD2 4.33Å; F978-Y1018 HydrophobicContact CE2-CG 4.43Å; F978-F1027 HydrophobicContact CE1-CE2 4.46Å; F978-F1027 HydrophobicContact CE2-CB 4.37Å; F978-F1027 AromaticContact CE2-CD1 3.91Å; F978-F1027 HydrophobicContact CE2-CD1 3.91Å; F978-F1027 HydrophobicContact CE2-CD2 4.16Å; F978-F1027 HydrophobicContact CE2-CE1 4.21Å; F978-F1027 HydrophobicContact CE2-CE2 4.47Å; F978-F1027 AromaticContact CE2-CG 3.87Å; F978-F1027 HydrophobicContact CE2-CG 3.87Å; F978-F1027 HydrophobicContact CE2-CZ 4.46Å; F978-F1027 AromaticContact CZ-CD1 3.93Å; F978-F1027 HydrophobicContact CZ-CD1 3.93Å; F978-F1027 AromaticContact CZ-CD2 3.66Å; F978-F1027 HydrophobicContact CZ-CD2 3.66Å; F978-F1027 AromaticContact CZ-CE1 3.85Å; F978-F1027 HydrophobicContact CZ-CE1 3.85Å; F978-F1027 AromaticContact CZ-CE2 3.6Å; F978-F1027 HydrophobicContact CZ-CE2 3.6Å; F978-F1027 AromaticContact CZ-CG 3.81Å; F978-F1027 HydrophobicContact CZ-CG 3.81Å; F978-F1027 AromaticContact CZ-CZ 3.67Å; F978-F1027 HydrophobicContact CZ-CZ 3.67Å; F978-A1041 HydrophobicContact CD2-CB 3.97Å; F978-A1041 HydrophobicContact CE2-CB 3.37Å; F978-A1041 HydrophobicContact CZ-CB 3.8Å; F978-L1042 PolarHBondContact N-O 3.32Å; F978-T1043 HydrophobicContact CB-CG2 3.85Å
979	R	92.6	Very high	93.2	Very high	53 Å²	53	38.4 Å²	38.4	20%	0.2	21%	0.214	C	C	.	.	S	Bend	trans	-65.4	-48.2	174.8	179	53.6	-167.4	81.4	0.3	112.5	Q984 R986 N1046 W1049	R979-Q984 HydrophobicContact CB-CB 4.32Å; R979-Q984 PolarHBondContact N-O 3.41Å; R979-R986 HydrophobicContact CB-CG 3.7Å; R979-N1046 PolarHBondContact NH1-OD1 3.02Å; R979-N1046 PolarHBondContact NH2-OD1 2.92Å; R979-W1049 VanDerWaalsContact CZ-CD1 3.44Å; R979-W1049 PolarHBondContact O-NE1 3.2Å
980	D	91.4	Very high	93.4	Very high	63 Å²	63	38.4 Å²	38.4	34%	0.337	21%	0.214	S	C	.	.	S	Bend	trans	-153.5	177.6	-176.9	-74.7	-61.2	0	0	0	108.3	G982 C983 N1046	D980-G982 PolarHBondContact O-N 2.87Å; D980-C983 PolarHBondContact O-N 3.41Å; D980-C983 VanDerWaalsContact O-N 3.13Å; D980-N1046 PolarHBondContact OD1-ND2 3.08Å
981	G	86.9	Confident	93.6	Very high	46 Å²	46	30.1 Å²	30.1	47%	0.474	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-7.2	-178.1	0	0	0	0	0	116.6	C983 Y1018	G981-C983 PolarHBondContact O-N 3.49Å; G981-Y1018 WeakPolarHBondContact CA-OH 3.43Å
982	G	88.6	Confident	93.7	Very high	63 Å²	63	33 Å²	33	65%	0.649	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	10.9	168.1	0	0	0	0	0	114.9	D980 Q984	D980-G982 PolarHBondContact O-N 2.87Å; G982-Q984 PolarHBondContact O-N 2.9Å; G982-Q984 VanDerWaalsContact O-N 3.08Å
983	C	90.4	Very high	93.5	Very high	35 Å²	35	30.5 Å²	30.5	24%	0.236	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	27.2	174.2	-57.5	0	0	0	0	115.1	F978 D980 G981 F985	F978-C983 HydrophobicContact CD1-CB 4.33Å; F978-C983 VanDerWaalsContact CD1-O 3.3Å; F978-C983 WeakPolarHBondContact CD1-O 3.48Å; F978-C983 HydrophobicContact CD2-CB 4.27Å; F978-C983 HydrophobicContact CE1-CB 4.08Å; F978-C983 WeakPolarHBondContact CE1-O 3.41Å; F978-C983 HydrophobicContact CE2-CB 4Å; F978-C983 HydrophobicContact CG-CB 4.43Å; F978-C983 HydrophobicContact CZ-CB 3.91Å; D980-C983 PolarHBondContact O-N 3.41Å; D980-C983 VanDerWaalsContact O-N 3.13Å; G981-C983 PolarHBondContact O-N 3.49Å; C983-F985 PolarHBondContact O-N 3.31Å
984	Q	92.6	Very high	93.2	Very high	110 Å²	110	35.4 Å²	35.4	51%	0.514	20%	0.2	S	C	.	.			trans	-71.2	115.7	174.3	-67.4	-177.6	9.8	0	0	110.6	F978 R979 G982	F978-Q984 VanDerWaalsContact CA-O 3.27Å; F978-Q984 WeakPolarHBondContact CA-O 3.45Å; R979-Q984 HydrophobicContact CB-CB 4.32Å; R979-Q984 PolarHBondContact N-O 3.41Å; G982-Q984 PolarHBondContact O-N 2.9Å; G982-Q984 VanDerWaalsContact O-N 3.08Å
985	F	95.3	Very high	92.7	Very high	17 Å²	17	39.5 Å²	39.5	8%	0.075	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	141.1	174.2	-172.9	-86.8	0	0	0	112.2	C949 L950 I962 I976 C983 L988	C949-F985 HydrophobicContact CB-CB 4.19Å; C949-F985 HydrophobicContact CB-CD2 4.19Å; L950-F985 HydrophobicContact CD1-CD1 4.3Å; L950-F985 HydrophobicContact CD1-CG 4.4Å; L950-F985 HydrophobicContact CD2-CB 4.02Å; L950-F985 HydrophobicContact CD2-CD1 4.22Å; L950-F985 HydrophobicContact CD2-CG 4.17Å; L950-F985 HydrophobicContact CG-CB 4.43Å; L950-F985 HydrophobicContact CG-CG 4.28Å; I962-F985 HydrophobicContact CD1-CD1 4.34Å; I962-F985 HydrophobicContact CD1-CE1 3.48Å; I962-F985 VanDerWaalsContact CD1-CE1 3.48Å; I962-F985 HydrophobicContact CD1-CZ 3.7Å; I962-F985 HydrophobicContact CG2-CZ 4.21Å; I976-F985 HydrophobicContact CG1-CE2 4.42Å; I976-F985 HydrophobicContact CG2-CD2 3.55Å; I976-F985 HydrophobicContact CG2-CE2 3.86Å; C983-F985 PolarHBondContact O-N 3.31Å; F985-L988 HydrophobicContact CE2-CB 4.45Å; F985-L988 HydrophobicContact CZ-CB 4.16Å
986	R	95.2	Very high	92.2	Very high	96 Å²	96	43 Å²	43	36%	0.362	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	-40.7	170.3	-67.4	-67.6	158	160.3	0.8	113.7	L977 R979 T1004 W1049	L977-R986 HydrophobicContact CG-CB 4.47Å; L977-R986 PolarHBondContact O-N 2.87Å; R979-R986 HydrophobicContact CB-CG 3.7Å; R986-T1004 PolarHBondContact O-N 3.31Å; R986-W1049 HydrophobicContact CB-CH2 3.8Å; R986-W1049 HydrophobicContact CG-CH2 3.81Å; R986-W1049 HydrophobicContact CG-CZ2 4.37Å; R986-W1049 HydrophobicContact CG-CZ3 4.42Å
987	A	96	Very high	91.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	162.4	-177.3	0	0	0	0	0	110.8	L977 Y989 K1000 T1002	L977-A987 HydrophobicContact CB-CB 4.19Å; L977-A987 HydrophobicContact CD2-CB 4.24Å; L977-A987 PolarHBondContact N-O 3.26Å; A987-Y989 HydrophobicContact CB-CD2 4.26Å; A987-Y989 HydrophobicContact CB-CE2 3.56Å; A987-K1000 HydrophobicContact CB-CD 4.28Å; A987-K1000 HydrophobicContact CB-CG 4.45Å; A987-T1002 CarbonylContact C-O 3.58Å; A987-T1002 WeakPolarHBondContact CA-O 3.45Å; A987-T1002 WeakPolarHBondContact CB-O 3.12Å
988	L	96.3	Very high	91.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.7	173.6	176.1	63.6	0	0	0	108.4	I941 I945 I962 L966 L974 I976 F985 L1001 T1002	I941-L988 HydrophobicContact CG2-CD1 3.9Å; I945-L988 HydrophobicContact CD1-CD2 4.27Å; I962-L988 HydrophobicContact CG2-CD2 3.97Å; L966-L988 HydrophobicContact CB-CD2 4.16Å; L966-L988 HydrophobicContact CD1-CD2 4.14Å; L974-L988 HydrophobicContact CB-CD1 4.31Å; L974-L988 HydrophobicContact CD2-CD1 4.25Å; L974-L988 HydrophobicContact CD2-CD2 4.38Å; L974-L988 HydrophobicContact CD2-CG 4.28Å; I976-L988 HydrophobicContact CG1-CD1 4.16Å; F985-L988 HydrophobicContact CE2-CB 4.45Å; F985-L988 HydrophobicContact CZ-CB 4.16Å; L988-L1001 HydrophobicContact CD2-CD2 3.89Å; L988-L1001 HydrophobicContact CG-CD2 4.2Å; L988-L1001 WeakPolarHBondContact O-CB 3.44Å; L988-L1001 PolarHBondContact O-N 3.34Å; L988-T1002 HydrophobicContact CB-CG2 3.75Å; L988-T1002 HydrophobicContact CD2-CG2 4.29Å; L988-T1002 PolarHBondContact N-O 2.69Å; L988-T1002 PolarHBondContact O-N 2.98Å; L988-T1002 VanDerWaalsContact O-N 3.12Å
989	Y	96.6	Very high	91.7	Very high	1 Å²	1	50.9 Å²	50.9	0%	0.004	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.3	-176.8	-71.7	-104.2	0	0	0	110.5	L974 M975 L977 A987 I998 H999 K1000 G1005 P1006 I1009	L974-Y989 CarbonylContact C-O 3.54Å; L974-Y989 VanDerWaalsContact CA-O 3.3Å; L974-Y989 WeakPolarHBondContact CA-O 3.3Å; M975-Y989 PolarHBondContact N-O 2.85Å; M975-Y989 PolarHBondContact O-N 3.26Å; L977-Y989 HydrophobicContact CB-CD2 3.87Å; L977-Y989 HydrophobicContact CB-CE2 3.54Å; L977-Y989 HydrophobicContact CD2-CE2 3.64Å; L977-Y989 HydrophobicContact CG-CE2 4.2Å; A987-Y989 HydrophobicContact CB-CD2 4.26Å; A987-Y989 HydrophobicContact CB-CE2 3.56Å; Y989-I998 HydrophobicContact CD1-CG2 3.68Å; Y989-I998 HydrophobicContact CG-CG2 3.83Å; Y989-H999 CarbonylContact C-O 3.59Å; Y989-H999 WeakPolarHBondContact CA-O 3.32Å; Y989-H999 WeakPolarHBondContact CB-O 3.4Å; Y989-H999 WeakPolarHBondContact CD1-O 3.11Å; Y989-K1000 VanDerWaalsContact CD1-CA 3.41Å; Y989-K1000 HydrophobicContact CD1-CB 3.85Å; Y989-K1000 HydrophobicContact CD1-CG 4.31Å; Y989-K1000 HydrophobicContact CE1-CB 3.41Å; Y989-K1000 VanDerWaalsContact CE1-CB 3.41Å; Y989-K1000 HydrophobicContact CE1-CD 4.49Å; Y989-K1000 HydrophobicContact CE1-CG 3.82Å; Y989-K1000 HydrophobicContact CE2-CG 4.07Å; Y989-G1005 WeakPolarHBondContact OH-CA 3.46Å; Y989-P1006 WeakPolarHBondContact CE1-O 3.44Å; Y989-P1006 WeakPolarHBondContact OH-CD 3.31Å; Y989-P1006 PolarHBondContact OH-O 2.94Å; Y989-I1009 HydrophobicContact CD1-CD1 4.04Å; Y989-I1009 HydrophobicContact CD1-CG1 4.28Å; Y989-I1009 HydrophobicContact CD2-CD1 4.25Å; Y989-I1009 HydrophobicContact CE1-CD1 3.59Å; Y989-I1009 HydrophobicContact CE1-CG1 3.7Å; Y989-I1009 HydrophobicContact CE2-CD1 3.81Å; Y989-I1009 HydrophobicContact CG-CD1 4.38Å; Y989-I1009 VanDerWaalsContact CZ-CD1 3.49Å
990	T	95.2	Very high	91.9	Very high	11 Å²	11	51.9 Å²	51.9	7%	0.067	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	148.7	164.3	56.6	0	0	0	0	109.4	C969 S971 L974 F992 I998 H999 L1001	C969-T990 WeakPolarHBondContact SG-CG2 3.49Å; S971-T990 VanDerWaalsContact OG-CG2 3.29Å; S971-T990 WeakPolarHBondContact OG-CG2 3.17Å; L974-T990 HydrophobicContact CD2-CG2 4.06Å; T990-F992 WeakPolarHBondContact OG1-CE2 3.17Å; T990-I998 CarbonylContact O-C 3.59Å; T990-I998 VanDerWaalsContact O-CA 3.28Å; T990-I998 WeakPolarHBondContact O-CA 3.37Å; T990-H999 PolarHBondContact N-O 2.83Å; T990-H999 PolarHBondContact O-N 3.02Å; T990-H999 PolarHBondContact OG1-O 2.97Å; T990-L1001 HydrophobicContact CG2-CB 4.4Å
991	Y	94.3	Very high	92	Very high	13 Å²	13	51.9 Å²	51.9	5%	0.051	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.2	176.3	173.2	-115.8	0	0	0	110.2	H973 M975 P993 E997 I998 V1035	H973-Y991 HydrophobicContact CB-CD1 4.04Å; H973-Y991 PolarHBondContact O-N 2.88Å; M975-Y991 HydrophobicContact SD-CG 4.23Å; Y991-P993 HydrophobicContact CE1-CB 3.98Å; Y991-E997 WeakPolarHBondContact CD2-O 3.26Å; Y991-I998 HydrophobicContact CD2-CG1 3.61Å; Y991-I998 HydrophobicContact CE2-CG1 4.28Å; Y991-V1035 HydrophobicContact CD2-CG1 4.01Å; Y991-V1035 HydrophobicContact CE1-CG1 4.17Å; Y991-V1035 HydrophobicContact CE2-CB 4.33Å; Y991-V1035 HydrophobicContact CE2-CG1 3.61Å; Y991-V1035 HydrophobicContact CG-CG1 4.42Å
992	F	91.3	Very high	92.4	Very high	82 Å²	82	50.5 Å²	50.5	36%	0.36	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.2	176.3	-64.3	-83.1	0	0	0	108.6	T990 D994 T995 E996 E997	T990-F992 WeakPolarHBondContact OG1-CE2 3.17Å; F992-D994 PolarHBondContact O-N 3.49Å; F992-T995 WeakPolarHBondContact CB-OG1 3.32Å; F992-E996 WeakPolarHBondContact O-CA 3.42Å; F992-E996 PolarHBondContact O-N 3.16Å; F992-E997 PolarHBondContact N-O 3.35Å
993	P	87.4	Confident	92.6	Very high	38 Å²	38	48.9 Å²	48.9	25%	0.247	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-23.4	-172.3	27.7	-34.6	0	0	0	113.3	Y991 V1037	Y991-P993 HydrophobicContact CE1-CB 3.98Å; P993-V1037 HydrophobicContact CB-CG1 4.17Å
994	D	86	Confident	92.8	Very high	113 Å²	113	52.1 Å²	52.1	60%	0.604	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-44.9	-175.5	-48.1	-64.8	0	0	0	111.5	F992	F992-D994 PolarHBondContact O-N 3.49Å
995	T	85.4	Confident	92.8	Very high	86 Å²	86	47.9 Å²	47.9	53%	0.528	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-11.5	177.1	61.9	0	0	0	0	113.8	F992 E997	F992-T995 WeakPolarHBondContact CB-OG1 3.32Å; T995-E997 PolarHBondContact O-N 2.98Å; T995-E997 PolarHBondContact OG1-N 3.18Å
996	E	85.6	Confident	92.7	Very high	76 Å²	76	49.3 Å²	49.3	36%	0.355	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	18.3	-169.2	-71.9	177.9	-130	0	0	114.1	K927 F992 K1011	K927-E996 WeakPolarHBondContact CE-OE1 3.42Å; K927-E996 IonicContact NZ-OE1 2.91Å; K927-E996 PolarHBondContact NZ-OE1 2.86Å; F992-E996 WeakPolarHBondContact O-CA 3.42Å; F992-E996 PolarHBondContact O-N 3.16Å; E996-K1011 IonicContact OE2-NZ 2.58Å; E996-K1011 PolarHBondContact OE2-NZ 2.95Å
997	E	89.5	Confident	92.7	Very high	97 Å²	97	53.6 Å²	53.6	45%	0.453	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	143.3	179.9	-64.6	-167.5	142	0	0	113.3	Y991 F992 T995 H999	Y991-E997 WeakPolarHBondContact CD2-O 3.26Å; F992-E997 PolarHBondContact N-O 3.35Å; T995-E997 PolarHBondContact O-N 2.98Å; T995-E997 PolarHBondContact OG1-N 3.18Å; E997-H999 IonicContact OE2-CD2 2.73Å; E997-H999 IonicContact OE2-CE1 3.07Å; E997-H999 IonicContact OE2-NE2 3.5Å; E997-H999 PolarHBondContact OE2-NE2 3.18Å
998	I	94.6	Very high	92.6	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	106.9	177.6	-57.4	161.8	0	0	0	108	M975 Y989 T990 Y991 S1008 I1009 I1014 V1035 L1042	M975-I998 HydrophobicContact SD-CD1 4.2Å; M975-I998 HydrophobicContact SD-CG1 4.29Å; Y989-I998 HydrophobicContact CD1-CG2 3.68Å; Y989-I998 HydrophobicContact CG-CG2 3.83Å; T990-I998 CarbonylContact O-C 3.59Å; T990-I998 VanDerWaalsContact O-CA 3.28Å; T990-I998 WeakPolarHBondContact O-CA 3.37Å; Y991-I998 HydrophobicContact CD2-CG1 3.61Å; Y991-I998 HydrophobicContact CE2-CG1 4.28Å; I998-S1008 CarbonylContact O-C 3.52Å; I998-S1008 WeakPolarHBondContact O-CA 3.25Å; I998-I1009 HydrophobicContact CB-CB 4.07Å; I998-I1009 WeakPolarHBondContact CB-O 3.47Å; I998-I1009 HydrophobicContact CD1-CB 4.43Å; I998-I1009 HydrophobicContact CD1-CG2 4.26Å; I998-I1009 HydrophobicContact CG2-CB 4.11Å; I998-I1009 PolarHBondContact O-N 2.88Å; I998-I1014 HydrophobicContact CD1-CD1 3.9Å; I998-V1035 HydrophobicContact CD1-CG1 4.38Å; I998-V1035 HydrophobicContact CD1-CG2 4.2Å; I998-L1042 HydrophobicContact CD1-CD2 3.96Å
999	H	95	Very high	92.5	Very high	67 Å²	67	56.7 Å²	56.7	31%	0.31	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142	-174.8	-74.2	-67.6	0	0	0	111.9	Y989 T990 E997 L1001	Y989-H999 CarbonylContact C-O 3.59Å; Y989-H999 WeakPolarHBondContact CA-O 3.32Å; Y989-H999 WeakPolarHBondContact CB-O 3.4Å; Y989-H999 WeakPolarHBondContact CD1-O 3.11Å; T990-H999 PolarHBondContact N-O 2.83Å; T990-H999 PolarHBondContact O-N 3.02Å; T990-H999 PolarHBondContact OG1-O 2.97Å; E997-H999 IonicContact OE2-CD2 2.73Å; E997-H999 IonicContact OE2-CE1 3.07Å; E997-H999 IonicContact OE2-NE2 3.5Å; E997-H999 PolarHBondContact OE2-NE2 3.18Å; H999-L1001 PolarHBondContact O-N 3.14Å
1000	K	95.8	Very high	92.3	Very high	74 Å²	74	59.4 Å²	59.4	32%	0.322	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	120.9	-175.3	-164.7	-179.6	68.5	169.2	0	111.2	A987 Y989 G1003 G1005 K1007	A987-K1000 HydrophobicContact CB-CD 4.28Å; A987-K1000 HydrophobicContact CB-CG 4.45Å; Y989-K1000 VanDerWaalsContact CD1-CA 3.41Å; Y989-K1000 HydrophobicContact CD1-CB 3.85Å; Y989-K1000 HydrophobicContact CD1-CG 4.31Å; Y989-K1000 HydrophobicContact CE1-CB 3.41Å; Y989-K1000 VanDerWaalsContact CE1-CB 3.41Å; Y989-K1000 HydrophobicContact CE1-CD 4.49Å; Y989-K1000 HydrophobicContact CE1-CG 3.82Å; Y989-K1000 HydrophobicContact CE2-CG 4.07Å; K1000-G1003 WeakPolarHBondContact CD-O 3.43Å; K1000-G1003 WeakPolarHBondContact CE-O 3.35Å; K1000-G1003 PolarHBondContact NZ-O 2.86Å; K1000-G1005 PolarHBondContact NZ-O 3.34Å; K1000-K1007 WeakPolarHBondContact CB-O 3.42Å; K1000-K1007 PolarHBondContact N-O 2.9Å
1001	L	94.3	Very high	92.1	Very high	62 Å²	62	64 Å²	64	33%	0.325	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-53.6	170.5	-177.2	64	0	0	0	110.7	C969 L974 L988 T990 H999	C969-L1001 HydrophobicContact CB-CD1 4.08Å; C969-L1001 HydrophobicContact CB-CD2 3.65Å; L974-L1001 HydrophobicContact CD2-CD2 4.01Å; L988-L1001 HydrophobicContact CD2-CD2 3.89Å; L988-L1001 HydrophobicContact CG-CD2 4.2Å; L988-L1001 WeakPolarHBondContact O-CB 3.44Å; L988-L1001 PolarHBondContact O-N 3.34Å; T990-L1001 HydrophobicContact CG2-CB 4.4Å; H999-L1001 PolarHBondContact O-N 3.14Å
1002	T	95.1	Very high	91.9	Very high	17 Å²	17	72.5 Å²	72.5	10%	0.104	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	162.1	-174.7	-179.7	0	0	0	0	113.3	I962 E965 A987 L988	I962-T1002 HydrophobicContact CG1-CG2 4.15Å; I962-T1002 HydrophobicContact CG2-CG2 4.19Å; E965-T1002 HydrophobicContact CB-CG2 4.47Å; E965-T1002 WeakPolarHBondContact OE2-CB 3.43Å; E965-T1002 VanDerWaalsContact OE2-CG2 3.27Å; E965-T1002 WeakPolarHBondContact OE2-CG2 3.34Å; E965-T1002 PolarHBondContact OE2-OG1 2.91Å; A987-T1002 CarbonylContact C-O 3.58Å; A987-T1002 WeakPolarHBondContact CA-O 3.45Å; A987-T1002 WeakPolarHBondContact CB-O 3.12Å; L988-T1002 HydrophobicContact CB-CG2 3.75Å; L988-T1002 HydrophobicContact CD2-CG2 4.29Å; L988-T1002 PolarHBondContact N-O 2.69Å; L988-T1002 PolarHBondContact O-N 2.98Å; L988-T1002 VanDerWaalsContact O-N 3.12Å
1003	G	93.6	Very high	92	Very high	30 Å²	30	70.8 Å²	70.8	31%	0.309	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	84.5	-165.7	175.9	0	0	0	0	0	116.1	K1000	K1000-G1003 WeakPolarHBondContact CD-O 3.43Å; K1000-G1003 WeakPolarHBondContact CE-O 3.35Å; K1000-G1003 PolarHBondContact NZ-O 2.86Å
1004	T	93.5	Very high	92.3	Very high	102 Å²	102	69.8 Å²	69.8	63%	0.626	37%	0.369	S	S	*	.	S	Bend	trans	-98.8	108.6	-169.6	-58.2	0	0	0	0	111.6	R986	R986-T1004 PolarHBondContact O-N 3.31Å
1005	G	93.3	Very high	92.6	Very high	21 Å²	21	67.5 Å²	67.5	22%	0.216	36%	0.357	C	S	.	.	S	Bend	trans	176.8	172.6	-179.7	0	0	0	0	0	111.8	Y989 K1000	Y989-G1005 WeakPolarHBondContact OH-CA 3.46Å; K1000-G1005 PolarHBondContact NZ-O 3.34Å
1006	P	93.9	Very high	93.1	Very high	48 Å²	48	67.7 Å²	67.7	31%	0.312	35%	0.35	S	S	.	.			trans	-60	154.2	176.2	28	-36.7	0	0	0	111.8	Y989 S1008 I1009 I1044	Y989-P1006 WeakPolarHBondContact CE1-O 3.44Å; Y989-P1006 WeakPolarHBondContact OH-CD 3.31Å; Y989-P1006 PolarHBondContact OH-O 2.94Å; P1006-S1008 PolarHBondContact O-N 3.46Å; P1006-I1009 HydrophobicContact CG-CD1 4.41Å; P1006-I1009 HydrophobicContact CG-CG1 3.88Å; P1006-I1044 HydrophobicContact CG-CD1 4.2Å
1007	K	94.4	Very high	93.6	Very high	185 Å²	185	64.4 Å²	64.4	80%	0.804	34%	0.335	S	S	*	.	S	Bend	trans	-61	-41.4	-177.5	-72.3	-168.4	176.1	-171.7	0	112.9	K1000	K1000-K1007 WeakPolarHBondContact CB-O 3.42Å; K1000-K1007 PolarHBondContact N-O 2.9Å
1008	S	93.9	Very high	93.8	Very high	61 Å²	61	60.3 Å²	60.3	43%	0.427	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	156.2	173	57.7	0	0	0	0	110.8	I998 P1006 M1013	I998-S1008 CarbonylContact O-C 3.52Å; I998-S1008 WeakPolarHBondContact O-CA 3.25Å; P1006-S1008 PolarHBondContact O-N 3.46Å; S1008-M1013 WeakPolarHBondContact O-CE 3.1Å
1009	I	93.8	Very high	93.9	Very high	4 Å²	4	65 Å²	65	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.4	176.9	-63.9	175.9	0	0	0	109.1	L977 Y989 I998 P1006 M1013 I1014 L1042 I1044	L977-I1009 HydrophobicContact CD1-CD1 4.29Å; L977-I1009 HydrophobicContact CD2-CD1 4.27Å; Y989-I1009 HydrophobicContact CD1-CD1 4.04Å; Y989-I1009 HydrophobicContact CD1-CG1 4.28Å; Y989-I1009 HydrophobicContact CD2-CD1 4.25Å; Y989-I1009 HydrophobicContact CE1-CD1 3.59Å; Y989-I1009 HydrophobicContact CE1-CG1 3.7Å; Y989-I1009 HydrophobicContact CE2-CD1 3.81Å; Y989-I1009 HydrophobicContact CG-CD1 4.38Å; Y989-I1009 VanDerWaalsContact CZ-CD1 3.49Å; I998-I1009 HydrophobicContact CB-CB 4.07Å; I998-I1009 WeakPolarHBondContact CB-O 3.47Å; I998-I1009 HydrophobicContact CD1-CB 4.43Å; I998-I1009 HydrophobicContact CD1-CG2 4.26Å; I998-I1009 HydrophobicContact CG2-CB 4.11Å; I998-I1009 PolarHBondContact O-N 2.88Å; P1006-I1009 HydrophobicContact CG-CD1 4.41Å; P1006-I1009 HydrophobicContact CG-CG1 3.88Å; I1009-M1013 HydrophobicContact CG2-CB 4.49Å; I1009-I1014 HydrophobicContact CG2-CD1 4.28Å; I1009-I1014 HydrophobicContact CG2-CG1 3.77Å; I1009-L1042 HydrophobicContact CD1-CD1 3.97Å; I1009-I1044 HydrophobicContact CD1-CG2 3.86Å; I1009-I1044 HydrophobicContact CG1-CG2 4.37Å; I1009-I1044 HydrophobicContact CG2-CG2 4.08Å
1010	S	92.3	Very high	93.9	Very high	59 Å²	59	62.3 Å²	62.3	41%	0.413	32%	0.323	S	S	.	.			trans	-99.4	155	173.6	69.6	0	0	0	0	111	K1012 M1013	S1010-K1012 PolarHBondContact O-N 2.85Å; S1010-M1013 WeakPolarHBondContact O-CB 3.39Å; S1010-M1013 PolarHBondContact O-N 3.11Å
1011	K	91	Very high	93.9	Very high	107 Å²	107	59.4 Å²	59.4	47%	0.465	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-32	178.9	-166.8	171.7	-170.8	163.7	0	114.3	E996 M1013	E996-K1011 IonicContact OE2-NZ 2.58Å; E996-K1011 PolarHBondContact OE2-NZ 2.95Å; K1011-M1013 VanDerWaalsContact C-N 3.32Å; K1011-M1013 PolarHBondContact O-N 2.87Å
1012	K	91	Very high	93.8	Very high	192 Å²	192	58.8 Å²	58.8	84%	0.835	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-17.8	178.2	-64.7	-179.3	-179.8	176.8	0	113.9	S1010	S1010-K1012 PolarHBondContact O-N 2.85Å
1013	M	92.9	Very high	93.6	Very high	46 Å²	46	65.6 Å²	65.6	23%	0.227	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-15.7	-177.8	-68.7	-160	-63.6	0	0	113.7	S1008 I1009 S1010 K1011 I1044 H1045 L1048	S1008-M1013 WeakPolarHBondContact O-CE 3.1Å; I1009-M1013 HydrophobicContact CG2-CB 4.49Å; S1010-M1013 WeakPolarHBondContact O-CB 3.39Å; S1010-M1013 PolarHBondContact O-N 3.11Å; K1011-M1013 VanDerWaalsContact C-N 3.32Å; K1011-M1013 PolarHBondContact O-N 2.87Å; M1013-I1044 CarbonylContact O-C 3.53Å; M1013-I1044 VanDerWaalsContact O-CA 3.28Å; M1013-I1044 WeakPolarHBondContact O-CA 3.49Å; M1013-I1044 WeakPolarHBondContact O-CB 3.3Å; M1013-H1045 VanDerWaalsContact C-ND1 3.35Å; M1013-H1045 PolarHBondContact O-N 3.4Å; M1013-H1045 PolarHBondContact O-ND1 3.36Å; M1013-L1048 HydrophobicContact CB-CD1 3.51Å; M1013-L1048 HydrophobicContact CG-CD1 3.68Å; M1013-L1048 HydrophobicContact CG-CD2 4.48Å; M1013-L1048 HydrophobicContact SD-CD1 3.75Å; M1013-L1048 HydrophobicContact SD-CD2 3.88Å; M1013-L1048 HydrophobicContact SD-CG 4.47Å
1014	I	93.6	Very high	93.6	Very high	16 Å²	16	71.3 Å²	71.3	8%	0.082	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	135.3	-176.8	-56.8	172.7	0	0	0	110.9	I998 I1009 L1017 V1035 L1042 T1043 H1045	I998-I1014 HydrophobicContact CD1-CD1 3.9Å; I1009-I1014 HydrophobicContact CG2-CD1 4.28Å; I1009-I1014 HydrophobicContact CG2-CG1 3.77Å; I1014-L1017 HydrophobicContact CG2-CD1 3.53Å; I1014-L1017 HydrophobicContact CG2-CG 4.06Å; I1014-V1035 HydrophobicContact CD1-CG2 3.42Å; I1014-V1035 VanDerWaalsContact CD1-CG2 3.42Å; I1014-L1042 HydrophobicContact CD1-CD2 4.07Å; I1014-L1042 HydrophobicContact CG1-CD2 4.36Å; I1014-L1042 HydrophobicContact CG2-CB 4.22Å; I1014-T1043 CarbonylContact C-O 3.57Å; I1014-T1043 WeakPolarHBondContact CA-O 3.47Å; I1014-T1043 WeakPolarHBondContact CG2-O 3.36Å; I1014-H1045 PolarHBondContact O-CE1 3.35Å; I1014-H1045 PolarHBondContact O-ND1 3.47Å
1015	D	93.1	Very high	93.6	Very high	66 Å²	66	71.7 Å²	71.7	35%	0.353	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-61.8	172.9	161.1	53.2	0	0	0	110.7	T1043	D1015-T1043 PolarHBondContact N-O 3.16Å; D1015-T1043 PolarHBondContact OD2-OG1 2.94Å
1016	K	94.5	Very high	93.6	Very high	89 Å²	89	74.7 Å²	74.7	39%	0.387	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.2	-177.4	-66.9	165.6	-168.5	96	0	111.5	Y1018 L1042 T1043	K1016-Y1018 HydrophobicContact CB-CD2 4.47Å; K1016-Y1018 HydrophobicContact CB-CE2 3.69Å; K1016-L1042 CarbonylContact O-C 3.47Å; K1016-L1042 WeakPolarHBondContact O-CA 3.22Å; K1016-T1043 WeakPolarHBondContact CB-OG1 3.08Å; K1016-T1043 PolarHBondContact N-OG1 3.46Å; K1016-T1043 PolarHBondContact O-N 3.4Å; K1016-T1043 PolarHBondContact O-OG1 2.86Å
1017	L	95.6	Very high	93.7	Very high	8 Å²	8	73.3 Å²	73.3	4%	0.042	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	144.6	179.3	-68.1	79	0	0	0	109	I1014 V1029 I1030 T1034 V1035 V1039	I1014-L1017 HydrophobicContact CG2-CD1 3.53Å; I1014-L1017 HydrophobicContact CG2-CG 4.06Å; L1017-V1029 WeakPolarHBondContact O-CA 3.25Å; L1017-I1030 PolarHBondContact O-N 3.31Å; L1017-T1034 WeakPolarHBondContact CD2-O 3.27Å; L1017-V1035 HydrophobicContact CD2-CG2 4.12Å; L1017-V1039 HydrophobicContact CB-CG1 3.86Å; L1017-V1039 HydrophobicContact CD2-CG1 4.2Å; L1017-V1039 HydrophobicContact CD2-CG2 4.11Å; L1017-V1039 HydrophobicContact CG-CG1 4.3Å
1018	Y	95.7	Very high	93.7	Very high	10 Å²	10	66.1 Å²	66.1	4%	0.039	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	142.7	-171.5	-68.5	-99.2	0	0	0	111.5	F978 G981 K1016 F1027 T1028 V1029 V1039 D1040 A1041 T1043	F978-Y1018 HydrophobicContact CD2-CD2 4.33Å; F978-Y1018 HydrophobicContact CE2-CG 4.43Å; G981-Y1018 WeakPolarHBondContact CA-OH 3.43Å; K1016-Y1018 HydrophobicContact CB-CD2 4.47Å; K1016-Y1018 HydrophobicContact CB-CE2 3.69Å; Y1018-F1027 HydrophobicContact CD1-CB 3.95Å; Y1018-T1028 WeakPolarHBondContact CA-O 3.46Å; Y1018-V1029 HydrophobicContact CD1-CG2 4Å; Y1018-V1029 HydrophobicContact CE1-CB 4.47Å; Y1018-V1029 HydrophobicContact CE1-CG2 3.42Å; Y1018-V1029 VanDerWaalsContact CE1-CG2 3.42Å; Y1018-V1039 WeakPolarHBondContact O-CG1 3.37Å; Y1018-D1040 PolarHBondContact O-N 2.92Å; Y1018-A1041 PolarHBondContact N-O 3.48Å; Y1018-A1041 PolarHBondContact O-N 3.28Å; Y1018-A1041 VanDerWaalsContact O-N 3.08Å; Y1018-T1043 HydrophobicContact CE2-CG2 3.89Å
1019	K	95.6	Very high	93.8	Very high	102 Å²	102	67.2 Å²	67.2	44%	0.443	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	139.2	169.1	-174.1	169.3	63	-178.4	0	110	F1027 T1028 I1030 D1040	K1019-F1027 WeakPolarHBondContact O-CA 3.13Å; K1019-T1028 PolarHBondContact N-O 3.28Å; K1019-T1028 PolarHBondContact O-N 2.83Å; K1019-T1028 PolarHBondContact O-OG1 3.24Å; K1019-T1028 VanDerWaalsContact O-OG1 3.11Å; K1019-I1030 HydrophobicContact CB-CD1 3.92Å; K1019-I1030 HydrophobicContact CB-CG1 4.02Å; K1019-D1040 WeakPolarHBondContact CG-OD2 3.47Å
1020	Y	96.2	Very high	93.8	Very high	10 Å²	10	68.8 Å²	68.8	4%	0.039	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	128.7	174	-175.6	-114.4	0	0	0	110.5	I940 N943 A944 C948 F1027 D1040	I940-Y1020 HydrophobicContact CG2-CD1 3.71Å; I940-Y1020 HydrophobicContact CG2-CG 4.35Å; N943-Y1020 HydrophobicContact CB-CE1 4.29Å; N943-Y1020 WeakPolarHBondContact OD1-CE1 3.27Å; N943-Y1020 PolarHBondContact OD1-OH 2.88Å; A944-Y1020 HydrophobicContact CB-CD1 3.89Å; A944-Y1020 HydrophobicContact CB-CD2 3.57Å; A944-Y1020 HydrophobicContact CB-CE1 3.89Å; A944-Y1020 HydrophobicContact CB-CE2 3.6Å; A944-Y1020 HydrophobicContact CB-CG 3.71Å; C948-Y1020 HydrophobicContact CB-CE2 3.9Å; Y1020-F1027 HydrophobicContact CD2-CD1 4.36Å; Y1020-F1027 HydrophobicContact CD2-CD2 4.1Å; Y1020-F1027 HydrophobicContact CD2-CE1 4.08Å; Y1020-F1027 AromaticContact CD2-CE2 3.77Å; Y1020-F1027 HydrophobicContact CD2-CE2 3.77Å; Y1020-F1027 HydrophobicContact CD2-CG 4.39Å; Y1020-F1027 AromaticContact CD2-CZ 3.79Å; Y1020-F1027 HydrophobicContact CD2-CZ 3.79Å; Y1020-F1027 HydrophobicContact CE2-CE2 4.25Å; Y1020-F1027 HydrophobicContact CG-CE1 4.41Å; Y1020-F1027 HydrophobicContact CG-CZ 4.41Å; Y1020-D1040 PolarHBondContact N-OD2 3.03Å
1021	S	94.7	Very high	93.7	Very high	13 Å²	13	72.3 Å²	72.3	9%	0.091	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	92.7	171.7	-63.1	0	0	0	0	109	D1023 R1024 K1025 Q1026	S1021-D1023 PolarHBondContact O-N 3.11Å; S1021-D1023 VanDerWaalsContact O-N 3.16Å; S1021-R1024 CarbonylContact O-C 3.58Å; S1021-R1024 PolarHBondContact O-N 2.63Å; S1021-R1024 PolarHBondContact OG-NH2 3.13Å; S1021-K1025 WeakPolarHBondContact O-CA 3.25Å; S1021-K1025 PolarHBondContact O-N 3.46Å; S1021-Q1026 PolarHBondContact N-O 3.08Å; S1021-Q1026 PolarHBondContact O-N 3.38Å
1022	S	92.3	Very high	93.6	Very high	49 Å²	49	69 Å²	69	34%	0.343	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-51	-39.8	-179.1	-58.8	0	0	0	0	113.4	R1024 K1025	S1022-R1024 PolarHBondContact O-N 2.69Å; S1022-K1025 WeakPolarHBondContact O-CG 3.22Å; S1022-K1025 PolarHBondContact O-N 3.1Å
1023	D	91.8	Very high	93.3	Very high	159 Å²	159	69.2 Å²	69.2	85%	0.85	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-62.1	-32.1	-179.1	-37.7	-47.5	0	0	0	112.9	S1021	S1021-D1023 PolarHBondContact O-N 3.11Å; S1021-D1023 VanDerWaalsContact O-N 3.16Å
1024	R	92.1	Very high	93.1	Very high	151 Å²	151	70.8 Å²	70.8	57%	0.57	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-105.7	-5.4	-179.6	-67.3	-178	-66.8	-153.5	-3.5	113.1	S1021 S1022 Q1026	S1021-R1024 CarbonylContact O-C 3.58Å; S1021-R1024 PolarHBondContact O-N 2.63Å; S1021-R1024 PolarHBondContact OG-NH2 3.13Å; S1022-R1024 PolarHBondContact O-N 2.69Å; R1024-Q1026 HydrophobicContact CB-CB 4.46Å; R1024-Q1026 HydrophobicContact CB-CG 3.74Å; R1024-Q1026 PolarHBondContact O-N 3.42Å; R1024-Q1026 VanDerWaalsContact O-N 3.14Å
1025	K	93.8	Very high	92.9	Very high	110 Å²	110	71 Å²	71	48%	0.478	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	35.8	-172.8	-56.5	-177	178.4	-172.1	0	113.6	H947 C948 S1021 S1022	H947-K1025 HydrophobicContact CB-CD 4.25Å; C948-K1025 PolarHBondContact SG-O 3.33Å; S1021-K1025 WeakPolarHBondContact O-CA 3.25Å; S1021-K1025 PolarHBondContact O-N 3.46Å; S1022-K1025 WeakPolarHBondContact O-CG 3.22Å; S1022-K1025 PolarHBondContact O-N 3.1Å
1026	Q	93.8	Very high	92.8	Very high	84 Å²	84	69.8 Å²	69.8	39%	0.393	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	153.2	-175.6	78.6	-177.1	67.1	0	0	111.5	S1021 R1024 T1028	S1021-Q1026 PolarHBondContact N-O 3.08Å; S1021-Q1026 PolarHBondContact O-N 3.38Å; R1024-Q1026 HydrophobicContact CB-CB 4.46Å; R1024-Q1026 HydrophobicContact CB-CG 3.74Å; R1024-Q1026 PolarHBondContact O-N 3.42Å; R1024-Q1026 VanDerWaalsContact O-N 3.14Å; Q1026-T1028 HydrophobicContact CG-CG2 4.37Å
1027	F	95.5	Very high	92.6	Very high	18 Å²	18	68.4 Å²	68.4	8%	0.079	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	144.4	167.7	-68.1	-92.7	0	0	0	111.1	A944 C948 C949 I976 F978 Y1018 K1019 Y1020 D1040 A1041	A944-F1027 HydrophobicContact CB-CE2 4.23Å; A944-F1027 HydrophobicContact CB-CZ 3.66Å; C948-F1027 HydrophobicContact CB-CE2 4.12Å; C949-F1027 VanDerWaalsContact SG-CE2 3.54Å; I976-F1027 HydrophobicContact CD1-CZ 3.98Å; F978-F1027 HydrophobicContact CE1-CE2 4.46Å; F978-F1027 HydrophobicContact CE2-CB 4.37Å; F978-F1027 AromaticContact CE2-CD1 3.91Å; F978-F1027 HydrophobicContact CE2-CD1 3.91Å; F978-F1027 HydrophobicContact CE2-CD2 4.16Å; F978-F1027 HydrophobicContact CE2-CE1 4.21Å; F978-F1027 HydrophobicContact CE2-CE2 4.47Å; F978-F1027 AromaticContact CE2-CG 3.87Å; F978-F1027 HydrophobicContact CE2-CG 3.87Å; F978-F1027 HydrophobicContact CE2-CZ 4.46Å; F978-F1027 AromaticContact CZ-CD1 3.93Å; F978-F1027 HydrophobicContact CZ-CD1 3.93Å; F978-F1027 AromaticContact CZ-CD2 3.66Å; F978-F1027 HydrophobicContact CZ-CD2 3.66Å; F978-F1027 AromaticContact CZ-CE1 3.85Å; F978-F1027 HydrophobicContact CZ-CE1 3.85Å; F978-F1027 AromaticContact CZ-CE2 3.6Å; F978-F1027 HydrophobicContact CZ-CE2 3.6Å; F978-F1027 AromaticContact CZ-CG 3.81Å; F978-F1027 HydrophobicContact CZ-CG 3.81Å; F978-F1027 AromaticContact CZ-CZ 3.67Å; F978-F1027 HydrophobicContact CZ-CZ 3.67Å; Y1018-F1027 HydrophobicContact CD1-CB 3.95Å; K1019-F1027 WeakPolarHBondContact O-CA 3.13Å; Y1020-F1027 HydrophobicContact CD2-CD1 4.36Å; Y1020-F1027 HydrophobicContact CD2-CD2 4.1Å; Y1020-F1027 HydrophobicContact CD2-CE1 4.08Å; Y1020-F1027 AromaticContact CD2-CE2 3.77Å; Y1020-F1027 HydrophobicContact CD2-CE2 3.77Å; Y1020-F1027 HydrophobicContact CD2-CG 4.39Å; Y1020-F1027 AromaticContact CD2-CZ 3.79Å; Y1020-F1027 HydrophobicContact CD2-CZ 3.79Å; Y1020-F1027 HydrophobicContact CE2-CE2 4.25Å; Y1020-F1027 HydrophobicContact CG-CE1 4.41Å; Y1020-F1027 HydrophobicContact CG-CZ 4.41Å; F1027-D1040 HydrophobicContact CE1-CB 4.42Å; F1027-A1041 HydrophobicContact CD1-CB 3.85Å; F1027-A1041 HydrophobicContact CE1-CB 3.63Å
1028	T	94.8	Very high	92.3	Very high	35 Å²	35	71 Å²	71	22%	0.215	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.2	176.3	49.2	0	0	0	0	109.7	Y1018 K1019 Q1026	Y1018-T1028 WeakPolarHBondContact CA-O 3.46Å; K1019-T1028 PolarHBondContact N-O 3.28Å; K1019-T1028 PolarHBondContact O-N 2.83Å; K1019-T1028 PolarHBondContact O-OG1 3.24Å; K1019-T1028 VanDerWaalsContact O-OG1 3.11Å; Q1026-T1028 HydrophobicContact CG-CG2 4.37Å
1029	V	95.1	Very high	92.3	Very high	84 Å²	84	70.7 Å²	70.7	51%	0.509	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	134.1	175.7	-178.7	0	0	0	0	109.7	L1017 Y1018	L1017-V1029 WeakPolarHBondContact O-CA 3.25Å; Y1018-V1029 HydrophobicContact CD1-CG2 4Å; Y1018-V1029 HydrophobicContact CE1-CB 4.47Å; Y1018-V1029 HydrophobicContact CE1-CG2 3.42Å; Y1018-V1029 VanDerWaalsContact CE1-CG2 3.42Å
1030	I	93.9	Very high	92.3	Very high	36 Å²	36	66.1 Å²	66.1	19%	0.185	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.8	171.5	-46	169.4	0	0	0	107.2	L1017 K1019 A1032 V1039	L1017-I1030 PolarHBondContact O-N 3.31Å; K1019-I1030 HydrophobicContact CB-CD1 3.92Å; K1019-I1030 HydrophobicContact CB-CG1 4.02Å; I1030-A1032 HydrophobicContact CG2-CB 3.83Å; I1030-A1032 PolarHBondContact O-N 3.48Å; I1030-A1032 VanDerWaalsContact O-N 3.08Å; I1030-V1039 HydrophobicContact CD1-CB 4.24Å; I1030-V1039 HydrophobicContact CD1-CG1 4.13Å; I1030-V1039 HydrophobicContact CD1-CG2 3.77Å
1031	P	91.4	Very high	92.3	Very high	133 Å²	133	65.7 Å²	65.7	86%	0.864	36%	0.357	S	S	*	.			trans	-73.8	8.4	178.3	31	-36.2	0	0	0	114.2
1032	A	87.9	Confident	92.3	Very high	39 Å²	39	65 Å²	65	32%	0.322	35%	0.353	S	S	.	.			trans	-82.4	147.1	-179.9	0	0	0	0	0	111.9	I1030	I1030-A1032 HydrophobicContact CG2-CB 3.83Å; I1030-A1032 PolarHBondContact O-N 3.48Å; I1030-A1032 VanDerWaalsContact O-N 3.08Å
1033	K	84.8	Confident	92.5	Very high	195 Å²	195	62.8 Å²	62.8	85%	0.848	34%	0.337	S	S	*	.	S	Bend	trans	-100.7	-1	172.7	-61.9	-178.5	-178.9	178.1	0	113.3
1034	T	88.2	Confident	92.7	Very high	80 Å²	80	55.3 Å²	55.3	49%	0.491	30%	0.297	S	S	.	.	S	Bend	trans	-103.8	128.8	179.5	39	0	0	0	0	109.9	L1017	L1017-T1034 WeakPolarHBondContact CD2-O 3.27Å
1035	V	90.9	Very high	92.8	Very high	19 Å²	19	51.4 Å²	51.4	12%	0.115	29%	0.285	C	S	.	.			trans	-67	141.6	166.8	-174.7	0	0	0	0	108	M975 Y991 I998 I1014 L1017	M975-V1035 HydrophobicContact CE-CG1 4.03Å; M975-V1035 HydrophobicContact SD-CG1 3.88Å; Y991-V1035 HydrophobicContact CD2-CG1 4.01Å; Y991-V1035 HydrophobicContact CE1-CG1 4.17Å; Y991-V1035 HydrophobicContact CE2-CB 4.33Å; Y991-V1035 HydrophobicContact CE2-CG1 3.61Å; Y991-V1035 HydrophobicContact CG-CG1 4.42Å; I998-V1035 HydrophobicContact CD1-CG1 4.38Å; I998-V1035 HydrophobicContact CD1-CG2 4.2Å; I1014-V1035 HydrophobicContact CD1-CG2 3.42Å; I1014-V1035 VanDerWaalsContact CD1-CG2 3.42Å; L1017-V1035 HydrophobicContact CD2-CG2 4.12Å
1036	S	90	Very high	92.7	Very high	41 Å²	41	50 Å²	50	29%	0.287	28%	0.282	S	S	.	.			trans	-153.8	166	178	66.7	0	0	0	0	109.8	S1038 V1039	S1036-S1038 PolarHBondContact O-N 3.09Å; S1036-S1038 PolarHBondContact OG-OG 3.1Å; S1036-V1039 WeakPolarHBondContact O-CB 3.31Å; S1036-V1039 WeakPolarHBondContact O-CG2 3.13Å; S1036-V1039 PolarHBondContact O-N 2.83Å; S1036-V1039 VanDerWaalsContact O-N 3.09Å
1037	V	90	Very high	92.5	Very high	60 Å²	60	51.9 Å²	51.9	36%	0.364	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-3.8	176.4	-59.7	0	0	0	0	115.1	H973 P993	H973-V1037 WeakPolarHBondContact NE2-CG1 3.45Å; P993-V1037 HydrophobicContact CB-CG1 4.17Å
1038	S	90.7	Very high	92.3	Very high	62 Å²	62	54 Å²	54	43%	0.434	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	7.3	177.7	71.6	0	0	0	0	114.4	S1036	S1036-S1038 PolarHBondContact O-N 3.09Å; S1036-S1038 PolarHBondContact OG-OG 3.1Å
1039	V	94.4	Very high	92.1	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.024	30%	0.304	C	S	.	.			trans	-109.6	121.7	-176.9	-170.5	0	0	0	0	109	M975 L1017 Y1018 I1030 S1036 A1041	M975-V1039 HydrophobicContact CE-CB 3.72Å; M975-V1039 HydrophobicContact CE-CG1 3.4Å; L1017-V1039 HydrophobicContact CB-CG1 3.86Å; L1017-V1039 HydrophobicContact CD2-CG1 4.2Å; L1017-V1039 HydrophobicContact CD2-CG2 4.11Å; L1017-V1039 HydrophobicContact CG-CG1 4.3Å; Y1018-V1039 WeakPolarHBondContact O-CG1 3.37Å; I1030-V1039 HydrophobicContact CD1-CB 4.24Å; I1030-V1039 HydrophobicContact CD1-CG1 4.13Å; I1030-V1039 HydrophobicContact CD1-CG2 3.77Å; S1036-V1039 WeakPolarHBondContact O-CB 3.31Å; S1036-V1039 WeakPolarHBondContact O-CG2 3.13Å; S1036-V1039 PolarHBondContact O-N 2.83Å; S1036-V1039 VanDerWaalsContact O-N 3.09Å; V1039-A1041 WeakPolarHBondContact CG1-O 3.45Å
1040	D	95.7	Very high	91.6	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.037	31%	0.313	C	S	.	.			trans	-100.5	-20.5	-175.4	-58.3	-59.9	0	0	0	113	N937 I941 M975 I976 Y1018 K1019 Y1020 F1027	N937-D1040 PolarHBondContact ND2-OD1 3.25Å; I941-D1040 HydrophobicContact CD1-CB 3.8Å; I941-D1040 VanDerWaalsContact CD1-O 3.29Å; I941-D1040 WeakPolarHBondContact CD1-O 3.4Å; M975-D1040 WeakPolarHBondContact CA-O 3.43Å; I976-D1040 PolarHBondContact N-O 3.49Å; Y1018-D1040 PolarHBondContact O-N 2.92Å; K1019-D1040 WeakPolarHBondContact CG-OD2 3.47Å; Y1020-D1040 PolarHBondContact N-OD2 3.03Å; F1027-D1040 HydrophobicContact CE1-CB 4.42Å
1041	A	96.1	Very high	90.4	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	161.8	179.5	0	0	0	0	0	112.7	I976 F978 Y1018 F1027 V1039	I976-A1041 HydrophobicContact CB-CB 3.9Å; I976-A1041 CarbonylContact O-C 3.54Å; I976-A1041 WeakPolarHBondContact O-CA 3.18Å; I976-A1041 WeakPolarHBondContact O-CB 3.33Å; F978-A1041 HydrophobicContact CD2-CB 3.97Å; F978-A1041 HydrophobicContact CE2-CB 3.37Å; F978-A1041 HydrophobicContact CZ-CB 3.8Å; Y1018-A1041 PolarHBondContact N-O 3.48Å; Y1018-A1041 PolarHBondContact O-N 3.28Å; Y1018-A1041 VanDerWaalsContact O-N 3.08Å; F1027-A1041 HydrophobicContact CD1-CB 3.85Å; F1027-A1041 HydrophobicContact CE1-CB 3.63Å; V1039-A1041 WeakPolarHBondContact CG1-O 3.45Å
1042	L	96	Very high	89	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	161.6	179.5	65	83	0	0	0	112.3	M975 I976 L977 F978 I998 I1009 I1014 K1016 I1044	M975-L1042 HydrophobicContact CE-CB 4.47Å; M975-L1042 HydrophobicContact CE-CD2 3.85Å; M975-L1042 HydrophobicContact SD-CD2 4.03Å; I976-L1042 PolarHBondContact O-N 3.02Å; L977-L1042 HydrophobicContact CD1-CD1 3.59Å; F978-L1042 PolarHBondContact N-O 3.32Å; I998-L1042 HydrophobicContact CD1-CD2 3.96Å; I1009-L1042 HydrophobicContact CD1-CD1 3.97Å; I1014-L1042 HydrophobicContact CD1-CD2 4.07Å; I1014-L1042 HydrophobicContact CG1-CD2 4.36Å; I1014-L1042 HydrophobicContact CG2-CB 4.22Å; K1016-L1042 CarbonylContact O-C 3.47Å; K1016-L1042 WeakPolarHBondContact O-CA 3.22Å; L1042-I1044 HydrophobicContact CD1-CG2 3.86Å
1043	T	95.6	Very high	87.3	Confident	1 Å²	1	73.6 Å²	73.6	1%	0.006	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	150.8	163.3	52.5	0	0	0	0	110.1	F978 I1014 D1015 K1016 Y1018	F978-T1043 HydrophobicContact CB-CG2 3.85Å; I1014-T1043 CarbonylContact C-O 3.57Å; I1014-T1043 WeakPolarHBondContact CA-O 3.47Å; I1014-T1043 WeakPolarHBondContact CG2-O 3.36Å; D1015-T1043 PolarHBondContact N-O 3.16Å; D1015-T1043 PolarHBondContact OD2-OG1 2.94Å; K1016-T1043 WeakPolarHBondContact CB-OG1 3.08Å; K1016-T1043 PolarHBondContact N-OG1 3.46Å; K1016-T1043 PolarHBondContact O-N 3.4Å; K1016-T1043 PolarHBondContact O-OG1 2.86Å; Y1018-T1043 HydrophobicContact CE2-CG2 3.89Å
1044	I	95.1	Very high	85.6	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.01	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	154.9	170.7	65.2	-179.3	0	0	0	111.4	L977 P1006 I1009 M1013 L1042 L1048 W1049	L977-I1044 HydrophobicContact CD1-CB 4.45Å; L977-I1044 HydrophobicContact CD1-CD1 4.39Å; L977-I1044 HydrophobicContact CD1-CG1 4.12Å; L977-I1044 HydrophobicContact CD1-CG2 3.87Å; L977-I1044 HydrophobicContact CD2-CD1 4.38Å; P1006-I1044 HydrophobicContact CG-CD1 4.2Å; I1009-I1044 HydrophobicContact CD1-CG2 3.86Å; I1009-I1044 HydrophobicContact CG1-CG2 4.37Å; I1009-I1044 HydrophobicContact CG2-CG2 4.08Å; M1013-I1044 CarbonylContact O-C 3.53Å; M1013-I1044 VanDerWaalsContact O-CA 3.28Å; M1013-I1044 WeakPolarHBondContact O-CA 3.49Å; M1013-I1044 WeakPolarHBondContact O-CB 3.3Å; L1042-I1044 HydrophobicContact CD1-CG2 3.86Å; I1044-L1048 HydrophobicContact CB-CD1 4.08Å; I1044-L1048 HydrophobicContact CD1-CB 4.13Å; I1044-L1048 HydrophobicContact CD1-CD1 4.48Å; I1044-L1048 HydrophobicContact CG1-CB 4.5Å; I1044-W1049 HydrophobicContact CD1-CD2 4.33Å; I1044-W1049 HydrophobicContact CD1-CH2 4.41Å; I1044-W1049 HydrophobicContact CD1-CZ2 3.89Å; I1044-W1049 HydrophobicContact CG1-CD2 4.48Å; I1044-W1049 HydrophobicContact CG1-CZ2 3.84Å
1045	H	94.4	Very high	83.8	Confident	69 Å²	69	69.9 Å²	69.9	32%	0.319	38%	0.376	S	S	.	.			trans	-54.4	138.1	-178.5	-75.3	78.4	0	0	0	112.6	M1013 I1014 H1047 L1048	M1013-H1045 VanDerWaalsContact C-ND1 3.35Å; M1013-H1045 PolarHBondContact O-N 3.4Å; M1013-H1045 PolarHBondContact O-ND1 3.36Å; I1014-H1045 PolarHBondContact O-CE1 3.35Å; I1014-H1045 PolarHBondContact O-ND1 3.47Å; H1045-H1047 VanDerWaalsContact CB-CE1 3.46Å; H1045-H1047 WeakPolarHBondContact CB-CE1 3.29Å; H1045-H1047 AromaticContact CG-CE1 3.95Å; H1045-H1047 PolarHBondContact O-N 2.98Å; H1045-L1048 HydrophobicContact CB-CD1 4.18Å; H1045-L1048 HydrophobicContact CB-CG 4.49Å; H1045-L1048 WeakPolarHBondContact O-CB 3.49Å; H1045-L1048 PolarHBondContact O-N 3.25Å
1046	N	92	Very high	81.7	Confident	80 Å²	80	74.8 Å²	74.8	43%	0.428	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-59.7	-22.7	-172.7	-105.9	-70.6	0	0	0	115.2	R979 D980 L1048 W1049	R979-N1046 PolarHBondContact NH1-OD1 3.02Å; R979-N1046 PolarHBondContact NH2-OD1 2.92Å; D980-N1046 PolarHBondContact OD1-ND2 3.08Å; N1046-L1048 VanDerWaalsContact C-N 3.28Å; N1046-L1048 PolarHBondContact O-N 2.98Å; N1046-W1049 PolarHBondContact O-N 3.49Å
1047	H	90.8	Very high	80	Confident	124 Å²	124	78.2 Å²	78.2	57%	0.574	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-70.6	-20.2	175.8	67.2	-104.8	0	0	0	113.7	H1045	H1045-H1047 VanDerWaalsContact CB-CE1 3.46Å; H1045-H1047 WeakPolarHBondContact CB-CE1 3.29Å; H1045-H1047 AromaticContact CG-CE1 3.95Å; H1045-H1047 PolarHBondContact O-N 2.98Å
1048	L	90.8	Very high	78.4	Confident	64 Å²	64	84.8 Å²	84.8	34%	0.335	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-81.1	-19.6	-179.8	-60.5	167.6	0	0	0	112.8	M1013 I1044 H1045 N1046 Q1050	M1013-L1048 HydrophobicContact CB-CD1 3.51Å; M1013-L1048 HydrophobicContact CG-CD1 3.68Å; M1013-L1048 HydrophobicContact CG-CD2 4.48Å; M1013-L1048 HydrophobicContact SD-CD1 3.75Å; M1013-L1048 HydrophobicContact SD-CD2 3.88Å; M1013-L1048 HydrophobicContact SD-CG 4.47Å; I1044-L1048 HydrophobicContact CB-CD1 4.08Å; I1044-L1048 HydrophobicContact CD1-CB 4.13Å; I1044-L1048 HydrophobicContact CD1-CD1 4.48Å; I1044-L1048 HydrophobicContact CG1-CB 4.5Å; H1045-L1048 HydrophobicContact CB-CD1 4.18Å; H1045-L1048 HydrophobicContact CB-CG 4.49Å; H1045-L1048 WeakPolarHBondContact O-CB 3.49Å; H1045-L1048 PolarHBondContact O-N 3.25Å; N1046-L1048 VanDerWaalsContact C-N 3.28Å; N1046-L1048 PolarHBondContact O-N 2.98Å; L1048-Q1050 VanDerWaalsContact C-N 3.34Å
1049	W	89.3	Confident	76.7	Confident	59 Å²	59	91.8 Å²	91.8	22%	0.223	47%	0.474	C	S	.	.	S	Bend	trans	-81.1	-14.1	172.9	-65.4	112.9	0	0	0	113.1	L977 R979 R986 I1044 N1046	L977-W1049 HydrophobicContact CD1-CZ2 4.07Å; L977-W1049 HydrophobicContact CD2-CH2 3.56Å; L977-W1049 HydrophobicContact CD2-CZ2 3.91Å; L977-W1049 HydrophobicContact CG-CH2 4.02Å; L977-W1049 HydrophobicContact CG-CZ2 4.02Å; R979-W1049 VanDerWaalsContact CZ-CD1 3.44Å; R979-W1049 PolarHBondContact O-NE1 3.2Å; R986-W1049 HydrophobicContact CB-CH2 3.8Å; R986-W1049 HydrophobicContact CG-CH2 3.81Å; R986-W1049 HydrophobicContact CG-CZ2 4.37Å; R986-W1049 HydrophobicContact CG-CZ3 4.42Å; I1044-W1049 HydrophobicContact CD1-CD2 4.33Å; I1044-W1049 HydrophobicContact CD1-CH2 4.41Å; I1044-W1049 HydrophobicContact CD1-CZ2 3.89Å; I1044-W1049 HydrophobicContact CG1-CD2 4.48Å; I1044-W1049 HydrophobicContact CG1-CZ2 3.84Å; N1046-W1049 PolarHBondContact O-N 3.49Å
1050	Q	85.8	Confident	74.8	Confident	151 Å²	151	98 Å²	98	71%	0.706	51%	0.512	S	S	*	.	S	Bend	trans	-87.6	132.4	171.9	-61.7	-163.7	10	0	0	109.4	L1048 K1052	L1048-Q1050 VanDerWaalsContact C-N 3.34Å; Q1050-K1052 PolarHBondContact O-N 2.98Å
1051	A	69.6	Low	72.9	Confident	97 Å²	97	101.2 Å²	101.2	80%	0.802	55%	0.547	S	S	*	.			trans	-60.9	106.6	173.7	0	0	0	0	0	109.2	R1053	A1051-R1053 VanDerWaalsContact C-N 3.28Å; A1051-R1053 PolarHBondContact O-N 3.16Å
1052	K	60.7	Low	70.5	Confident	196 Å²	196	114.7 Å²	114.7	85%	0.852	61%	0.605	S	S	*	*			trans	-63.7	91	174.6	-176.8	-174.7	179.3	-176.4	0	108.3	Q1050 S1054	Q1050-K1052 PolarHBondContact O-N 2.98Å; K1052-S1054 PolarHBondContact O-N 3.1Å
1053	R	52.2	Low	69.2	Low	234 Å²	234	120.4 Å²	120.4	88%	0.883	64%	0.635	S	S	*	*			trans	-50.1	114.9	165.4	-75	-168.9	-74.8	178.3	-4.3	106.7	A1051 A1055	A1051-R1053 VanDerWaalsContact C-N 3.28Å; A1051-R1053 PolarHBondContact O-N 3.16Å; R1053-A1055 PolarHBondContact O-N 3.27Å
1054	S	49.8	Very low	67.9	Low	103 Å²	103	126.7 Å²	126.7	72%	0.72	67%	0.668	S	S	*	*			trans	-63.5	103.9	-179.5	30.2	0	0	0	0	108.1	K1052 V1056	K1052-S1054 PolarHBondContact O-N 3.1Å; S1054-V1056 VanDerWaalsContact C-N 3.31Å; S1054-V1056 PolarHBondContact O-N 2.87Å
1055	A	50	Low	66.3	Low	94 Å²	94	133.6 Å²	133.6	78%	0.777	71%	0.705	S	S	*	*			trans	-62.5	100.2	166.1	0	0	0	0	0	106.9	R1053	R1053-A1055 PolarHBondContact O-N 3.27Å
1056	V	46	Very low	64.7	Low	122 Å²	122	137.4 Å²	137.4	74%	0.739	73%	0.728	S	S	*	*			trans	-51.3	126.5	174.8	177.6	0	0	0	0	107.1	S1054 K1058	S1054-V1056 VanDerWaalsContact C-N 3.31Å; S1054-V1056 PolarHBondContact O-N 2.87Å; V1056-K1058 PolarHBondContact O-N 3.44Å
1057	P	54.7	Low	63	Low	114 Å²	114	141 Å²	141	74%	0.74	75%	0.746	S	S	*	*			trans	-59.7	118.2	-179.5	24.1	-32.8	0	0	0	108.3	K1059	P1057-K1059 PolarHBondContact O-N 3.35Å
1058	K	55.9	Low	61.1	Low	198 Å²	198	142.1 Å²	142.1	86%	0.861	76%	0.758	S	S	*	*			trans	-60.7	109.2	174.7	-76	-169.9	175.2	-173	0	107.5	V1056 T1060	V1056-K1058 PolarHBondContact O-N 3.44Å; K1058-T1060 PolarHBondContact O-N 3.44Å
1059	K	56.3	Low	59	Low	209 Å²	209	147.7 Å²	147.7	91%	0.909	79%	0.788	S	S	*	*			trans	-56.6	100.3	177.6	-171.3	178.6	-177.1	-177.9	0	108.5	P1057 G1061	P1057-K1059 PolarHBondContact O-N 3.35Å; K1059-G1061 PolarHBondContact O-N 2.83Å; K1059-G1061 VanDerWaalsContact O-N 3.08Å
1060	T	53.4	Low	56.7	Low	134 Å²	134	154.5 Å²	154.5	82%	0.822	83%	0.832	S	S	*	*			trans	-71.3	102.2	178.2	46.7	0	0	0	0	108.3	K1058 K1062	K1058-T1060 PolarHBondContact O-N 3.44Å; T1060-K1062 PolarHBondContact O-N 2.97Å
1061	G	56.6	Low	54.3	Low	75 Å²	75	154.8 Å²	154.8	77%	0.773	84%	0.842	S	S	*	*			trans	-65.2	126.4	173.1	0	0	0	0	0	111.1	K1059	K1059-G1061 PolarHBondContact O-N 2.83Å; K1059-G1061 VanDerWaalsContact O-N 3.08Å
1062	K	46	Very low	52.9	Low	282 Å²	282	160.1 Å²	160.1	100%	1.226	85%	0.846	S	S	*	*			trans	-143.5	0	155.7	-96.4	-164.2	170.7	-170	0	107	T1060	T1060-K1062 PolarHBondContact O-N 2.97Å

Retrieved 1,062 of 1,062 residues in 711.1 ms (Link to these results)

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